smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name Cc1sc2nc(C[NH+]3CCCC3)nc(N3CCC4(CC(=O)CO4)CC3)c2c1C ZINC001164388337 718827787 /nfs/dbraw/zinc/82/77/87/718827787.db2.gz AQABKBCEMARKPO-UHFFFAOYSA-N 1 1 400.548 3.232 20 0 HGADMO O=C1Nc2ccccc2[C@H]2CN(c3ncnc4c3CC[N@H+](Cc3ccccc3)C4)C[C@H]12 ZINC001164403210 718856576 /nfs/dbraw/zinc/85/65/76/718856576.db2.gz ICJILAXKQTZMQO-RTWAWAEBSA-N 1 1 411.509 3.207 20 0 HGADMO O=C1Nc2ccccc2[C@H]2CN(c3ncnc4c3CC[N@@H+](Cc3ccccc3)C4)C[C@H]12 ZINC001164403210 718856577 /nfs/dbraw/zinc/85/65/77/718856577.db2.gz ICJILAXKQTZMQO-RTWAWAEBSA-N 1 1 411.509 3.207 20 0 HGADMO CCOC(=O)c1c[nH]c2ncnc(N3CCC[C@H]4C[N@@H+](Cc5ccccc5)C[C@@H]43)c12 ZINC001164624926 719065988 /nfs/dbraw/zinc/06/59/88/719065988.db2.gz MACWEWALEXCXHD-HKUYNNGSSA-N 1 1 405.502 3.235 20 0 HGADMO Clc1ncc(N2CCOCC2)c(N2CCC[C@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)n1 ZINC001164624963 719080017 /nfs/dbraw/zinc/08/00/17/719080017.db2.gz MHQMUFYRGKQFFI-ICSRJNTNSA-N 1 1 413.953 3.067 20 0 HGADMO CC(C)n1nc(C[NH+](C)C)c2c1CN(c1ccc(C(=O)N3CCC[C@H](C)C3)cn1)CC2 ZINC001164650441 719314961 /nfs/dbraw/zinc/31/49/61/719314961.db2.gz DLQCWNXBSRLLNY-SFHVURJKSA-N 1 1 424.593 3.355 20 0 HGADMO CNC(=O)C[N@H+]1CCCC12CCN(c1cc(Cl)nc3cc(OC)ccc31)CC2 ZINC001164684434 719717841 /nfs/dbraw/zinc/71/78/41/719717841.db2.gz HCTZLHQWILDMCC-UHFFFAOYSA-N 1 1 402.926 3.078 20 0 HGADMO Cc1nc(C[N@H+]2CCCC23CCN(c2cc(C(N)=O)cc(Cl)n2)CC3)cs1 ZINC001164691196 719804232 /nfs/dbraw/zinc/80/42/32/719804232.db2.gz FLQWQUVWKQJIEY-UHFFFAOYSA-N 1 1 405.955 3.234 20 0 HGADMO COC(=O)c1cc(OC)cnc1N1CCC2(CCC[N@H+]2Cc2csc(C)n2)CC1 ZINC001164691921 719806546 /nfs/dbraw/zinc/80/65/46/719806546.db2.gz AOXWGXCDFQFIFV-UHFFFAOYSA-N 1 1 416.547 3.277 20 0 HGADMO CCOC(=O)c1cc(N2CCC3(CCC[N@H+]3Cc3csc(C)n3)CC2)ncn1 ZINC001164691949 719806845 /nfs/dbraw/zinc/80/68/45/719806845.db2.gz BEPCGPSNVVJOKL-UHFFFAOYSA-N 1 1 401.536 3.053 20 0 HGADMO CCOC(=O)c1ncnc(N2CCC3(CCC[N@H+]3Cc3csc(C)n3)CC2)c1C ZINC001164693063 719809579 /nfs/dbraw/zinc/80/95/79/719809579.db2.gz PLIDOVLMOIQJMX-UHFFFAOYSA-N 1 1 415.563 3.362 20 0 HGADMO CON(C)C(=O)c1cccnc1N1CCC2(CCC[N@H+]2Cc2csc(C)n2)CC1 ZINC001164691564 719812044 /nfs/dbraw/zinc/81/20/44/719812044.db2.gz HJUUNTNNZRGJQD-UHFFFAOYSA-N 1 1 415.563 3.115 20 0 HGADMO CCOC(=O)c1cc(Cl)nc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COC)c1 ZINC001164815748 720067908 /nfs/dbraw/zinc/06/79/08/720067908.db2.gz ZJNIZJNLZDQCRP-UWJYYQICSA-N 1 1 407.942 3.096 20 0 HGADMO CC[N@H+]1CCCC[C@H]1c1ccc(N2CCc3nnc(Cn4cccc4)n3CC2)nc1 ZINC001164710055 720091191 /nfs/dbraw/zinc/09/11/91/720091191.db2.gz GJROHYWMPONBTD-FQEVSTJZSA-N 1 1 405.550 3.133 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1nc(Cl)nc3c1COC3(C)C)C2 ZINC001164814864 720095479 /nfs/dbraw/zinc/09/54/79/720095479.db2.gz XMSSMMOYBUVHNX-YCRPNKLZSA-N 1 1 406.958 3.080 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(C(F)(F)Oc1ccc(Cl)nc1)C2 ZINC001164813197 720095843 /nfs/dbraw/zinc/09/58/43/720095843.db2.gz TUJYGKMTBDLDID-YJBOKZPZSA-N 1 1 401.885 3.344 20 0 HGADMO CCOC(=O)c1ccnc(N2CCC3(C[C@H](COC)[N@@H+](Cc4ccccn4)C3)CC2)c1 ZINC001164710035 720097473 /nfs/dbraw/zinc/09/74/73/720097473.db2.gz FZMMDJXRMDCWJA-OAQYLSRUSA-N 1 1 424.545 3.161 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1nc3ccc(OC)cc3nc1Cl)C2 ZINC001164810668 720102042 /nfs/dbraw/zinc/10/20/42/720102042.db2.gz KOLFTNVDDGFFGJ-AOMKIAJQSA-N 1 1 416.953 3.477 20 0 HGADMO CCOC(=O)c1cccc(N2CCC3(C[C@@H](COC)[N@@H+](Cc4ccccn4)C3)CC2)n1 ZINC001164716382 720110285 /nfs/dbraw/zinc/11/02/85/720110285.db2.gz KPTQAONKYYZHNL-FQEVSTJZSA-N 1 1 424.545 3.161 20 0 HGADMO COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1ccc3nc(C)n(C)c3n1)CC2 ZINC001164716106 720118092 /nfs/dbraw/zinc/11/80/92/720118092.db2.gz IYLRZKACRTXLRH-HXUWFJFHSA-N 1 1 420.561 3.179 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1nc(Cl)nc3sc(C)nc31)C2 ZINC001164813128 720124426 /nfs/dbraw/zinc/12/44/26/720124426.db2.gz PPJBPLAGXSPWEI-KUHUBIRLSA-N 1 1 407.971 3.233 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1nc(Cl)nc3cccc(OC)c31)C2 ZINC001164814374 720124549 /nfs/dbraw/zinc/12/45/49/720124549.db2.gz SDIDVPXIZIUKQK-KSFYIVLOSA-N 1 1 416.953 3.477 20 0 HGADMO COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1ncnc3cc(C)[nH]c31)CC2 ZINC001164719113 720124615 /nfs/dbraw/zinc/12/46/15/720124615.db2.gz WHIJLEZBYKDYSS-LJQANCHMSA-N 1 1 406.534 3.169 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1ccc(-c3ccccc3OC)nn1)C2 ZINC001164819875 720170248 /nfs/dbraw/zinc/17/02/48/720170248.db2.gz YVGURGOQVWAGRI-DVECYGJZSA-N 1 1 408.546 3.337 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1cc(-c3ccc(OC)cc3)ncn1)C2 ZINC001164817861 720175667 /nfs/dbraw/zinc/17/56/67/720175667.db2.gz QNHPFGMKNFGVBP-YKSBVNFPSA-N 1 1 408.546 3.337 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(C(F)(F)Oc1ccnc(Cl)c1)C2 ZINC001164812741 720196546 /nfs/dbraw/zinc/19/65/46/720196546.db2.gz MBMBCMQRBAEAFR-CRAIPNDOSA-N 1 1 401.885 3.344 20 0 HGADMO COc1ccc2c(ccnc2N2CCCn3c(=O)cc(C[N@@H+](C)C(C)C)nc3C2)c1 ZINC001164814678 720215589 /nfs/dbraw/zinc/21/55/89/720215589.db2.gz WGMUDQTZCDKPOT-UHFFFAOYSA-N 1 1 407.518 3.051 20 0 HGADMO CC(C)[N@@H+](C)Cc1cc(=O)n2c(n1)CN(c1ncc3ccc(Cl)cc3n1)CCC2 ZINC001164814094 720226873 /nfs/dbraw/zinc/22/68/73/720226873.db2.gz SWLUMBPGEHLWHQ-UHFFFAOYSA-N 1 1 412.925 3.090 20 0 HGADMO CCOC(=O)c1c(C)cc(Cl)nc1N1CC[C@H]2[C@H]1CC[N@H+]2Cc1cccnc1 ZINC001164725921 720363879 /nfs/dbraw/zinc/36/38/79/720363879.db2.gz OEPBAFHQYGLFHE-DLBZAZTESA-N 1 1 400.910 3.468 20 0 HGADMO c1cncc(C[N@H+]2CC[C@@H]3[C@@H]2CCN3c2ccc(-c3ccc4c(c3)OCCO4)nn2)c1 ZINC001164734738 720442891 /nfs/dbraw/zinc/44/28/91/720442891.db2.gz TZXBXDOVVJNCPI-LEWJYISDSA-N 1 1 415.497 3.163 20 0 HGADMO FC(F)(c1nc2ccc(Cl)nc2[nH]1)N1CC[C@H]2[C@@H]1CC[N@@H+]2Cc1cccnc1 ZINC001164727132 720451891 /nfs/dbraw/zinc/45/18/91/720451891.db2.gz DCKMXLAIIGRKSF-GJZGRUSLSA-N 1 1 404.852 3.404 20 0 HGADMO FC(F)(c1nc2ccc(Cl)nc2[nH]1)N1CC[C@H]2[C@@H]1CC[N@H+]2Cc1cccnc1 ZINC001164727132 720451896 /nfs/dbraw/zinc/45/18/96/720451896.db2.gz DCKMXLAIIGRKSF-GJZGRUSLSA-N 1 1 404.852 3.404 20 0 HGADMO CC(C)(c1ccnc(Cl)c1)[N@@H+]1CC[C@@H]2OCC[C@@]2(C(=O)Nc2cccnc2)C1 ZINC001164729885 720504341 /nfs/dbraw/zinc/50/43/41/720504341.db2.gz KGRMCMGTUINVDI-LAUBAEHRSA-N 1 1 400.910 3.485 20 0 HGADMO CC(C)(c1ccnc(Cl)c1)[N@H+]1CC[C@@H]2OCC[C@@]2(C(=O)Nc2cccnc2)C1 ZINC001164729885 720504343 /nfs/dbraw/zinc/50/43/43/720504343.db2.gz KGRMCMGTUINVDI-LAUBAEHRSA-N 1 1 400.910 3.485 20 0 HGADMO CC(C)[N@@H+]1[C@@H]2CCN(C(F)(F)c3cc(Cl)ncn3)C[C@@H]2C[C@H]1Cn1cccn1 ZINC001164838477 720505873 /nfs/dbraw/zinc/50/58/73/720505873.db2.gz RMAXFOWPEOCFRD-HRCADAONSA-N 1 1 410.900 3.249 20 0 HGADMO COC(=O)c1cnc(Cl)cc1N1CC[C@@H]2[C@H](C[C@@H](Cn3cccn3)[N@H+]2C(C)C)C1 ZINC001164841234 720508440 /nfs/dbraw/zinc/50/84/40/720508440.db2.gz XYKDAGJROIFUHO-SOLBZPMBSA-N 1 1 417.941 3.096 20 0 HGADMO COC(=O)c1cc(Cl)cnc1N1CC[C@@H]2[C@H](C[C@H](Cn3cccn3)[N@H+]2C(C)C)C1 ZINC001164833285 720512338 /nfs/dbraw/zinc/51/23/38/720512338.db2.gz CSFDUCMGNNPBAD-SZVBFZGTSA-N 1 1 417.941 3.096 20 0 HGADMO COC(=O)c1cc(N2CC[C@@H]3[C@H](C[C@@H](Cn4cccn4)[N@H+]3C(C)C)C2)ncc1Cl ZINC001164839034 720513041 /nfs/dbraw/zinc/51/30/41/720513041.db2.gz RZWUJGGVJDFNQB-JTDSTZFVSA-N 1 1 417.941 3.096 20 0 HGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@@H]2CN(C(F)(F)c3cnc(Cl)cn3)CC[C@@H]21 ZINC001164832979 720514055 /nfs/dbraw/zinc/51/40/55/720514055.db2.gz CEWQGSAJTCUYOG-PMPSAXMXSA-N 1 1 410.900 3.249 20 0 HGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@@H]2CN(C(F)(F)c3nccc(Cl)n3)CC[C@@H]21 ZINC001164840025 720515447 /nfs/dbraw/zinc/51/54/47/720515447.db2.gz VUMIWFLJVKDCFP-PMPSAXMXSA-N 1 1 410.900 3.249 20 0 HGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@H]2CN(c3nc(Cl)nc4cnccc43)CC[C@@H]21 ZINC001164834911 720527873 /nfs/dbraw/zinc/52/78/73/720527873.db2.gz IFEAFYPKEXZQMK-BXWFABGCSA-N 1 1 411.941 3.253 20 0 HGADMO CCOc1nc(Cl)cc(N2CC[C@@H]3[C@H](C[C@@H](Cn4cccn4)[N@H+]3C(C)C)C2)n1 ZINC001164836569 720527957 /nfs/dbraw/zinc/52/79/57/720527957.db2.gz NGFAEHJFVORBAU-IXDOHACOSA-N 1 1 404.946 3.103 20 0 HGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@@H]2CN([C@@H](F)Oc3cccc(Cl)n3)CC[C@@H]21 ZINC001164836383 720545498 /nfs/dbraw/zinc/54/54/98/720545498.db2.gz JTEQUSWTQGTXOQ-NHAYFPRASA-N 1 1 407.921 3.437 20 0 HGADMO CCOC(=O)/C=C/c1ccc(N2CC[C@@H]3[C@H](C[C@H](Cn4cccn4)[N@H+]3C(C)C)C2)nc1 ZINC001164838554 720568745 /nfs/dbraw/zinc/56/87/45/720568745.db2.gz OLFNMUDEAJOVRW-XZYYFQSUSA-N 1 1 423.561 3.232 20 0 HGADMO CCOC(=O)c1c(C)ccnc1N1CC[C@@H]2[C@H](C[C@@H](Cn3cccn3)[N@H+]2C(C)C)C1 ZINC001164839820 720577954 /nfs/dbraw/zinc/57/79/54/720577954.db2.gz OVUQBVVYQPAMRT-HSALFYBXSA-N 1 1 411.550 3.141 20 0 HGADMO Cc1cc(N2CC[C@@H]3[C@@H](C[C@@H](Cn4cccn4)[N@@H+]3C(C)C)C2)nc(-c2ccccn2)n1 ZINC001164840082 720598472 /nfs/dbraw/zinc/59/84/72/720598472.db2.gz OYIPLXHYBHHWRZ-JAXLGGSGSA-N 1 1 417.561 3.421 20 0 HGADMO Cc1noc(-c2ccc(N3CC[C@@H]4[C@H](C[C@H](Cn5cccn5)[N@@H+]4C(C)C)C3)nc2)n1 ZINC001164838380 720613428 /nfs/dbraw/zinc/61/34/28/720613428.db2.gz KVRSXOOETXUVJT-VAMGGRTRSA-N 1 1 407.522 3.014 20 0 HGADMO Cc1nc(-c2ccncc2)cc(N2CC[C@@H]3[C@@H](C[C@@H](Cn4cccn4)[N@@H+]3C(C)C)C2)n1 ZINC001164838158 720620926 /nfs/dbraw/zinc/62/09/26/720620926.db2.gz KCSMWCVSPKIPAN-QNWVGRARSA-N 1 1 417.561 3.421 20 0 HGADMO CCOC(=O)Cc1cccnc1N1CCC2(C[C@H]([N@@H+](C)Cc3ccccc3)CO2)CC1 ZINC001164841852 720670181 /nfs/dbraw/zinc/67/01/81/720670181.db2.gz QPTKAHBIGOMBFT-QFIPXVFZSA-N 1 1 423.557 3.447 20 0 HGADMO COC(=O)c1cnc(N2CCC3(C[C@H]([N@@H+](C)Cc4ccccc4)CO3)CC2)c(C)c1 ZINC001164842638 720678697 /nfs/dbraw/zinc/67/86/97/720678697.db2.gz LXZNBKJJMSRNGJ-NRFANRHFSA-N 1 1 409.530 3.437 20 0 HGADMO C[N@@H+](Cc1ccccc1)[C@H]1COC2(C1)CCN(c1ncc(OC(F)F)cn1)CC2 ZINC001164839869 720699711 /nfs/dbraw/zinc/69/97/11/720699711.db2.gz CJZQSTKPVBMBHX-QGZVFWFLSA-N 1 1 404.461 3.338 20 0 HGADMO C[N@@H+](Cc1ccccc1)[C@H]1COC2(C1)CCN(c1ncc3ncnc(Cl)c3n1)CC2 ZINC001164843391 720701739 /nfs/dbraw/zinc/70/17/39/720701739.db2.gz PFJXZZJOKDUNAP-QGZVFWFLSA-N 1 1 424.936 3.333 20 0 HGADMO CCNC(=O)c1ccc(N2CCC3(C[C@@H]([N@@H+](C)Cc4ccccc4)CO3)CC2)nc1 ZINC001164840346 720710336 /nfs/dbraw/zinc/71/03/36/720710336.db2.gz PPFMBMPXRWSTGX-OAQYLSRUSA-N 1 1 408.546 3.091 20 0 HGADMO COc1ncc(Cl)c(N2CCC3(C[C@@H]([N@@H+](C)Cc4ccccc4)CO3)CC2)n1 ZINC001164840360 720723329 /nfs/dbraw/zinc/72/33/29/720723329.db2.gz PYSNJLVZMPXDIE-QGZVFWFLSA-N 1 1 402.926 3.399 20 0 HGADMO Cc1cc2nc(Cl)c(N3CC[N@H+]4C[C@H](Oc5cncnc5)C[C@H]4C3)nc2cc1C ZINC001164742340 720726046 /nfs/dbraw/zinc/72/60/46/720726046.db2.gz OEMRUNCMTDEAAR-JKSUJKDBSA-N 1 1 410.909 3.032 20 0 HGADMO Cc1nc2sc3c(c2c(N2CC[N@H+]4C[C@@H](Oc5cncnc5)C[C@@H]4C2)n1)CCCC3 ZINC001164738493 720756571 /nfs/dbraw/zinc/75/65/71/720756571.db2.gz FVDMPTPZSDMJMA-CVEARBPZSA-N 1 1 422.558 3.010 20 0 HGADMO C[NH+]1CCC(Oc2ccnc(N3CC[C@@H]4[C@H]3CCC(=O)N4c3ccccc3)c2)CC1 ZINC001164843733 720768415 /nfs/dbraw/zinc/76/84/15/720768415.db2.gz AMUSWLRVGPTLNI-FGZHOGPDSA-N 1 1 406.530 3.329 20 0 HGADMO C[NH+]1CCC(Oc2ccnc(N3CC[C@H]4[C@@H]3CCC(=O)N4c3ccccc3)c2)CC1 ZINC001164843738 720768731 /nfs/dbraw/zinc/76/87/31/720768731.db2.gz AMUSWLRVGPTLNI-VXKWHMMOSA-N 1 1 406.530 3.329 20 0 HGADMO Clc1cc(C2CCCCC2)nc(N2CC[N@H+]3C[C@@H](Oc4cncnc4)C[C@@H]3C2)n1 ZINC001164752831 720802174 /nfs/dbraw/zinc/80/21/74/720802174.db2.gz ZZZIKJIITDDGBR-SJORKVTESA-N 1 1 414.941 3.310 20 0 HGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2C[C@@H]3CN(Cc4ccncc4)C(=O)[C@@H]3C2)nc1 ZINC001164853577 720813935 /nfs/dbraw/zinc/81/39/35/720813935.db2.gz QOOGRTLWHGJLDY-YPAWHYETSA-N 1 1 405.546 3.118 20 0 HGADMO Cc1sc2ncnc(N3CC[C@@H]4[C@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)c2c1C ZINC001164751993 720814993 /nfs/dbraw/zinc/81/49/93/720814993.db2.gz YJAMETKSJGTDHW-CEXWTWQISA-N 1 1 423.590 3.279 20 0 HGADMO COc1ccc2c(ccnc2N2CC[C@@H]3[C@@H](C[C@@H](Cn4cncn4)[N@H+]3CC3CC3)C2)c1 ZINC001164745611 720818744 /nfs/dbraw/zinc/81/87/44/720818744.db2.gz XFAYDYCHIPTMFT-SXWKCWPCSA-N 1 1 418.545 3.214 20 0 HGADMO Cc1nc2ccc(F)cc2c(N2CC[C@@H]3[C@@H](C[C@@H](Cn4cncn4)[N@H+]3CC3CC3)C2)n1 ZINC001164739603 720819827 /nfs/dbraw/zinc/81/98/27/720819827.db2.gz HZAKBKIRGKBFIF-LQBOVUBWSA-N 1 1 421.524 3.048 20 0 HGADMO Cc1nc2cc(F)ccc2c(N2CC[C@@H]3[C@H](C[C@H](Cn4cncn4)[N@H+]3CC3CC3)C2)n1 ZINC001164737656 720820310 /nfs/dbraw/zinc/82/03/10/720820310.db2.gz BHBAKFSPIQKXCJ-SFGWALBWSA-N 1 1 421.524 3.048 20 0 HGADMO Cc1nc(Cl)cc(N2CC[C@@H]3[C@H](C[C@@H](Cn4cncn4)[N@H+]3CC3CC3)C2)c1C ZINC001164748796 720832162 /nfs/dbraw/zinc/83/21/62/720832162.db2.gz UYCDLQYMXYPZML-CEXWTWQISA-N 1 1 400.958 3.323 20 0 HGADMO Clc1ccnc2nc(N3CC[C@@H]4[C@@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)ccc12 ZINC001164742981 720834667 /nfs/dbraw/zinc/83/46/67/720834667.db2.gz HQQTUOALANNEQS-SQGPQFPESA-N 1 1 423.952 3.254 20 0 HGADMO CC(C)COc1cccc(N2CC[C@@H]3[C@@H](C[C@@H](Cn4cncn4)[N@H+]3CC3CC3)C2)n1 ZINC001164748918 720841738 /nfs/dbraw/zinc/84/17/38/720841738.db2.gz VCZCTHRGDJUCDR-PCCBWWKXSA-N 1 1 410.566 3.087 20 0 HGADMO Fc1ccc2cc(N3CC[C@@H]4[C@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)ncc2c1 ZINC001164749564 720850180 /nfs/dbraw/zinc/85/01/80/720850180.db2.gz WELZPMATJQDJFZ-BAGYTPMASA-N 1 1 406.509 3.345 20 0 HGADMO Cc1cc(N2CC[C@@H]3[C@@H](C[C@H](Cn4cncn4)[N@H+]3CC3CC3)C2)nc(C(C)(C)C)n1 ZINC001164744582 720850744 /nfs/dbraw/zinc/85/07/44/720850744.db2.gz KSJJDSIOIPMSOR-XUVXKRRUSA-N 1 1 409.582 3.053 20 0 HGADMO COCC[N@H+]1CCO[C@@H]2CN(c3ncc(OC)c4ccc(Cl)cc43)CC[C@@H]2C1 ZINC001164853121 720855382 /nfs/dbraw/zinc/85/53/82/720855382.db2.gz GNDAZGGNGDGEAD-FOIQADDNSA-N 1 1 405.926 3.070 20 0 HGADMO CC(C)c1c(Cl)ncnc1N1CC[C@@H]2[C@@H](C[C@@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164751055 720856869 /nfs/dbraw/zinc/85/68/69/720856869.db2.gz PXZWLWUXLMSNCA-OKZBNKHCSA-N 1 1 415.973 3.224 20 0 HGADMO COCC[N@H+]1CCO[C@H]2CN(c3cc(F)ccc3-c3ccc(Cl)nn3)CC[C@@H]2C1 ZINC001164854928 720881151 /nfs/dbraw/zinc/88/11/51/720881151.db2.gz GGKFDYZIRIBHQZ-QRWLVFNGSA-N 1 1 420.916 3.110 20 0 HGADMO Cc1cc(C)c(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COCc2cccnc2)nn1 ZINC001164757866 720882092 /nfs/dbraw/zinc/88/20/92/720882092.db2.gz VXUZAPCYIIWCGR-VWNXMTODSA-N 1 1 407.562 3.244 20 0 HGADMO Cc1cnc(C)nc1N1CC[C@]2(C1)C[N@@H+](CC1CC1)C[C@@H]2COCc1cccnc1 ZINC001164755351 720884180 /nfs/dbraw/zinc/88/41/80/720884180.db2.gz LFTOLMLZCCYTPM-ISKFKSNPSA-N 1 1 407.562 3.244 20 0 HGADMO C[N@@H+](Cc1ccc(N2CC[C@]3(C2)C[C@H](NC(=O)c2ccccc2)CCO3)nc1)C1CC1 ZINC001164861539 720902079 /nfs/dbraw/zinc/90/20/79/720902079.db2.gz TVXLAKRQJXHTBZ-PXDATVDWSA-N 1 1 420.557 3.234 20 0 HGADMO CCOC(=O)c1cc2cccnc2nc1N1CCn2c(C[N@@H+](C)C(C)C)cnc2[C@H]1C ZINC001164862472 720959758 /nfs/dbraw/zinc/95/97/58/720959758.db2.gz VSMCUZMHQDRCEI-MRXNPFEDSA-N 1 1 422.533 3.424 20 0 HGADMO COc1cc2ncnc(N3CCn4c(C[N@@H+](C)C(C)C)cnc4[C@H]3C)c2c(OC)c1 ZINC001164864190 720970026 /nfs/dbraw/zinc/97/00/26/720970026.db2.gz ZEZFLMCDBLZCPI-OAHLLOKOSA-N 1 1 410.522 3.265 20 0 HGADMO C[N@@H+](Cc1ccc(N2CCC[C@]3(C[C@@H](OCc4ccccn4)CO3)C2)nc1)C1CC1 ZINC001164765371 721030954 /nfs/dbraw/zinc/03/09/54/721030954.db2.gz OVGNMPLFJBDSBM-VWNXMTODSA-N 1 1 408.546 3.416 20 0 HGADMO FC(F)(c1cc(Cl)nc(Cl)c1)N1CCc2[nH+]cc(Cn3cccn3)n2CC1 ZINC001164861231 721031538 /nfs/dbraw/zinc/03/15/38/721031538.db2.gz FGNDXHPVERAXNQ-UHFFFAOYSA-N 1 1 413.259 3.437 20 0 HGADMO Clc1nnc(N2CC[N@H+]3C[C@H](OCc4cccnc4)C[C@@H]3C2)c2sccc21 ZINC001164866042 721064340 /nfs/dbraw/zinc/06/43/40/721064340.db2.gz BXOAOACGAZETRB-HUUCEWRRSA-N 1 1 401.923 3.219 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4nc(Cl)nc5ccc(F)cc54)C[C@@H]3C2)cn1 ZINC001164771191 721084314 /nfs/dbraw/zinc/08/43/14/721084314.db2.gz ROEOECVOWDPORR-GJZGRUSLSA-N 1 1 400.889 3.114 20 0 HGADMO COc1ccc2nc(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@@H]4C3)cc(C)c2c1 ZINC001164867657 721088444 /nfs/dbraw/zinc/08/84/44/721088444.db2.gz ZGMBZBGDLXGTNT-TZIWHRDSSA-N 1 1 404.514 3.427 20 0 HGADMO COc1cc2ccc(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@@H]4C3)nc2cc1OC ZINC001164865443 721107045 /nfs/dbraw/zinc/10/70/45/721107045.db2.gz LIWYZEOUILINET-UXHICEINSA-N 1 1 420.513 3.127 20 0 HGADMO COc1cc2ccc(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@H]4C3)nc2cc1OC ZINC001164865444 721107101 /nfs/dbraw/zinc/10/71/01/721107101.db2.gz LIWYZEOUILINET-VQTJNVASSA-N 1 1 420.513 3.127 20 0 HGADMO COc1ccc2c(C)cc(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@@H]4C3)nc2c1 ZINC001164867703 721109119 /nfs/dbraw/zinc/10/91/19/721109119.db2.gz ZSJCAQOPPZVOOX-CTNGQTDRSA-N 1 1 404.514 3.427 20 0 HGADMO c1ccc2c(c1)CCc1cnc(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@@H]4C3)nc1-2 ZINC001164879493 721126366 /nfs/dbraw/zinc/12/63/66/721126366.db2.gz SVBKQWLEVXOFGW-FGZHOGPDSA-N 1 1 413.525 3.117 20 0 HGADMO Fc1cc2ncnc(Cl)c2c(N2CC[N@H+]3C[C@H](OCc4cccnc4)C[C@@H]3C2)c1 ZINC001164879570 721127687 /nfs/dbraw/zinc/12/76/87/721127687.db2.gz UAVVYXYQOFXPSG-IAGOWNOFSA-N 1 1 413.884 3.297 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4cc(F)cc5ncnc(Cl)c54)C[C@H]3C2)cn1 ZINC001164772349 721180268 /nfs/dbraw/zinc/18/02/68/721180268.db2.gz SQBGDNAVBMXQDL-LSDHHAIUSA-N 1 1 400.889 3.114 20 0 HGADMO FC(F)(Oc1ccnc(Cl)c1)N1CC[N@H+]2C[C@H](OCc3cccnc3)C[C@H]2C1 ZINC001164879584 721181965 /nfs/dbraw/zinc/18/19/65/721181965.db2.gz UDIGHNNDKNNTOB-DOTOQJQBSA-N 1 1 410.852 3.034 20 0 HGADMO COc1cc2ccnc(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@H]4C3)c2cc1F ZINC001164877583 721184281 /nfs/dbraw/zinc/18/42/81/721184281.db2.gz OUCKOVXRWJXJDC-RBUKOAKNSA-N 1 1 408.477 3.257 20 0 HGADMO Cc1c(Cl)nc(C(C)(C)C)nc1N1C[C@@H]2CC[N@H+](Cc3cnn(C)c3)C[C@H]2C1 ZINC001164774441 721195260 /nfs/dbraw/zinc/19/52/60/721195260.db2.gz ZEUQAYBXZCTTAR-IRXDYDNUSA-N 1 1 402.974 3.428 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4ccc(-c5c(F)cccc5F)nn4)C[C@@H]3C2)cn1 ZINC001164771884 721215878 /nfs/dbraw/zinc/21/58/78/721215878.db2.gz RRZFJMUFEABVPG-IRXDYDNUSA-N 1 1 410.472 3.114 20 0 HGADMO Cc1c(Cl)nc(C2CCC2)nc1N1C[C@H]2CC[N@H+](Cc3cnn(C)c3)C[C@@H]2C1 ZINC001164767140 721238515 /nfs/dbraw/zinc/23/85/15/721238515.db2.gz VXDQUJOXNAIMLH-QZTJIDSGSA-N 1 1 400.958 3.398 20 0 HGADMO O=C(Nc1cccnc1Cl)OCC(F)(F)N1CC2(C1)CC[N@@H+](CC1CC1)C2 ZINC001164774985 721302293 /nfs/dbraw/zinc/30/22/93/721302293.db2.gz LRHWVIXREBBJRG-UHFFFAOYSA-N 1 1 400.857 3.294 20 0 HGADMO CCN1CC[C@@]2(CN(c3ccc4c(n3)CC[N@H+](Cc3ccccc3)C4)C[C@H]2C)C1=O ZINC001164777293 721317965 /nfs/dbraw/zinc/31/79/65/721317965.db2.gz JNQWZOGNMFFMMW-CLOONOSVSA-N 1 1 404.558 3.335 20 0 HGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@@]2(CCCN(c3ncc(Cl)c(C)n3)C2)C1 ZINC001164779787 721340446 /nfs/dbraw/zinc/34/04/46/721340446.db2.gz WMWJDUHVZBCYLC-FQEVSTJZSA-N 1 1 405.930 3.162 20 0 HGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@@]2(CCCN(c3ncc(Cl)c(C)n3)C2)C1 ZINC001164779787 721340447 /nfs/dbraw/zinc/34/04/47/721340447.db2.gz WMWJDUHVZBCYLC-FQEVSTJZSA-N 1 1 405.930 3.162 20 0 HGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@@]2(CCCN(c3ccc4nc(C)n(C)c4n3)C2)C1 ZINC001164777210 721350343 /nfs/dbraw/zinc/35/03/43/721350343.db2.gz FCDDKNXYJXKYCB-QHCPKHFHSA-N 1 1 424.549 3.001 20 0 HGADMO CCCc1cc(N2CCC[C@@]3(C2)COCC[N@@H+](Cc2c(C)noc2C)C3)nc(C)n1 ZINC001164785313 721358428 /nfs/dbraw/zinc/35/84/28/721358428.db2.gz UJYNPZRHKHGHRH-HSZRJFAPSA-N 1 1 413.566 3.461 20 0 HGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@@]2(CCCN(c3cc(-c4ncc[nH]4)ccn3)C2)C1 ZINC001164787078 721360293 /nfs/dbraw/zinc/36/02/93/721360293.db2.gz YLNJECGXVQMVAP-QHCPKHFHSA-N 1 1 422.533 3.196 20 0 HGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@@]2(CCCN(c3cc(-c4ncc[nH]4)ccn3)C2)C1 ZINC001164787078 721360299 /nfs/dbraw/zinc/36/02/99/721360299.db2.gz YLNJECGXVQMVAP-QHCPKHFHSA-N 1 1 422.533 3.196 20 0 HGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@@]2(CCCN(c3cc(C4CCC4)ncn3)C2)C1 ZINC001164787082 721372244 /nfs/dbraw/zinc/37/22/44/721372244.db2.gz YNDNIEMGGXAPHH-QHCPKHFHSA-N 1 1 411.550 3.468 20 0 HGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@@]2(CCCN(c3cc(C4CCC4)ncn3)C2)C1 ZINC001164787082 721372246 /nfs/dbraw/zinc/37/22/46/721372246.db2.gz YNDNIEMGGXAPHH-QHCPKHFHSA-N 1 1 411.550 3.468 20 0 HGADMO COc1ccc2nc(N3C[C@@H]4C[N@@H+](Cc5nccs5)C[C@@H]4C3)c(Cl)nc2c1 ZINC001164784352 721405474 /nfs/dbraw/zinc/40/54/74/721405474.db2.gz JSXZEQCKOMQNEI-BETUJISGSA-N 1 1 401.923 3.317 20 0 HGADMO COc1ccc2nc(N3C[C@@H]4C[N@H+](Cc5nccs5)C[C@@H]4C3)c(Cl)nc2c1 ZINC001164784352 721405477 /nfs/dbraw/zinc/40/54/77/721405477.db2.gz JSXZEQCKOMQNEI-BETUJISGSA-N 1 1 401.923 3.317 20 0 HGADMO COC(=O)C[C@H](c1ccnc(N2C[C@H]3C[NH+](Cc4nccs4)C[C@@H]3C2)c1)C1CC1 ZINC001164787353 721423391 /nfs/dbraw/zinc/42/33/91/721423391.db2.gz QGPODZSMJDHFFR-QRVBRYPASA-N 1 1 412.559 3.163 20 0 HGADMO Cc1c(Cl)cnc(Cl)c1N1CC[C@]2(C1)CCC[C@H](CN1CC[NH+](C)CC1)O2 ZINC001164892251 721429187 /nfs/dbraw/zinc/42/91/87/721429187.db2.gz HUDWMBZRMNMKFN-UZLBHIALSA-N 1 1 413.393 3.462 20 0 HGADMO CSc1cc(Cl)cnc1N1CC[C@@]2(C1)CCC[C@H](CN1CC[NH+](C)CC1)O2 ZINC001164898302 721430208 /nfs/dbraw/zinc/43/02/08/721430208.db2.gz VQLKUDZYNWPSNZ-YLJYHZDGSA-N 1 1 411.015 3.222 20 0 HGADMO COc1ccc(OC)c(-c2ccc(N3C[C@H]4C[NH+](Cc5nccs5)C[C@@H]4C3)nn2)c1 ZINC001164784682 721431183 /nfs/dbraw/zinc/43/11/83/721431183.db2.gz LPRWXVDSQZTLID-HZPDHXFCSA-N 1 1 423.542 3.186 20 0 HGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1nc(Cl)ncc1F)CC2 ZINC001164784386 721450309 /nfs/dbraw/zinc/45/03/09/721450309.db2.gz FCKRXFDQXRDIIV-INIZCTEOSA-N 1 1 412.937 3.003 20 0 HGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1ncc3c(n1)CCCC3)CC2 ZINC001164789536 721470605 /nfs/dbraw/zinc/47/06/05/721470605.db2.gz NWTHHKSPNYAQQU-OAQYLSRUSA-N 1 1 414.594 3.089 20 0 HGADMO CCCc1nccnc1N1CCC2(C[C@H](COCC3CC3)[N@@H+](CCOC)C2)CC1 ZINC001164786569 721473279 /nfs/dbraw/zinc/47/32/79/721473279.db2.gz BPZRRHNGCOPBBK-HXUWFJFHSA-N 1 1 402.583 3.163 20 0 HGADMO C[N@@H+](Cc1ccc(N2CCCC[C@]23CC(=O)N(Cc2cccnc2)C3)nc1)C1CC1 ZINC001164897014 721475742 /nfs/dbraw/zinc/47/57/42/721475742.db2.gz ZLLUETDLSAUSTR-XMMPIXPASA-N 1 1 405.546 3.232 20 0 HGADMO CCOC(=O)c1cnc(Cl)cc1N1CC[N@H+]2C[C@@H](Oc3cccc(F)c3)C[C@@H]2C1 ZINC001164900773 721509444 /nfs/dbraw/zinc/50/94/44/721509444.db2.gz UPMJXLAHOJDIBS-WBVHZDCISA-N 1 1 419.884 3.393 20 0 HGADMO COC(=O)c1cnc(Cl)cc1N1CC[N@H+]2C[C@H](Oc3cccc(F)c3)C[C@H]2C1 ZINC001164900260 721510835 /nfs/dbraw/zinc/51/08/35/721510835.db2.gz PGBGVPIUZUOMIM-GOEBONIOSA-N 1 1 405.857 3.003 20 0 HGADMO O=C(c1cccnc1N1CC[N@H+]2C[C@H](Oc3cccc(F)c3)C[C@@H]2C1)N1CCCCC1 ZINC001164900671 721513442 /nfs/dbraw/zinc/51/34/42/721513442.db2.gz SRCOQDTZRRCSOX-TZIWHRDSSA-N 1 1 424.520 3.189 20 0 HGADMO CCOC(=O)/C=C/c1cccnc1N1CC[N@H+]2C[C@H](Oc3cccc(F)c3)C[C@@H]2C1 ZINC001164902230 721513620 /nfs/dbraw/zinc/51/36/20/721513620.db2.gz ZZNUCMNUTZVNKX-AUGFPLSNSA-N 1 1 411.477 3.139 20 0 HGADMO COC(=O)c1cc(Cl)cnc1N1CC[N@H+]2C[C@@H](Oc3cccc(F)c3)C[C@@H]2C1 ZINC001164897066 721513845 /nfs/dbraw/zinc/51/38/45/721513845.db2.gz DMORBQPMIUKFQP-WBVHZDCISA-N 1 1 405.857 3.003 20 0 HGADMO COC(=O)c1cc(N2CC[N@H+]3C[C@@H](Oc4cccc(F)c4)C[C@@H]3C2)ncc1Cl ZINC001164899603 721514669 /nfs/dbraw/zinc/51/46/69/721514669.db2.gz LGINNCUIZATLDO-ZBFHGGJFSA-N 1 1 405.857 3.003 20 0 HGADMO COC(=O)c1ccc(Cl)c(N2CC[N@H+]3C[C@H](Oc4cccc(F)c4)C[C@H]3C2)n1 ZINC001164911996 721537902 /nfs/dbraw/zinc/53/79/02/721537902.db2.gz YAHCNUJIPHWLSA-GOEBONIOSA-N 1 1 405.857 3.003 20 0 HGADMO Nc1cc(Cl)nc(C(F)(F)N2CC[N@H+]3C[C@@H](Oc4cccc(F)c4)C[C@@H]3C2)c1 ZINC001164906392 721539911 /nfs/dbraw/zinc/53/99/11/721539911.db2.gz KJKXONDGZZDMOP-ZBFHGGJFSA-N 1 1 412.843 3.343 20 0 HGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(C(F)(F)Oc2cccnc2Cl)[C@@H]2CCCO[C@@H]12 ZINC001164801347 721540018 /nfs/dbraw/zinc/54/00/18/721540018.db2.gz DZDUYKMNXFPENZ-JFIYKMOQSA-N 1 1 424.879 3.423 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(C(F)(F)Oc2cccnc2Cl)[C@@H]2CCCO[C@@H]12 ZINC001164801347 721540026 /nfs/dbraw/zinc/54/00/26/721540026.db2.gz DZDUYKMNXFPENZ-JFIYKMOQSA-N 1 1 424.879 3.423 20 0 HGADMO Fc1cccc(O[C@@H]2C[C@@H]3CN(c4ncnc(-c5cccc(F)c5)n4)CC[N@H+]3C2)c1 ZINC001164903525 721557818 /nfs/dbraw/zinc/55/78/18/721557818.db2.gz BZMQVKNGENSJJA-UYAOXDASSA-N 1 1 409.440 3.159 20 0 HGADMO COc1cc(C)c2ncnc(N3CC[N@H+]4C[C@H](Oc5cccc(F)c5)C[C@@H]4C3)c2c1 ZINC001164903500 721568780 /nfs/dbraw/zinc/56/87/80/721568780.db2.gz BODFJROYDKXBPS-YLJYHZDGSA-N 1 1 408.477 3.428 20 0 HGADMO CSc1ncc(Cl)nc1N1C[C@H]([N@H+](C)Cc2cccnc2)[C@@H]2OCCC[C@H]21 ZINC001164798604 721574047 /nfs/dbraw/zinc/57/40/47/721574047.db2.gz BOXMYXBWEQVYID-HLLBOEOZSA-N 1 1 405.955 3.115 20 0 HGADMO CSc1ncc(Cl)nc1N1C[C@H]([N@@H+](C)Cc2cccnc2)[C@@H]2OCCC[C@H]21 ZINC001164798604 721574049 /nfs/dbraw/zinc/57/40/49/721574049.db2.gz BOXMYXBWEQVYID-HLLBOEOZSA-N 1 1 405.955 3.115 20 0 HGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2cc(-c3ccccc3)ncn2)[C@H]2CCCO[C@@H]12 ZINC001164804034 721575604 /nfs/dbraw/zinc/57/56/04/721575604.db2.gz KYOVOODODCASEG-WMTXJRDZSA-N 1 1 401.514 3.407 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2cc(-c3ccccc3)ncn2)[C@H]2CCCO[C@@H]12 ZINC001164804034 721575605 /nfs/dbraw/zinc/57/56/05/721575605.db2.gz KYOVOODODCASEG-WMTXJRDZSA-N 1 1 401.514 3.407 20 0 HGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2ncnc3sc4c(c32)CCC4)[C@@H]2CCCO[C@@H]12 ZINC001164798569 721576411 /nfs/dbraw/zinc/57/64/11/721576411.db2.gz BLMZCXOITRYDOC-DBXWQHBBSA-N 1 1 421.570 3.443 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2ncnc3sc4c(c32)CCC4)[C@@H]2CCCO[C@@H]12 ZINC001164798569 721576412 /nfs/dbraw/zinc/57/64/12/721576412.db2.gz BLMZCXOITRYDOC-DBXWQHBBSA-N 1 1 421.570 3.443 20 0 HGADMO COC(=O)c1ccnc(N2CCC(F)(F)[C@@]3(CC[N@@H+](Cc4ccccn4)C3)C2)c1 ZINC001164907042 721584828 /nfs/dbraw/zinc/58/48/28/721584828.db2.gz QMSQHXHQIBKKBH-HXUWFJFHSA-N 1 1 402.445 3.001 20 0 HGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2cncc(N3CCCCCC3)n2)[C@H]2CCCO[C@H]12 ZINC001164804301 721585076 /nfs/dbraw/zinc/58/50/76/721585076.db2.gz JJSJFEUOSNBRKZ-IMSXRSKXSA-N 1 1 422.577 3.120 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2cncc(N3CCCCCC3)n2)[C@H]2CCCO[C@H]12 ZINC001164804301 721585077 /nfs/dbraw/zinc/58/50/77/721585077.db2.gz JJSJFEUOSNBRKZ-IMSXRSKXSA-N 1 1 422.577 3.120 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2nc(C3CC3)nc3[nH]ccc32)[C@@H]2CCCO[C@H]12 ZINC001164805652 721588665 /nfs/dbraw/zinc/58/86/65/721588665.db2.gz LKDPEGSNEXMNGU-AQNXPRMDSA-N 1 1 404.518 3.099 20 0 HGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2cncc(OCC3CCCC3)n2)[C@@H]2CCCO[C@H]12 ZINC001164802591 721589264 /nfs/dbraw/zinc/58/92/64/721589264.db2.gz GXUBRQUDCREVOX-LGVFNWMJSA-N 1 1 423.561 3.309 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2cncc(OCC3CCCC3)n2)[C@@H]2CCCO[C@H]12 ZINC001164802591 721589267 /nfs/dbraw/zinc/58/92/67/721589267.db2.gz GXUBRQUDCREVOX-LGVFNWMJSA-N 1 1 423.561 3.309 20 0 HGADMO CSc1cc(N2C[C@H]([N@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@@H]32)nc(SC)n1 ZINC001164800695 721590190 /nfs/dbraw/zinc/59/01/90/721590190.db2.gz CLWFQNKUEABXRM-TXPKVOOTSA-N 1 1 417.604 3.184 20 0 HGADMO CSc1cc(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@@H]32)nc(SC)n1 ZINC001164800695 721590192 /nfs/dbraw/zinc/59/01/92/721590192.db2.gz CLWFQNKUEABXRM-TXPKVOOTSA-N 1 1 417.604 3.184 20 0 HGADMO Cc1nc2ccc(N3CCC(F)(F)[C@]4(CC[N@@H+](Cc5ccccn5)C4)C3)nc2n1C ZINC001164904346 721703642 /nfs/dbraw/zinc/70/36/42/721703642.db2.gz BXRDBUFPCVHJEP-NRFANRHFSA-N 1 1 412.488 3.409 20 0 HGADMO CN(C)C(=O)C[NH+]1CCC2(CCCN2C(F)(F)c2cnc(Cl)c(Cl)c2)CC1 ZINC001165009084 721731122 /nfs/dbraw/zinc/73/11/22/721731122.db2.gz TZBMFDBJSPRZSZ-UHFFFAOYSA-N 1 1 421.319 3.456 20 0 HGADMO C[N@H+](Cc1ccco1)Cc1cncc2c1CCN(c1cc(C(N)=O)cc(Cl)n1)C2 ZINC001164908291 721745807 /nfs/dbraw/zinc/74/58/07/721745807.db2.gz GMGBUPIKBMAOPS-UHFFFAOYSA-N 1 1 411.893 3.017 20 0 HGADMO C[N@@H+](Cc1ccco1)Cc1cncc2c1CCN(c1cc(C(N)=O)cc(Cl)n1)C2 ZINC001164908291 721745809 /nfs/dbraw/zinc/74/58/09/721745809.db2.gz GMGBUPIKBMAOPS-UHFFFAOYSA-N 1 1 411.893 3.017 20 0 HGADMO c1ccc(C[N@H+]2CCc3nc(N4C[C@H](OCC5CC5)[C@H]5COC[C@@H]54)ccc3C2)cc1 ZINC001165016482 721761427 /nfs/dbraw/zinc/76/14/27/721761427.db2.gz WVPQAZWBLZHWRH-XWGVYQGASA-N 1 1 405.542 3.270 20 0 HGADMO COC(=O)c1cc(Cl)nc(N2C[C@@H]3CCC[C@@H]([N@@H+](C)Cc4ccccn4)[C@@H]3C2)n1 ZINC001165028556 721801160 /nfs/dbraw/zinc/80/11/60/721801160.db2.gz ZGXJLTWEKZPDDF-YXJHDRRASA-N 1 1 415.925 3.049 20 0 HGADMO COC(=O)c1cc(OC)cnc1N1C[C@@H]2CCC[C@@H]([N@@H+](C)Cc3ccccn3)[C@@H]2C1 ZINC001165024051 721807191 /nfs/dbraw/zinc/80/71/91/721807191.db2.gz KVVSHVDYPNKTGG-ZLGUVYLKSA-N 1 1 410.518 3.009 20 0 HGADMO CCOC(=O)c1cnc(C)nc1N1C[C@@H]2CCC[C@@H]([N@@H+](C)Cc3ccccn3)[C@@H]2C1 ZINC001165025089 721807224 /nfs/dbraw/zinc/80/72/24/721807224.db2.gz NNIAAZKOOBOTMR-IOMROCGXSA-N 1 1 409.534 3.094 20 0 HGADMO C[N@@H+](Cc1ccc(N2CCO[C@@H]3[C@@H](COCc4nccs4)CC[C@H]32)nc1)C1CC1 ZINC001164916705 721811134 /nfs/dbraw/zinc/81/11/34/721811134.db2.gz ITXWOPNJKNJTLN-SFGWALBWSA-N 1 1 414.575 3.333 20 0 HGADMO CCOC(=O)Cc1ccc(N2C[C@@H]3CCC[C@H]([N@@H+](C)Cc4ccccn4)[C@H]3C2)nc1 ZINC001165026234 721812767 /nfs/dbraw/zinc/81/27/67/721812767.db2.gz POVUMDWPJYGLKG-BVSLBCMMSA-N 1 1 408.546 3.319 20 0 HGADMO C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@@H]2CN(c3ccc(C(=O)NC4CC4)cn3)C[C@@H]21 ZINC001165027402 721814312 /nfs/dbraw/zinc/81/43/12/721814312.db2.gz URGGWCZXMYSATC-BVYCBKJFSA-N 1 1 405.546 3.106 20 0 HGADMO COC(=O)c1cc2c[nH]c(N3C[C@@H]4CCC[C@@H]([N@@H+](C)Cc5ccccn5)[C@@H]4C3)cc-2n1 ZINC001165025522 721820491 /nfs/dbraw/zinc/82/04/91/721820491.db2.gz NEBBWKQOTVVWCK-DKZVUGQWSA-N 1 1 419.529 3.481 20 0 HGADMO COC(=O)c1ccc(-c2ccc(N3CC[C@H]4[C@H]3CC[N@H+]4CCN(C)C)nc2C)cc1 ZINC001164922383 721876616 /nfs/dbraw/zinc/87/66/16/721876616.db2.gz GKFZZNBRNCROKP-FCHUYYIVSA-N 1 1 408.546 3.058 20 0 HGADMO COC(=O)c1ccc(-c2ccc(N3CC[C@H]4[C@H]3CCN4CC[NH+](C)C)nc2C)cc1 ZINC001164922383 721876617 /nfs/dbraw/zinc/87/66/17/721876617.db2.gz GKFZZNBRNCROKP-FCHUYYIVSA-N 1 1 408.546 3.058 20 0 HGADMO CN(C)CC[N@H+]1CC[C@@H]2[C@H]1CCN2c1nnc(Cc2ccccc2)c2ccccc21 ZINC001164929399 721877139 /nfs/dbraw/zinc/87/71/39/721877139.db2.gz BGASTMWZDYQDSI-DNQXCXABSA-N 1 1 401.558 3.435 20 0 HGADMO C[NH+](C)CCN1CC[C@@H]2[C@H]1CCN2c1nnc(Cc2ccccc2)c2ccccc21 ZINC001164929399 721877140 /nfs/dbraw/zinc/87/71/40/721877140.db2.gz BGASTMWZDYQDSI-DNQXCXABSA-N 1 1 401.558 3.435 20 0 HGADMO CN(C)CC[N@@H+]1CC[C@@H]2[C@H]1CCN2[C@H](F)Oc1cccc(-c2ccc(Cl)nn2)c1 ZINC001164935078 721883940 /nfs/dbraw/zinc/88/39/40/721883940.db2.gz VQOUEYJSAKYDIN-SBHAEUEKSA-N 1 1 419.932 3.139 20 0 HGADMO CN(C)CC[N@H+]1CC[C@@H]2[C@H]1CCN2[C@H](F)Oc1cccc(-c2ccc(Cl)nn2)c1 ZINC001164935078 721883941 /nfs/dbraw/zinc/88/39/41/721883941.db2.gz VQOUEYJSAKYDIN-SBHAEUEKSA-N 1 1 419.932 3.139 20 0 HGADMO CN(C)CC[N@H+]1CC[C@@H]2[C@@H]1CCN2c1cc(-c2nc(-c3cccs3)no2)ccn1 ZINC001164934188 721884609 /nfs/dbraw/zinc/88/46/09/721884609.db2.gz QEOMQLWDJQDCBK-DLBZAZTESA-N 1 1 410.547 3.075 20 0 HGADMO C[NH+](C)CCN1CC[C@@H]2[C@@H]1CCN2c1cc(-c2nc(-c3cccs3)no2)ccn1 ZINC001164934188 721884610 /nfs/dbraw/zinc/88/46/10/721884610.db2.gz QEOMQLWDJQDCBK-DLBZAZTESA-N 1 1 410.547 3.075 20 0 HGADMO CN(C)CC[N@H+]1CC[C@H]2[C@H]1CCN2c1cc(-c2nc(-c3cccs3)no2)ccn1 ZINC001164934194 721884987 /nfs/dbraw/zinc/88/49/87/721884987.db2.gz QEOMQLWDJQDCBK-SJORKVTESA-N 1 1 410.547 3.075 20 0 HGADMO C[NH+](C)CCN1CC[C@H]2[C@H]1CCN2c1cc(-c2nc(-c3cccs3)no2)ccn1 ZINC001164934194 721884988 /nfs/dbraw/zinc/88/49/88/721884988.db2.gz QEOMQLWDJQDCBK-SJORKVTESA-N 1 1 410.547 3.075 20 0 HGADMO Cc1ccccc1Oc1nc(Cl)ncc1N1CC[C@H]2[C@@H]1CC[N@H+]2CCN(C)C ZINC001164934093 721888384 /nfs/dbraw/zinc/88/83/84/721888384.db2.gz PMFMTMDNKIYGFN-IRXDYDNUSA-N 1 1 401.942 3.445 20 0 HGADMO Cc1ccccc1Oc1nc(Cl)ncc1N1CC[C@H]2[C@@H]1CC[N@@H+]2CCN(C)C ZINC001164934093 721888386 /nfs/dbraw/zinc/88/83/86/721888386.db2.gz PMFMTMDNKIYGFN-IRXDYDNUSA-N 1 1 401.942 3.445 20 0 HGADMO Cc1cccc(Oc2nc(Cl)ncc2N2CC[C@H]3[C@@H]2CC[N@H+]3CCN(C)C)c1 ZINC001164929613 721888486 /nfs/dbraw/zinc/88/84/86/721888486.db2.gz BXCVIGRQAAGXFF-ROUUACIJSA-N 1 1 401.942 3.445 20 0 HGADMO Cc1cccc(Oc2nc(Cl)ncc2N2CC[C@H]3[C@@H]2CC[N@@H+]3CCN(C)C)c1 ZINC001164929613 721888487 /nfs/dbraw/zinc/88/84/87/721888487.db2.gz BXCVIGRQAAGXFF-ROUUACIJSA-N 1 1 401.942 3.445 20 0 HGADMO Cc1ccc(C[N@H+]2CCOC3(CCN(c4ccc(C(=O)OC(C)C)nn4)CC3)C2)cc1 ZINC001164941017 721923053 /nfs/dbraw/zinc/92/30/53/721923053.db2.gz YUDQPLYJLZTCDS-UHFFFAOYSA-N 1 1 424.545 3.222 20 0 HGADMO COc1ccccc1Oc1nc(Cl)ncc1N1CC[NH+](C[C@H]2CCCO2)CC1 ZINC001165043316 721925642 /nfs/dbraw/zinc/92/56/42/721925642.db2.gz IWTSEQQXYQNLDX-OAHLLOKOSA-N 1 1 404.898 3.232 20 0 HGADMO COc1ccc(-c2ccc(N3CC[NH+](CCOc4ccccc4)CC3)nn2)c(OC)c1 ZINC001165044280 721960825 /nfs/dbraw/zinc/96/08/25/721960825.db2.gz HJZZXJDOZCUPSU-UHFFFAOYSA-N 1 1 420.513 3.362 20 0 HGADMO CC(=O)N1CC[C@]2(c3ccccc3)CCN(c3ccc(C[N@H+](C)C4CC4)cn3)C[C@H]12 ZINC001164947820 721967699 /nfs/dbraw/zinc/96/76/99/721967699.db2.gz RNIUQHIOUGNEQR-ZCYQVOJMSA-N 1 1 404.558 3.445 20 0 HGADMO O=C1NCC[N@@H+](Cc2ccccc2)C12CCN(c1nccc3c(Cl)ccnc31)CC2 ZINC001164944501 721970530 /nfs/dbraw/zinc/97/05/30/721970530.db2.gz JKTNMXHZLIBKRT-UHFFFAOYSA-N 1 1 421.932 3.254 20 0 HGADMO O=C1NCC[N@H+](Cc2ccccc2)C12CCN(c1nccc3c(Cl)ccnc31)CC2 ZINC001164944501 721970532 /nfs/dbraw/zinc/97/05/32/721970532.db2.gz JKTNMXHZLIBKRT-UHFFFAOYSA-N 1 1 421.932 3.254 20 0 HGADMO COC[C@]12COC[C@@H]1CN(c1nc(C[NH+]3CCCC3)nc3sc(C)c(C)c31)C2 ZINC001164953915 721995204 /nfs/dbraw/zinc/99/52/04/721995204.db2.gz SNDGJFBLNBAZOZ-HRAATJIYSA-N 1 1 402.564 3.003 20 0 HGADMO CCOC(=O)c1c[n-]c2nc[nH+]c(N3CCC4(CC[N@@H+](Cc5cccnc5)C4)CC3)c12 ZINC001164952610 722014693 /nfs/dbraw/zinc/01/46/93/722014693.db2.gz ONNAMBRYDXAJCZ-UHFFFAOYSA-N 1 1 420.517 3.022 20 0 HGADMO CCOC(=O)c1c[nH]c2ncnc(N3CCC4(CC[N@H+](Cc5cccnc5)C4)CC3)c12 ZINC001164952610 722014696 /nfs/dbraw/zinc/01/46/96/722014696.db2.gz ONNAMBRYDXAJCZ-UHFFFAOYSA-N 1 1 420.517 3.022 20 0 HGADMO CCOC(=O)c1c[nH]c2ncnc(N3CCC4(CC[N@@H+](Cc5cccnc5)C4)CC3)c12 ZINC001164952610 722014699 /nfs/dbraw/zinc/01/46/99/722014699.db2.gz ONNAMBRYDXAJCZ-UHFFFAOYSA-N 1 1 420.517 3.022 20 0 HGADMO O=C1NCc2c1c(N1CCC3(CC[N@@H+](Cc4cccnc4)C3)CC1)nc(Cl)c2F ZINC001164953230 722018991 /nfs/dbraw/zinc/01/89/91/722018991.db2.gz UFQGLYLJJBTUPI-UHFFFAOYSA-N 1 1 415.900 3.005 20 0 HGADMO NC(=O)c1cc2ccccc2c(N2CCC3(CC[N@@H+](Cc4cccnc4)C3)CC2)n1 ZINC001164955251 722022653 /nfs/dbraw/zinc/02/26/53/722022653.db2.gz BYUAOWISLYMGAX-UHFFFAOYSA-N 1 1 401.514 3.221 20 0 HGADMO CSc1nc(Cl)cc(N2CCC3(CC2)COCC[N@@H+](Cc2ccncc2)C3)n1 ZINC001164959527 722052639 /nfs/dbraw/zinc/05/26/39/722052639.db2.gz MJPILBXNZHEACS-UHFFFAOYSA-N 1 1 419.982 3.366 20 0 HGADMO FC(F)(c1nccc(Cl)n1)N1CCC2(CC1)COCC[N@@H+](Cc1ccncc1)C2 ZINC001164961900 722053164 /nfs/dbraw/zinc/05/31/64/722053164.db2.gz XSHGZOBJZSWKCW-UHFFFAOYSA-N 1 1 423.895 3.189 20 0 HGADMO Fc1ccc2ncc(N3CCC4(CC3)COCC[N@@H+](Cc3ccncc3)C4)nc2c1 ZINC001164963073 722055320 /nfs/dbraw/zinc/05/53/20/722055320.db2.gz HAELLJRDUVQCMD-UHFFFAOYSA-N 1 1 407.493 3.283 20 0 HGADMO Clc1cc2[nH]cnc2nc1N1CCC2(CC1)COCC[N@@H+](Cc1ccncc1)C2 ZINC001164963799 722057426 /nfs/dbraw/zinc/05/74/26/722057426.db2.gz LITZXIFOLVQDPA-UHFFFAOYSA-N 1 1 412.925 3.125 20 0 HGADMO Clc1cc2nc[nH]c2nc1N1CCC2(CC1)COCC[N@H+](Cc1ccncc1)C2 ZINC001164963799 722057428 /nfs/dbraw/zinc/05/74/28/722057428.db2.gz LITZXIFOLVQDPA-UHFFFAOYSA-N 1 1 412.925 3.125 20 0 HGADMO Clc1cc2nc[nH]c2nc1N1CCC2(CC1)COCC[N@@H+](Cc1ccncc1)C2 ZINC001164963799 722057431 /nfs/dbraw/zinc/05/74/31/722057431.db2.gz LITZXIFOLVQDPA-UHFFFAOYSA-N 1 1 412.925 3.125 20 0 HGADMO FC(F)(c1cncc(Cl)n1)N1CCC2(CC1)COCC[N@@H+](Cc1ccncc1)C2 ZINC001164960735 722058382 /nfs/dbraw/zinc/05/83/82/722058382.db2.gz JXWBQUIHEIKGDI-UHFFFAOYSA-N 1 1 423.895 3.189 20 0 HGADMO Cc1nnc(N2CCC3(CC2)COCC[N@@H+](Cc2ccncc2)C3)c2ccccc12 ZINC001164962211 722059191 /nfs/dbraw/zinc/05/91/91/722059191.db2.gz QDXRAVUPRHHVRD-UHFFFAOYSA-N 1 1 403.530 3.452 20 0 HGADMO CC(=O)N1[C@@H]2CC[N@@H+](C(C)(C)c3ccnc(Cl)c3)C[C@H]2C[C@H]1Cn1cccn1 ZINC001164970768 722081285 /nfs/dbraw/zinc/08/12/85/722081285.db2.gz RLUQSBMMLFKMLP-NZSAHSFTSA-N 1 1 401.942 3.178 20 0 HGADMO O=C(NC1CCC1)C1C[C@H]2CN(c3nc(Cl)ccc3C[NH+]3CCCC3)C[C@@H]2C1 ZINC001164976521 722085105 /nfs/dbraw/zinc/08/51/05/722085105.db2.gz VMKPXXLQIKBMRN-ROUUACIJSA-N 1 1 402.970 3.462 20 0 HGADMO FC(F)(c1ccc(Cl)nc1)N1CC[C@@H]2C[N@@H+](Cc3cccnc3)CCO[C@@H]2C1 ZINC001164981350 722098582 /nfs/dbraw/zinc/09/85/82/722098582.db2.gz LDPSFBSEVXSMBQ-SJLPKXTDSA-N 1 1 408.880 3.402 20 0 HGADMO FC(F)(c1ccnc(Cl)c1)N1CC[C@@H]2C[N@@H+](Cc3cccnc3)CCO[C@H]2C1 ZINC001164986537 722100629 /nfs/dbraw/zinc/10/06/29/722100629.db2.gz ZGZOVUHCEZCHKK-AEFFLSMTSA-N 1 1 408.880 3.402 20 0 HGADMO Cc1nc(Cl)cc(C(F)(F)N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)n1 ZINC001164985716 722105625 /nfs/dbraw/zinc/10/56/25/722105625.db2.gz WGTJXLIJJFZDAL-SJORKVTESA-N 1 1 423.895 3.106 20 0 HGADMO FC(F)(Oc1cccnc1Cl)N1CC[C@@H]2C[N@@H+](Cc3cccnc3)CCO[C@@H]2C1 ZINC001164986650 722107025 /nfs/dbraw/zinc/10/70/25/722107025.db2.gz ZYSVZHBNYWUGSX-SJLPKXTDSA-N 1 1 424.879 3.282 20 0 HGADMO Clc1ccc2c(c1)ncnc2N1CC[C@@H]2C[N@@H+](Cc3cccnc3)CCO[C@@H]2C1 ZINC001164982132 722109917 /nfs/dbraw/zinc/10/99/17/722109917.db2.gz WCEXXTCXCGMNLJ-DYESRHJHSA-N 1 1 409.921 3.406 20 0 HGADMO Clc1ccc2c(c1)ncnc2N1CC[C@@H]2C[N@@H+](Cc3cccnc3)CCO[C@H]2C1 ZINC001164982140 722110287 /nfs/dbraw/zinc/11/02/87/722110287.db2.gz WCEXXTCXCGMNLJ-UTKZUKDTSA-N 1 1 409.921 3.406 20 0 HGADMO Clc1ccnc2cc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)ncc12 ZINC001164971857 722113826 /nfs/dbraw/zinc/11/38/26/722113826.db2.gz CRRZQASFVTUBEB-UWJYYQICSA-N 1 1 409.921 3.406 20 0 HGADMO CCc1c(Cl)nnc(N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)c1CC ZINC001164980413 722119649 /nfs/dbraw/zinc/11/96/49/722119649.db2.gz RDBQBYGFHZKXFF-XLIONFOSSA-N 1 1 415.969 3.377 20 0 HGADMO COc1cc(N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)nc2ccccc21 ZINC001164984645 722132400 /nfs/dbraw/zinc/13/24/00/722132400.db2.gz YEWRKXCHLXULCP-WMZHIEFXSA-N 1 1 404.514 3.366 20 0 HGADMO COc1ccc2ccnc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)c2c1 ZINC001164974133 722133939 /nfs/dbraw/zinc/13/39/39/722133939.db2.gz CJLGOQXLUZOFCS-REWPJTCUSA-N 1 1 404.514 3.366 20 0 HGADMO Cc1nc(C2CC2)nc(Cl)c1N1CC[C@H]2C[N@@H+](Cc3cccnc3)CCO[C@@H]2C1 ZINC001164973137 722144517 /nfs/dbraw/zinc/14/45/17/722144517.db2.gz BAPRDOZEDRUVFW-RBUKOAKNSA-N 1 1 413.953 3.438 20 0 HGADMO Cc1cc(N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)nc(-c2ccco2)n1 ZINC001164983861 722147423 /nfs/dbraw/zinc/14/74/23/722147423.db2.gz VWQMEYOWTNZJAR-CTNGQTDRSA-N 1 1 405.502 3.167 20 0 HGADMO Cc1cc2ncnc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)c2cc1C ZINC001164972658 722152510 /nfs/dbraw/zinc/15/25/10/722152510.db2.gz IVMMVXOCEGGQHZ-OFNKIYASSA-N 1 1 403.530 3.369 20 0 HGADMO Fc1ccc(-c2cncc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)n2)cc1 ZINC001164971144 722153970 /nfs/dbraw/zinc/15/39/70/722153970.db2.gz AUDYYFGZWJBRDS-REWPJTCUSA-N 1 1 419.504 3.405 20 0 HGADMO CSc1cc(N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)nc(SC)n1 ZINC001164974787 722156019 /nfs/dbraw/zinc/15/60/19/722156019.db2.gz QLGJLMONQXNIRI-IAGOWNOFSA-N 1 1 417.604 3.043 20 0 HGADMO CCCc1cc(N2CC[C@@H]3OCCN(Cc4csc(C)n4)[C@H]3CC2)nc(C)[nH+]1 ZINC001164988484 722183991 /nfs/dbraw/zinc/18/39/91/722183991.db2.gz JRPJFZCAQUEYNO-PMACEKPBSA-N 1 1 401.580 3.372 20 0 HGADMO COC(=O)Cc1c(Cl)ncnc1N1CCC[C@@]2(CC[N@H+]2Cc2cccc(F)c2)C1 ZINC001164993996 722197207 /nfs/dbraw/zinc/19/72/07/722197207.db2.gz KKPZFWNJHGMIDU-OAQYLSRUSA-N 1 1 418.900 3.230 20 0 HGADMO CON(C)C(=O)c1cc(C)cnc1N1CCC[C@@]2(CC[N@H+]2Cc2cccc(F)c2)C1 ZINC001164993773 722205728 /nfs/dbraw/zinc/20/57/28/722205728.db2.gz BEMMRNIKXOIOOX-HSZRJFAPSA-N 1 1 412.509 3.407 20 0 HGADMO COC(=O)CSc1cncc(N2CCC[C@]3(CC[N@H+]3Cc3cccc(F)c3)C2)n1 ZINC001164993730 722209695 /nfs/dbraw/zinc/20/96/95/722209695.db2.gz AFZWXQYORQQWEA-NRFANRHFSA-N 1 1 416.522 3.126 20 0 HGADMO Fc1cccc(C[N@H+]2CC[C@@]23CCCN(c2cc(N4CCSCC4)ncn2)C3)c1 ZINC001164997847 722211000 /nfs/dbraw/zinc/21/10/00/722211000.db2.gz SLCSSIDFCUSMER-JOCHJYFZSA-N 1 1 413.566 3.414 20 0 HGADMO Cc1ccc2c(c1)nc(Cl)cc2N1CCc2ncnc(N3CC[NH+](C)CC3)c2CC1 ZINC001164997633 722235143 /nfs/dbraw/zinc/23/51/43/722235143.db2.gz SNRDMSOMDCFGHH-UHFFFAOYSA-N 1 1 422.964 3.344 20 0 HGADMO O=C1Nc2ccccc2[C@@H]2CN(c3ncnc4c3CC[N@H+](Cc3ccccc3)C4)C[C@@H]12 ZINC001164403208 718856660 /nfs/dbraw/zinc/85/66/60/718856660.db2.gz ICJILAXKQTZMQO-LEWJYISDSA-N 1 1 411.509 3.207 20 0 HGADMO O=C1Nc2ccccc2[C@@H]2CN(c3ncnc4c3CC[N@@H+](Cc3ccccc3)C4)C[C@@H]12 ZINC001164403208 718856661 /nfs/dbraw/zinc/85/66/61/718856661.db2.gz ICJILAXKQTZMQO-LEWJYISDSA-N 1 1 411.509 3.207 20 0 HGADMO CCOC(=O)c1cc2n(n1)CCCN(c1nc(Cl)ccc1C[NH+]1CCCC1)C2 ZINC001164410262 718866679 /nfs/dbraw/zinc/86/66/79/718866679.db2.gz YNDBBPMRTWYXMW-UHFFFAOYSA-N 1 1 403.914 3.114 20 0 HGADMO CCOC(=O)c1cnc(SC)nc1N1CCC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21 ZINC001164620927 719054148 /nfs/dbraw/zinc/05/41/48/719054148.db2.gz HJFBVDNSOQFLMN-MJGOQNOKSA-N 1 1 412.559 3.476 20 0 HGADMO Cc1noc([C@@H]2C[C@@H]3CCN(c4nc(Cl)ccc4C[NH+]4CCCC4)C[C@H]3O2)n1 ZINC001164648039 719299816 /nfs/dbraw/zinc/29/98/16/719299816.db2.gz FQIOFNKJKNQWOY-BHYGNILZSA-N 1 1 403.914 3.379 20 0 HGADMO COC(=O)c1ccc2nc(N3CCc4c(C[NH+](C)C)nn(C(C)C)c4C3)ccc2c1 ZINC001164647574 719310255 /nfs/dbraw/zinc/31/02/55/719310255.db2.gz DBTVLCVTAOVXKJ-UHFFFAOYSA-N 1 1 407.518 3.423 20 0 HGADMO CC(C)n1nc(C[NH+](C)C)c2c1CN(C(F)(F)c1cc(Cl)nc(=S)[nH]1)CC2 ZINC001164653559 719313925 /nfs/dbraw/zinc/31/39/25/719313925.db2.gz VQRBLXDXHPSAFG-UHFFFAOYSA-N 1 1 416.929 3.365 20 0 HGADMO C[N@H+]1CCO[C@@H]2CN(c3nc(-c4cccnc4)nc4sc5c(c43)CCCC5)C[C@H]21 ZINC000301684046 719434190 /nfs/dbraw/zinc/43/41/90/719434190.db2.gz WIDIEGFCNZTWRM-IAGOWNOFSA-N 1 1 407.543 3.151 20 0 HGADMO CNC(=O)C[N@H+]1CCCC12CCN(C(F)(F)c1ccc(Cl)c(Cl)n1)CC2 ZINC001164687328 719717189 /nfs/dbraw/zinc/71/71/89/719717189.db2.gz WDUMNTBUKQNHTB-UHFFFAOYSA-N 1 1 407.292 3.114 20 0 HGADMO Cc1nc(C[N@H+]2CCCC23CCN(c2nc(Cl)ccc2C(N)=O)CC3)cs1 ZINC001164692899 719809181 /nfs/dbraw/zinc/80/91/81/719809181.db2.gz NNMQKTDORAWKLF-UHFFFAOYSA-N 1 1 405.955 3.234 20 0 HGADMO COC(=O)[C@]1(C)C[C@H]([NH+]2CCOCC2)CCN1c1ncnc2sc(C(C)C)cc21 ZINC001164707035 719838226 /nfs/dbraw/zinc/83/82/26/719838226.db2.gz YXCYYGQGOVUGOL-VFNWGFHPSA-N 1 1 418.563 3.047 20 0 HGADMO COC(=O)[C@@]1(C)C[C@H]([NH+]2CCOCC2)CCN1c1nccc2cc(Cl)ccc21 ZINC001164697222 719849613 /nfs/dbraw/zinc/84/96/13/719849613.db2.gz BTRYXECWVAIPST-DYESRHJHSA-N 1 1 403.910 3.121 20 0 HGADMO COC(=O)[C@]1(C)C[C@H]([NH+]2CCOCC2)CCN1c1cc(Cl)nc2cc(C)ccc21 ZINC001164701035 719858510 /nfs/dbraw/zinc/85/85/10/719858510.db2.gz JBIXAVMBBPVMLW-ZHRRBRCNSA-N 1 1 417.937 3.429 20 0 HGADMO COC(=O)[C@]1(C)C[C@@H]([NH+]2CCOCC2)CCN1c1cc(Cl)nc2cc(C)ccc21 ZINC001164701026 719858542 /nfs/dbraw/zinc/85/85/42/719858542.db2.gz JBIXAVMBBPVMLW-AOMKIAJQSA-N 1 1 417.937 3.429 20 0 HGADMO COc1cnc(SC)nc1N1CCC2(CC1)C[N@@H+](Cc1cccs1)CCO2 ZINC001164696111 719887467 /nfs/dbraw/zinc/88/74/67/719887467.db2.gz XMPPJAYLMCPSSY-UHFFFAOYSA-N 1 1 406.577 3.140 20 0 HGADMO CCOC(=O)c1cnc(N2CCC3(CC2)C[N@@H+](Cc2cccs2)CCO3)c(C)c1 ZINC001164695704 719889814 /nfs/dbraw/zinc/88/98/14/719889814.db2.gz RSLBVHNWFPFKPT-UHFFFAOYSA-N 1 1 415.559 3.500 20 0 HGADMO CSc1nc(Cl)nc(N2CCC3(CC2)C[N@H+](Cc2cccs2)CCO3)n1 ZINC001164694647 719890004 /nfs/dbraw/zinc/89/00/04/719890004.db2.gz BQIWLOSVWXMAPX-UHFFFAOYSA-N 1 1 411.984 3.180 20 0 HGADMO CSc1nc(Cl)nc(N2CCC3(CC2)C[N@@H+](Cc2cccs2)CCO3)n1 ZINC001164694647 719890005 /nfs/dbraw/zinc/89/00/05/719890005.db2.gz BQIWLOSVWXMAPX-UHFFFAOYSA-N 1 1 411.984 3.180 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1cc(C(=O)OC(C)(C)C)ccn1)C2 ZINC001164811291 720081852 /nfs/dbraw/zinc/08/18/52/720081852.db2.gz NSLSEFQSRJTTHA-WMZHIEFXSA-N 1 1 401.551 3.222 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(C(F)(F)Oc1cccnc1Cl)C2 ZINC001164807381 720090306 /nfs/dbraw/zinc/09/03/06/720090306.db2.gz FHPIEFBFZQBZJG-CRAIPNDOSA-N 1 1 401.885 3.344 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(C(F)(F)Oc1ccc(Cl)nc1)C2 ZINC001164813192 720094972 /nfs/dbraw/zinc/09/49/72/720094972.db2.gz TUJYGKMTBDLDID-CRAIPNDOSA-N 1 1 401.885 3.344 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1nc(Cl)nc3c1COC3(C)C)C2 ZINC001164814863 720095732 /nfs/dbraw/zinc/09/57/32/720095732.db2.gz XMSSMMOYBUVHNX-VFNWGFHPSA-N 1 1 406.958 3.080 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1nc(Cl)nc(-c3ccccc3)n1)C2 ZINC001164806447 720099725 /nfs/dbraw/zinc/09/97/25/720099725.db2.gz CYZWPPSGISUKJF-PGRDOPGGSA-N 1 1 413.953 3.377 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1nccc3cc(C(=O)OC)ccc31)C2 ZINC001164811113 720101995 /nfs/dbraw/zinc/10/19/95/720101995.db2.gz LKQZIQSLEWFUJS-RDPSFJRHSA-N 1 1 409.530 3.206 20 0 HGADMO COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1nccc(C(=O)OC)c1C)CC2 ZINC001164717329 720107974 /nfs/dbraw/zinc/10/79/74/720107974.db2.gz NELAJFMVJVQLKM-FQEVSTJZSA-N 1 1 424.545 3.079 20 0 HGADMO COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1cc(N)cc(Cl)n1)CC2 ZINC001164714897 720110972 /nfs/dbraw/zinc/11/09/72/720110972.db2.gz DQEBNSFCCACFNN-GOSISDBHSA-N 1 1 401.942 3.220 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1ccc3cc(OC)c(OC)cc3n1)C2 ZINC001164807010 720133310 /nfs/dbraw/zinc/13/33/10/720133310.db2.gz ADDVZXWIMCMOEU-YADARESESA-N 1 1 411.546 3.437 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1nc3ccccc3cc1C(=O)OC)C2 ZINC001164815421 720141846 /nfs/dbraw/zinc/14/18/46/720141846.db2.gz VNVKHJGKHNPUGO-CYFREDJKSA-N 1 1 409.530 3.206 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1nccc(-c3ccc(N(C)C)cc3)n1)C2 ZINC001164817540 720150897 /nfs/dbraw/zinc/15/08/97/720150897.db2.gz PUNQOEFSRGUIJY-PXDATVDWSA-N 1 1 421.589 3.394 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1ncc3c(n1)-c1ccccc1CC3)C2 ZINC001164817798 720151004 /nfs/dbraw/zinc/15/10/04/720151004.db2.gz QHJGXRLFOWFUPE-OFVILXPXSA-N 1 1 404.558 3.427 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1ccc(-c3ccccc3OC)nn1)C2 ZINC001164819872 720170284 /nfs/dbraw/zinc/17/02/84/720170284.db2.gz YVGURGOQVWAGRI-CYFREDJKSA-N 1 1 408.546 3.337 20 0 HGADMO CC(C)[N@@H+](C)Cc1cc(=O)n2c(n1)CN(c1nccc3c(Cl)ccnc31)CCC2 ZINC001164812963 720214190 /nfs/dbraw/zinc/21/41/90/720214190.db2.gz NMFAQRKCICGCSX-UHFFFAOYSA-N 1 1 412.925 3.090 20 0 HGADMO COc1ccc2ccnc(N3CCCn4c(=O)cc(C[N@@H+](C)C(C)C)nc4C3)c2c1 ZINC001164814516 720230376 /nfs/dbraw/zinc/23/03/76/720230376.db2.gz WQHZZXQRAWUQMD-UHFFFAOYSA-N 1 1 407.518 3.051 20 0 HGADMO CCOC(=O)c1cc2cccnc2nc1N1CC[C@@H]2[C@H]1CC[N@H+]2Cc1cccnc1 ZINC001164725401 720380564 /nfs/dbraw/zinc/38/05/64/720380564.db2.gz NFOLIKPSHNJBMZ-WOJBJXKFSA-N 1 1 403.486 3.055 20 0 HGADMO CCOC(=O)c1cc2ncnc(N3CC[C@@H]4[C@H]3CC[N@H+]4Cc3cccnc3)c2s1 ZINC001164734252 720411184 /nfs/dbraw/zinc/41/11/84/720411184.db2.gz RHIZQKCUCXNJIA-IAGOWNOFSA-N 1 1 409.515 3.116 20 0 HGADMO COC(=O)C[C@H](c1ccnc(N2CC[C@@H]3[C@H]2CC[N@H+]3Cc2cccnc2)c1)C1CC1 ZINC001164731536 720429139 /nfs/dbraw/zinc/42/91/39/720429139.db2.gz LQDXAKXIKMEAKY-BHDDXSALSA-N 1 1 406.530 3.387 20 0 HGADMO c1ccc2nc(N3CC[C@H]4[C@H]3CC[N@@H+]4Cc3cccnc3)c(N3CCCC3)nc2c1 ZINC001164726268 720429559 /nfs/dbraw/zinc/42/95/59/720429559.db2.gz BFVUUKOUTPOMJL-FCHUYYIVSA-N 1 1 400.530 3.478 20 0 HGADMO C[C@@H]1CCCN(C(=O)c2ccc(N3CC[C@H]4[C@@H]3CC[N@H+]4Cc3cccnc3)nc2)C1 ZINC001164731480 720435586 /nfs/dbraw/zinc/43/55/86/720435586.db2.gz KWNMNGMOPYWHMW-COPCDDAFSA-N 1 1 405.546 3.202 20 0 HGADMO COc1ccc(-c2ccc(N3CC[C@H]4[C@H]3CC[N@H+]4Cc3cccnc3)nn2)c(OC)c1 ZINC001164735365 720458008 /nfs/dbraw/zinc/45/80/08/720458008.db2.gz WQXFFJDUPXAMDD-FCHUYYIVSA-N 1 1 417.513 3.409 20 0 HGADMO COC(=O)c1nc(N2CC[C@H]3[C@@H]2CC[N@H+]3Cc2cccnc2)c2ccccc2c1OC ZINC001164735069 720461008 /nfs/dbraw/zinc/46/10/08/720461008.db2.gz VMWBOBHGKAUJSN-PMACEKPBSA-N 1 1 418.497 3.278 20 0 HGADMO COc1nc2ccccc2nc1N1CC[C@@H]2[C@@H](C[C@@H](Cn3cccn3)[N@H+]2C(C)C)C1 ZINC001164838520 720522362 /nfs/dbraw/zinc/52/23/62/720522362.db2.gz RNUFFZYDPSVOAM-BBTUJRGHSA-N 1 1 406.534 3.213 20 0 HGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@@H]2CN(c3nc(Cl)nc4c3SCC4)CC[C@@H]21 ZINC001164833640 720530781 /nfs/dbraw/zinc/53/07/81/720530781.db2.gz BBLYDWIMDKREBF-VYDXJSESSA-N 1 1 418.998 3.353 20 0 HGADMO CC(C)[N@@H+]1[C@@H]2CCN(c3nc4ncccc4nc3Cl)C[C@@H]2C[C@H]1Cn1cccn1 ZINC001164843073 720542672 /nfs/dbraw/zinc/54/26/72/720542672.db2.gz ZWDCCNHNKQQDFU-XYJFISCASA-N 1 1 411.941 3.253 20 0 HGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@H]2CN(C(F)(F)c3cnnc(Cl)c3)CC[C@@H]21 ZINC001164841385 720544494 /nfs/dbraw/zinc/54/44/94/720544494.db2.gz URYVWIXXKKLUHC-XIRDDKMYSA-N 1 1 410.900 3.249 20 0 HGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@@H]2CN([C@@H](F)Oc3ccc(Cl)nc3)CC[C@@H]21 ZINC001164839551 720545236 /nfs/dbraw/zinc/54/52/36/720545236.db2.gz QMROUIYSHDULJJ-NDUPCHFUSA-N 1 1 407.921 3.437 20 0 HGADMO COC(=O)c1ccc(Cl)c(N2CC[C@@H]3[C@H](C[C@@H](Cn4cccn4)[N@H+]3C(C)C)C2)n1 ZINC001164839643 720553929 /nfs/dbraw/zinc/55/39/29/720553929.db2.gz RDJQBDCNYFRONS-JTDSTZFVSA-N 1 1 417.941 3.096 20 0 HGADMO CC(C)[N@@H+]1[C@@H]2CCN(c3nccc(N4CCCCC4)n3)C[C@H]2C[C@H]1Cn1cccn1 ZINC001164837400 720567660 /nfs/dbraw/zinc/56/76/60/720567660.db2.gz MGVXQIBBNXAMLL-QHAWAJNXSA-N 1 1 409.582 3.041 20 0 HGADMO COc1cc2c(cc1F)ncnc2N1CC[C@@H]2[C@@H](C[C@H](Cn3cccn3)[N@H+]2C(C)C)C1 ZINC001164840204 720570310 /nfs/dbraw/zinc/57/03/10/720570310.db2.gz SDPWJIQEJODWKN-CSODHUTKSA-N 1 1 424.524 3.352 20 0 HGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@@H]2CN(c3cc(-c4ccncc4)ncn3)CC[C@@H]21 ZINC001164841339 720613177 /nfs/dbraw/zinc/61/31/77/720613177.db2.gz RWQLLDIHLCMWLS-URVUXULASA-N 1 1 403.534 3.113 20 0 HGADMO FC(F)(c1ccc(Cl)nc1Cl)N1CC[N@@H+]2C[C@H](Oc3cncnc3)C[C@H]2C1 ZINC001164744266 720618101 /nfs/dbraw/zinc/61/81/01/720618101.db2.gz QXJAFYQDTRUSQT-NWDGAFQWSA-N 1 1 416.259 3.065 20 0 HGADMO FC(F)(c1ccc(Cl)nc1Cl)N1CC[N@H+]2C[C@H](Oc3cncnc3)C[C@H]2C1 ZINC001164744266 720618113 /nfs/dbraw/zinc/61/81/13/720618113.db2.gz QXJAFYQDTRUSQT-NWDGAFQWSA-N 1 1 416.259 3.065 20 0 HGADMO CC(C)[N@H+]1[C@@H](Cn2cccn2)C[C@H]2CN(c3cc(N4CCC[C@@H](C)C4)ncn3)CC[C@H]21 ZINC001164836246 720624390 /nfs/dbraw/zinc/62/43/90/720624390.db2.gz FNPIOQHVEOSFQR-CIAFKFPVSA-N 1 1 423.609 3.287 20 0 HGADMO CN(C)c1nc(Cl)cc(N2CCC3(C[C@H]([N@@H+](C)Cc4ccccc4)CO3)CC2)n1 ZINC001164841035 720656609 /nfs/dbraw/zinc/65/66/09/720656609.db2.gz OSFLALJCWWYEKC-SFHVURJKSA-N 1 1 415.969 3.456 20 0 HGADMO CC(C)(C)c1cc2ncnc(N3CC[N@H+]4C[C@H](Oc5cncnc5)C[C@@H]4C3)c2s1 ZINC001164743212 720656780 /nfs/dbraw/zinc/65/67/80/720656780.db2.gz XBRONWLHIBIQOW-HUUCEWRRSA-N 1 1 410.547 3.121 20 0 HGADMO CCOC(=O)Cc1cccnc1N1CCC2(C[C@@H]([N@@H+](C)Cc3ccccc3)CO2)CC1 ZINC001164841849 720670935 /nfs/dbraw/zinc/67/09/35/720670935.db2.gz QPTKAHBIGOMBFT-JOCHJYFZSA-N 1 1 423.557 3.447 20 0 HGADMO c1ccc(-c2nc3ccccc3c(N3CC[N@@H+]4C[C@H](Oc5cncnc5)C[C@H]4C3)n2)cc1 ZINC001164737564 720675709 /nfs/dbraw/zinc/67/57/09/720675709.db2.gz GECIPGOTGKGKCR-VQTJNVASSA-N 1 1 424.508 3.429 20 0 HGADMO C[N@@H+](Cc1ccccc1)[C@@H]1COC2(C1)CCN(c1ncnc3cnc(F)cc31)CC2 ZINC001164843752 720677668 /nfs/dbraw/zinc/67/76/68/720677668.db2.gz QPFDIBBUOGMLAK-SFHVURJKSA-N 1 1 407.493 3.424 20 0 HGADMO COc1cnnc(Cl)c1N1CCC2(C[C@@H]([N@@H+](C)Cc3ccccc3)CO2)CC1 ZINC001164842718 720688765 /nfs/dbraw/zinc/68/87/65/720688765.db2.gz MXWDDCGKYRLTQL-QGZVFWFLSA-N 1 1 402.926 3.399 20 0 HGADMO Clc1cccc2nc(Cl)nc(N3CC[N@H+]4C[C@@H](Oc5cncnc5)C[C@@H]4C3)c12 ZINC001164737952 720695401 /nfs/dbraw/zinc/69/54/01/720695401.db2.gz HWMBHCURWKQZQC-OLZOCXBDSA-N 1 1 417.300 3.069 20 0 HGADMO COc1cnc(N2CC[N@H+]3C[C@@H](Oc4cncnc4)C[C@@H]3C2)c2cc(Cl)ccc12 ZINC001164740106 720697331 /nfs/dbraw/zinc/69/73/31/720697331.db2.gz QARIHEZOSRGOIR-CVEARBPZSA-N 1 1 411.893 3.029 20 0 HGADMO CCn1cnc2c1ncnc2N1CCC2(C[C@@H]([N@@H+](C)Cc3ccccc3)CO2)CC1 ZINC001164840932 720713175 /nfs/dbraw/zinc/71/31/75/720713175.db2.gz SSGOHKLHOMRONM-LJQANCHMSA-N 1 1 406.534 3.106 20 0 HGADMO COc1nc(N2CCC3(C[C@H]([N@@H+](C)Cc4ccccc4)CO3)CC2)nc2c1ccn2C ZINC001164842276 720725606 /nfs/dbraw/zinc/72/56/06/720725606.db2.gz XKQSABDCBXQUDZ-IBGZPJMESA-N 1 1 421.545 3.237 20 0 HGADMO CC[C@H]1N(c2ncnc3c2CC[N@H+](Cc2ccccc2)C3)CCC[C@@]12CCC(=O)N2 ZINC001164843910 720750994 /nfs/dbraw/zinc/75/09/94/720750994.db2.gz MNKHHZYGZRJSND-ZJSXRUAMSA-N 1 1 405.546 3.063 20 0 HGADMO CC[C@H]1N(c2ncnc3c2CC[N@@H+](Cc2ccccc2)C3)CCC[C@@]12CCC(=O)N2 ZINC001164843910 720751000 /nfs/dbraw/zinc/75/10/00/720751000.db2.gz MNKHHZYGZRJSND-ZJSXRUAMSA-N 1 1 405.546 3.063 20 0 HGADMO C[N@@H+](Cc1ccc(N2CC[C@@H]3O[C@H](COCc4ccccn4)CC[C@@H]32)nc1)C1CC1 ZINC001164845172 720778634 /nfs/dbraw/zinc/77/86/34/720778634.db2.gz FIZPNCGBGJYNCC-VABKMULXSA-N 1 1 408.546 3.414 20 0 HGADMO Clc1cccc2nc(Cl)c(N3CC[N@H+]4C[C@H](Oc5cncnc5)C[C@H]4C3)nc12 ZINC001164742757 720800760 /nfs/dbraw/zinc/80/07/60/720800760.db2.gz DMYSRNGNJPMXAM-QWHCGFSZSA-N 1 1 417.300 3.069 20 0 HGADMO Clc1cc(Cl)nc(N2CC[C@@H]3[C@H](C[C@H](Cn4cncn4)[N@H+]3CC3CC3)C2)c1 ZINC001164748927 720810300 /nfs/dbraw/zinc/81/03/00/720810300.db2.gz RXKMCVBQGOYUTL-DJIMGWMZSA-N 1 1 407.349 3.359 20 0 HGADMO Clc1ccnc2c1ccnc2N1CC[C@@H]2[C@@H](C[C@@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164738782 720815411 /nfs/dbraw/zinc/81/54/11/720815411.db2.gz GLOIGAXYFNIEFE-ABSDTBQOSA-N 1 1 423.952 3.254 20 0 HGADMO Clc1nc2ccccc2nc1N1CC[C@@H]2[C@H](C[C@@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164739797 720823119 /nfs/dbraw/zinc/82/31/19/720823119.db2.gz IRAHDJVHQJAXBI-FUHIMQAGSA-N 1 1 423.952 3.254 20 0 HGADMO CCc1cc2c(ncnc2N2CC[C@@H]3[C@@H](C[C@H](Cn4cncn4)[N@H+]3CC3CC3)C2)s1 ZINC001164743808 720827294 /nfs/dbraw/zinc/82/72/94/720827294.db2.gz SKLUWRKWOTVOAH-SQGPQFPESA-N 1 1 423.590 3.225 20 0 HGADMO Clc1ccnc2nc(N3CC[C@@H]4[C@@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)ccc12 ZINC001164742975 720834572 /nfs/dbraw/zinc/83/45/72/720834572.db2.gz HQQTUOALANNEQS-ABSDTBQOSA-N 1 1 423.952 3.254 20 0 HGADMO CSc1ccnc(Cl)c1N1CC[C@@H]2[C@H](C[C@@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164746697 720836055 /nfs/dbraw/zinc/83/60/55/720836055.db2.gz PZDVADFMKWXSDM-IXDOHACOSA-N 1 1 418.998 3.428 20 0 HGADMO COCC[N@H+]1CCO[C@H]2CN(c3ncnc4cc(C(C)(C)C)sc43)CC[C@H]2C1 ZINC001164857573 720844186 /nfs/dbraw/zinc/84/41/86/720844186.db2.gz YGCNKLKGDUMKLZ-RDJZCZTQSA-N 1 1 404.580 3.162 20 0 HGADMO c1ncn(C[C@H]2C[C@@H]3CN(c4ccc(-c5ccncc5)cn4)CC[C@H]3[N@H+]2CC2CC2)n1 ZINC001164747718 720845354 /nfs/dbraw/zinc/84/53/54/720845354.db2.gz RMQGYGBRMZPDEL-DNVJHFABSA-N 1 1 415.545 3.115 20 0 HGADMO COCC[N@H+]1CCO[C@@H]2CN(c3cc4nc(Cl)cnc4cc3Cl)CC[C@@H]2C1 ZINC001164856368 720850895 /nfs/dbraw/zinc/85/08/95/720850895.db2.gz VYFVPGJFQAWTID-FZKQIMNGSA-N 1 1 411.333 3.110 20 0 HGADMO COc1cccnc1N1CC[C@]2(C1)C[N@@H+](CC1CC1)C[C@H]2COCc1cccnc1 ZINC001164747138 720877933 /nfs/dbraw/zinc/87/79/33/720877933.db2.gz ABSYKTWNNYCIFE-XUZZJYLKSA-N 1 1 408.546 3.240 20 0 HGADMO Cc1ncc(F)c(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COCc2cccnc2)n1 ZINC001164752911 720879279 /nfs/dbraw/zinc/87/92/79/720879279.db2.gz NLELSHWUZNHXPI-NZQKXSOJSA-N 1 1 411.525 3.074 20 0 HGADMO COCC[N@H+]1CCO[C@H]2CN(c3ccc(-c4cccc5ccccc54)nn3)CC[C@@H]2C1 ZINC001164853905 720881890 /nfs/dbraw/zinc/88/18/90/720881890.db2.gz DSOMWAUEEZCXPL-YKSBVNFPSA-N 1 1 418.541 3.470 20 0 HGADMO Cc1ncnc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COCc2cccnc2)c1C ZINC001164755724 720884161 /nfs/dbraw/zinc/88/41/61/720884161.db2.gz NFCDOYZNSFLEGY-LADGPHEKSA-N 1 1 407.562 3.244 20 0 HGADMO CCc1nccnc1N1CC[C@@]2(C1)C[N@@H+](CC1CC1)C[C@@H]2COCc1cccnc1 ZINC001164752558 720887062 /nfs/dbraw/zinc/88/70/62/720887062.db2.gz FDUQZEHPKDRMQZ-QPPBQGQZSA-N 1 1 407.562 3.189 20 0 HGADMO COCC[N@H+]1CCO[C@H]2CN(c3cnc(Cl)nc3Oc3ccccc3)CC[C@H]2C1 ZINC001164865048 720888677 /nfs/dbraw/zinc/88/86/77/720888677.db2.gz YBAHKQBDXGXYEW-LPHOPBHVSA-N 1 1 418.925 3.096 20 0 HGADMO COCC[N@H+]1CCO[C@H]2CN(c3cc(Cl)nc4c(F)ccc(F)c34)CC[C@H]2C1 ZINC001164853850 720890892 /nfs/dbraw/zinc/89/08/92/720890892.db2.gz DAIVNBDEGDNFPY-GUYCJALGSA-N 1 1 411.880 3.340 20 0 HGADMO CC(C)[N@@H+](C)Cc1cnc2n1CCN(c1ncnc3cc4c(cc31)OCCO4)[C@H]2C ZINC001164860044 720934507 /nfs/dbraw/zinc/93/45/07/720934507.db2.gz PLKATVZPQCQCCW-HNNXBMFYSA-N 1 1 408.506 3.019 20 0 HGADMO CC(C)N(C)Cc1cnc2n1CCN(c1nc(Cl)cc(C3CC[NH2+]CC3)n1)[C@@H]2C ZINC001164857955 720943275 /nfs/dbraw/zinc/94/32/75/720943275.db2.gz ILMXXDOLQOJCIB-OAHLLOKOSA-N 1 1 417.989 3.215 20 0 HGADMO COC(=O)c1cc(Cl)c(N2CCn3c(C[N@@H+](C)C(C)C)cnc3[C@H]2C)nc1C ZINC001164864793 721017913 /nfs/dbraw/zinc/01/79/13/721017913.db2.gz ZMDTVXQIBIWHNN-CQSZACIVSA-N 1 1 405.930 3.448 20 0 HGADMO FC(F)(c1cc(Cl)cnc1Cl)N1CCc2[nH+]cc(Cn3cccn3)n2CC1 ZINC001164863984 721031743 /nfs/dbraw/zinc/03/17/43/721031743.db2.gz WBTGBRPWWQTXQO-UHFFFAOYSA-N 1 1 413.259 3.437 20 0 HGADMO FC(F)(c1cc2cc[nH]c2c(Cl)n1)N1CCc2[nH+]cc(Cn3cccn3)n2CC1 ZINC001164862071 721033114 /nfs/dbraw/zinc/03/31/14/721033114.db2.gz LXHCSBCRVYQBFV-UHFFFAOYSA-N 1 1 417.851 3.265 20 0 HGADMO c1ccc(Oc2ccnc(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@@H]4C3)n2)cc1 ZINC001164868810 721065995 /nfs/dbraw/zinc/06/59/95/721065995.db2.gz QRKSRRTVAUPFAW-CTNGQTDRSA-N 1 1 403.486 3.144 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(C(F)(F)c4cnc(Cl)nc4Cl)C[C@@H]3C2)cn1 ZINC001164772613 721078084 /nfs/dbraw/zinc/07/80/84/721078084.db2.gz VFWJQXRZNREDML-OLZOCXBDSA-N 1 1 417.291 3.020 20 0 HGADMO Fc1cccc2c1nc(Cl)nc2N1CC[N@H+]2C[C@@H](OCc3cccnc3)C[C@H]2C1 ZINC001164865751 721078629 /nfs/dbraw/zinc/07/86/29/721078629.db2.gz PGTZQVGAKSXWRZ-HOTGVXAUSA-N 1 1 413.884 3.297 20 0 HGADMO Fc1cccc2c1nc(Cl)nc2N1CC[N@H+]2C[C@H](OCc3cccnc3)C[C@H]2C1 ZINC001164865753 721079500 /nfs/dbraw/zinc/07/95/00/721079500.db2.gz PGTZQVGAKSXWRZ-JKSUJKDBSA-N 1 1 413.884 3.297 20 0 HGADMO FC(F)(COc1ccnc(Cl)c1)N1CC[N@H+]2C[C@@H](OCc3cccnc3)C[C@@H]2C1 ZINC001164863403 721083460 /nfs/dbraw/zinc/08/34/60/721083460.db2.gz CGCDYNSVKZDEGB-AEFFLSMTSA-N 1 1 424.879 3.077 20 0 HGADMO COc1ccc(C(F)(F)N2CC[N@H+]3C[C@H](OCc4cccnc4)C[C@@H]3C2)nc1Cl ZINC001164863703 721100091 /nfs/dbraw/zinc/10/00/91/721100091.db2.gz CZIOHTXYJYXUQL-HZPDHXFCSA-N 1 1 424.879 3.163 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4nccnc4C4SCCCS4)C[C@@H]3C2)cn1 ZINC001164770582 721104963 /nfs/dbraw/zinc/10/49/63/721104963.db2.gz RAJIKPMEZLJXLP-IRXDYDNUSA-N 1 1 416.620 3.037 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4nccnc4C4SCCCS4)C[C@@H]3C2)cn1 ZINC001164770583 721105799 /nfs/dbraw/zinc/10/57/99/721105799.db2.gz RAJIKPMEZLJXLP-SJORKVTESA-N 1 1 416.620 3.037 20 0 HGADMO c1ccc2c(c1)CCc1cnc(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@H]4C3)nc1-2 ZINC001164879491 721124783 /nfs/dbraw/zinc/12/47/83/721124783.db2.gz SVBKQWLEVXOFGW-FCHUYYIVSA-N 1 1 413.525 3.117 20 0 HGADMO Fc1cc2ncnc(Cl)c2c(N2CC[N@H+]3C[C@H](OCc4cccnc4)C[C@H]3C2)c1 ZINC001164879568 721127048 /nfs/dbraw/zinc/12/70/48/721127048.db2.gz UAVVYXYQOFXPSG-DLBZAZTESA-N 1 1 413.884 3.297 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4cccc(-c5cccc(Cl)n5)n4)C[C@@H]3C2)cn1 ZINC001164770590 721136813 /nfs/dbraw/zinc/13/68/13/721136813.db2.gz RBYZKEKVQINFTO-ROUUACIJSA-N 1 1 408.937 3.489 20 0 HGADMO Fc1cccc(F)c1-c1ccc(N2CC[N@H+]3C[C@@H](OCc4cccnc4)C[C@H]3C2)nn1 ZINC001164879055 721162212 /nfs/dbraw/zinc/16/22/12/721162212.db2.gz ROTJYRKVKMHVOY-ROUUACIJSA-N 1 1 423.467 3.297 20 0 HGADMO Cc1nc(-c2ccccn2)nc(N2CC[N@H+]3C[C@@H](OCc4cccnc4)C[C@H]3C2)c1C ZINC001164880348 721167971 /nfs/dbraw/zinc/16/79/71/721167971.db2.gz WAANWLNKPDVCSZ-SFTDATJTSA-N 1 1 416.529 3.030 20 0 HGADMO c1ccc(Oc2nccnc2N2CC[N@H+]3C[C@H](OCc4cccnc4)C[C@@H]3C2)cc1 ZINC001164880717 721170687 /nfs/dbraw/zinc/17/06/87/721170687.db2.gz XFFPBOWCGUYYJV-TZIWHRDSSA-N 1 1 403.486 3.144 20 0 HGADMO c1ccc(Oc2nccnc2N2CC[N@H+]3C[C@@H](OCc4cccnc4)C[C@H]3C2)cc1 ZINC001164880715 721172217 /nfs/dbraw/zinc/17/22/17/721172217.db2.gz XFFPBOWCGUYYJV-FPOVZHCZSA-N 1 1 403.486 3.144 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4cccc(OCc5ccccc5)n4)C[C@@H]3C2)cn1 ZINC001164768704 721174181 /nfs/dbraw/zinc/17/41/81/721174181.db2.gz LOQYPSZFKIPFES-VXKWHMMOSA-N 1 1 403.530 3.352 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4nccc(Oc5cccc(F)c5)n4)C[C@H]3C2)cn1 ZINC001164762623 721177905 /nfs/dbraw/zinc/17/79/05/721177905.db2.gz DBEKQAOSKQAYJM-QZTJIDSGSA-N 1 1 408.481 3.100 20 0 HGADMO Cc1cc(-c2ccccc2F)nnc1N1CC[N@H+]2C[C@@H](OCc3cccnc3)C[C@H]2C1 ZINC001164876478 721180061 /nfs/dbraw/zinc/18/00/61/721180061.db2.gz MRWODYFUMIPJRW-PMACEKPBSA-N 1 1 419.504 3.466 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4ncccc4OCc4ccccc4)C[C@H]3C2)cn1 ZINC001164768636 721192103 /nfs/dbraw/zinc/19/21/03/721192103.db2.gz LKHNUVCAWNMHHO-FGZHOGPDSA-N 1 1 403.530 3.352 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4ccc(-c5c(F)cccc5F)nn4)C[C@H]3C2)cn1 ZINC001164771882 721215141 /nfs/dbraw/zinc/21/51/41/721215141.db2.gz RRZFJMUFEABVPG-DLBZAZTESA-N 1 1 410.472 3.114 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4ncc(Cl)nc4-c4ccccc4)C[C@@H]3C2)cn1 ZINC001164772371 721215353 /nfs/dbraw/zinc/21/53/53/721215353.db2.gz TXSUEOUSTIEUHJ-OALUTQOASA-N 1 1 408.937 3.489 20 0 HGADMO C[NH+]1CCC(Oc2ccnc(N3CCO[C@@H]4C[C@H](COc5ccccn5)C[C@H]43)c2)CC1 ZINC001164880061 721315582 /nfs/dbraw/zinc/31/55/82/721315582.db2.gz PAJRMBSLQPYMBF-STZQEDGTSA-N 1 1 424.545 3.012 20 0 HGADMO COc1cc(C)cc(N2CCC[C@@]3(C2)COCC[N@@H+](Cc2c(C)noc2C)C3)n1 ZINC001164777749 721348607 /nfs/dbraw/zinc/34/86/07/721348607.db2.gz HSQWAQGSMZFVBN-JOCHJYFZSA-N 1 1 400.523 3.122 20 0 HGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@]2(CCCN(c3nccc4nc(C)cnc43)C2)C1 ZINC001164787106 721371230 /nfs/dbraw/zinc/37/12/30/721371230.db2.gz ZEYFPSVKTFNPIE-HSZRJFAPSA-N 1 1 422.533 3.057 20 0 HGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@@]2(CCCN(c3ncc(C(F)F)cn3)C2)C1 ZINC001164785315 721373823 /nfs/dbraw/zinc/37/38/23/721373823.db2.gz UKQPOCDVRNVBQE-FQEVSTJZSA-N 1 1 407.465 3.138 20 0 HGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@@]2(CCCN(c3ncc(C(F)F)cn3)C2)C1 ZINC001164785315 721373827 /nfs/dbraw/zinc/37/38/27/721373827.db2.gz UKQPOCDVRNVBQE-FQEVSTJZSA-N 1 1 407.465 3.138 20 0 HGADMO CCOC(=O)c1c(Cl)cc(C)nc1N1C[C@@H]2C[N@@H+](Cc3nccs3)C[C@@H]2C1 ZINC001164785054 721392067 /nfs/dbraw/zinc/39/20/67/721392067.db2.gz KTYYXFDEOPLBQU-OKILXGFUSA-N 1 1 406.939 3.245 20 0 HGADMO CCOC(=O)c1c(Cl)cc(C)nc1N1C[C@@H]2C[N@H+](Cc3nccs3)C[C@@H]2C1 ZINC001164785054 721392073 /nfs/dbraw/zinc/39/20/73/721392073.db2.gz KTYYXFDEOPLBQU-OKILXGFUSA-N 1 1 406.939 3.245 20 0 HGADMO C[NH+]1CCN(C[C@@H]2CCC[C@@]3(CCN(c4ncnc5c(Cl)cccc54)C3)O2)CC1 ZINC001164884400 721393752 /nfs/dbraw/zinc/39/37/52/721393752.db2.gz APMPCVIWERWSOK-JTSKRJEESA-N 1 1 415.969 3.049 20 0 HGADMO COc1cccc2c1nc(Cl)nc2N1C[C@H]2C[NH+](Cc3nccs3)C[C@@H]2C1 ZINC001164783571 721409210 /nfs/dbraw/zinc/40/92/10/721409210.db2.gz IZVQFURTVOFMBR-CHWSQXEVSA-N 1 1 401.923 3.317 20 0 HGADMO COc1cccc(Oc2cncc(N3C[C@@H]4C[N@@H+](Cc5nccs5)C[C@@H]4C3)n2)c1 ZINC001164785007 721419289 /nfs/dbraw/zinc/41/92/89/721419289.db2.gz MCNPMXHHVBQLTI-IYBDPMFKSA-N 1 1 409.515 3.302 20 0 HGADMO COc1cccc(Oc2cncc(N3C[C@@H]4C[N@H+](Cc5nccs5)C[C@@H]4C3)n2)c1 ZINC001164785007 721419290 /nfs/dbraw/zinc/41/92/90/721419290.db2.gz MCNPMXHHVBQLTI-IYBDPMFKSA-N 1 1 409.515 3.302 20 0 HGADMO COc1cccc(Oc2cncc(N3C[C@@H]4C[NH+](Cc5nccs5)C[C@H]4C3)n2)c1 ZINC001164784996 721419509 /nfs/dbraw/zinc/41/95/09/721419509.db2.gz MCNPMXHHVBQLTI-HOTGVXAUSA-N 1 1 409.515 3.302 20 0 HGADMO Cc1csc2nc(C)nc(N3CC[C@@]4(C3)CCC[C@@H](CN3CC[NH+](C)CC3)O4)c12 ZINC001164890242 721441575 /nfs/dbraw/zinc/44/15/75/721441575.db2.gz CQSBSOUZNDWBBA-PGRDOPGGSA-N 1 1 415.607 3.074 20 0 HGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1ncc3ccccc3n1)CC2 ZINC001164785951 721448282 /nfs/dbraw/zinc/44/82/82/721448282.db2.gz JZJRYVJGYUTCJY-OAQYLSRUSA-N 1 1 410.562 3.364 20 0 HGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1nc(C)cc(SC)n1)CC2 ZINC001164786863 721459578 /nfs/dbraw/zinc/45/95/78/721459578.db2.gz QBJRIGIJZOYHRP-IBGZPJMESA-N 1 1 420.623 3.241 20 0 HGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1nccc3cnccc31)CC2 ZINC001164786835 721463059 /nfs/dbraw/zinc/46/30/59/721463059.db2.gz PTAWVICLXUDVMH-NRFANRHFSA-N 1 1 410.562 3.364 20 0 HGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1ncc3c(n1)CCCC3)CC2 ZINC001164789534 721470170 /nfs/dbraw/zinc/47/01/70/721470170.db2.gz NWTHHKSPNYAQQU-NRFANRHFSA-N 1 1 414.594 3.089 20 0 HGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2Cc3nccn3C[C@H](Cn3cccn3)C2)nc1 ZINC001164897690 721487849 /nfs/dbraw/zinc/48/78/49/721487849.db2.gz UACBSNVKUHXKBG-PZJWPPBQSA-N 1 1 405.550 3.358 20 0 HGADMO Cc1cn(-c2ccc(N3CCC4(CC([N@@H+](C)Cc5ccncc5)C4)CC3)nn2)cn1 ZINC001164796261 721498109 /nfs/dbraw/zinc/49/81/09/721498109.db2.gz OWDFVDDNPUEHMQ-UHFFFAOYSA-N 1 1 403.534 3.247 20 0 HGADMO Cc1cc(Cl)nc(C(F)(F)N2CC[N@H+]3C[C@H](Oc4cccc(F)c4)C[C@H]3C2)n1 ZINC001164900056 721512400 /nfs/dbraw/zinc/51/24/00/721512400.db2.gz NQCNVSLLAOMYIB-GOEBONIOSA-N 1 1 412.843 3.464 20 0 HGADMO COc1cc2ncnc(N3CC[N@H+]4C[C@@H](Oc5cccc(F)c5)C[C@H]4C3)c2cc1OC ZINC001164900993 721520064 /nfs/dbraw/zinc/52/00/64/721520064.db2.gz VLUKZVTXLUJMKL-WMZOPIPTSA-N 1 1 424.476 3.128 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2cc(C(=O)OC(C)(C)C)ccn2)[C@@H]2CCCO[C@@H]12 ZINC001164807757 721534484 /nfs/dbraw/zinc/53/44/84/721534484.db2.gz RCPTUJDRURRIGY-KCZVDYSFSA-N 1 1 424.545 3.300 20 0 HGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2ccc(-c3ccccc3)nn2)[C@@H]2CCCO[C@H]12 ZINC001164805550 721536431 /nfs/dbraw/zinc/53/64/31/721536431.db2.gz MHFCOCOUYDGTGS-AKFKNWHVSA-N 1 1 401.514 3.407 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2ccc(-c3ccccc3)nn2)[C@@H]2CCCO[C@H]12 ZINC001164805550 721536437 /nfs/dbraw/zinc/53/64/37/721536437.db2.gz MHFCOCOUYDGTGS-AKFKNWHVSA-N 1 1 401.514 3.407 20 0 HGADMO COc1cc2ncnc(N3CC[N@H+]4C[C@H](Oc5cccc(F)c5)C[C@H]4C3)c2c(OC)c1 ZINC001164903454 721538562 /nfs/dbraw/zinc/53/85/62/721538562.db2.gz CRPOTYRRGPBHER-QFBILLFUSA-N 1 1 424.476 3.128 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2nc(Cl)nc3c2CCCC3)[C@@H]2CCCO[C@H]12 ZINC001164799880 721538579 /nfs/dbraw/zinc/53/85/79/721538579.db2.gz BOXOOSUBTLDUDZ-AQNXPRMDSA-N 1 1 413.953 3.272 20 0 HGADMO Cc1cc(N2CC[N@H+]3C[C@@H](Oc4cccc(F)c4)C[C@H]3C2)nc(-c2ccncc2)n1 ZINC001164903176 721551747 /nfs/dbraw/zinc/55/17/47/721551747.db2.gz BHXZKYHBLIYUKN-FPOVZHCZSA-N 1 1 405.477 3.328 20 0 HGADMO CC1CCN(c2ccc(N3CC[N@H+]4C[C@@H](Oc5cccc(F)c5)C[C@@H]4C3)nn2)CC1 ZINC001164911655 721555500 /nfs/dbraw/zinc/55/55/00/721555500.db2.gz ZKJCFWBXWLRIKU-CTNGQTDRSA-N 1 1 411.525 3.194 20 0 HGADMO C[C@@H]1CCCN(c2cc(N3CC[N@H+]4C[C@H](Oc5cccc(F)c5)C[C@@H]4C3)ncn2)C1 ZINC001164910849 721559863 /nfs/dbraw/zinc/55/98/63/721559863.db2.gz XLHRHYQOFLERPI-YFVAEKQCSA-N 1 1 411.525 3.194 20 0 HGADMO C[C@@H]1CCCN(c2cc(N3CC[N@H+]4C[C@@H](Oc5cccc(F)c5)C[C@H]4C3)ncn2)C1 ZINC001164910829 721559927 /nfs/dbraw/zinc/55/99/27/721559927.db2.gz XLHRHYQOFLERPI-LMNJBCLMSA-N 1 1 411.525 3.194 20 0 HGADMO Fc1cccc(O[C@@H]2C[C@@H]3CN(c4cncc(N5CCCCCC5)n4)CC[N@H+]3C2)c1 ZINC001164903543 721560407 /nfs/dbraw/zinc/56/04/07/721560407.db2.gz CCYWJVDAFZZQBQ-TZIWHRDSSA-N 1 1 411.525 3.338 20 0 HGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(C(F)(F)c2cc(N)cc(Cl)n2)[C@H]2CCCO[C@@H]12 ZINC001164800322 721562050 /nfs/dbraw/zinc/56/20/50/721562050.db2.gz DUTDRUMLUHUJHL-FRQCXROJSA-N 1 1 423.895 3.125 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(C(F)(F)c2cc(N)cc(Cl)n2)[C@H]2CCCO[C@@H]12 ZINC001164800322 721562051 /nfs/dbraw/zinc/56/20/51/721562051.db2.gz DUTDRUMLUHUJHL-FRQCXROJSA-N 1 1 423.895 3.125 20 0 HGADMO Fc1cccc(O[C@@H]2C[C@H]3CN(c4cc(-c5nc(C6CC6)no5)ccn4)CC[N@H+]3C2)c1 ZINC001164910445 721562539 /nfs/dbraw/zinc/56/25/39/721562539.db2.gz WZIMIDPETLMIQL-AZUAARDMSA-N 1 1 421.476 3.490 20 0 HGADMO C=Cc1nc(Cl)nc(N2C[C@H]([N@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@H]32)c1OC ZINC001164806672 721574516 /nfs/dbraw/zinc/57/45/16/721574516.db2.gz QQJWBHPOQHCKTF-ZIFCJYIRSA-N 1 1 415.925 3.045 20 0 HGADMO C=Cc1nc(Cl)nc(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@H]32)c1OC ZINC001164806672 721574518 /nfs/dbraw/zinc/57/45/18/721574518.db2.gz QQJWBHPOQHCKTF-ZIFCJYIRSA-N 1 1 415.925 3.045 20 0 HGADMO CCOC(=O)c1cccnc1N1CCC(F)(F)[C@@]2(CC[N@@H+](Cc3ccccn3)C2)C1 ZINC001164906184 721585402 /nfs/dbraw/zinc/58/54/02/721585402.db2.gz LXROPWUNEIZORS-OAQYLSRUSA-N 1 1 416.472 3.391 20 0 HGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(C(F)(F)Oc2ccnc(Cl)c2)[C@H]2CCCO[C@H]12 ZINC001164805107 721588910 /nfs/dbraw/zinc/58/89/10/721588910.db2.gz KRERYWRDCDSFDT-SCTDSRPQSA-N 1 1 424.879 3.423 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(C(F)(F)Oc2ccnc(Cl)c2)[C@H]2CCCO[C@H]12 ZINC001164805107 721588914 /nfs/dbraw/zinc/58/89/14/721588914.db2.gz KRERYWRDCDSFDT-SCTDSRPQSA-N 1 1 424.879 3.423 20 0 HGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2nc3c(nc2Cl)CCCC3)[C@@H]2CCCO[C@H]12 ZINC001164810190 721590666 /nfs/dbraw/zinc/59/06/66/721590666.db2.gz VCLAPYXEWYLONO-AQNXPRMDSA-N 1 1 413.953 3.272 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2nc3c(nc2Cl)CCCC3)[C@@H]2CCCO[C@H]12 ZINC001164810190 721590667 /nfs/dbraw/zinc/59/06/67/721590667.db2.gz VCLAPYXEWYLONO-AQNXPRMDSA-N 1 1 413.953 3.272 20 0 HGADMO CCOC(=O)c1cccc(N2CCC(F)(F)[C@]3(CC[N@@H+](Cc4ccccn4)C3)C2)n1 ZINC001164908234 721697612 /nfs/dbraw/zinc/69/76/12/721697612.db2.gz YDMRXFQYQDSNLC-NRFANRHFSA-N 1 1 416.472 3.391 20 0 HGADMO CC(=O)Nc1cccc(N2CCC(F)(F)[C@]3(CC[N@@H+](Cc4ccccn4)C3)C2)n1 ZINC001164904814 721703972 /nfs/dbraw/zinc/70/39/72/721703972.db2.gz DFLVCVLEQVXRBA-FQEVSTJZSA-N 1 1 401.461 3.173 20 0 HGADMO COC(=O)c1cc(F)cnc1N1CCc2c(C[N@H+](C)Cc3ccco3)cncc2C1 ZINC001164907896 721745249 /nfs/dbraw/zinc/74/52/49/721745249.db2.gz CTUPFDORRVHQSY-UHFFFAOYSA-N 1 1 410.449 3.190 20 0 HGADMO COC(=O)c1cc(F)cnc1N1CCc2c(C[N@@H+](C)Cc3ccco3)cncc2C1 ZINC001164907896 721745250 /nfs/dbraw/zinc/74/52/50/721745250.db2.gz CTUPFDORRVHQSY-UHFFFAOYSA-N 1 1 410.449 3.190 20 0 HGADMO Cc1nc2ccc(N3CCc4c(C[N@H+](C)Cc5ccco5)cncc4C3)nc2n1C ZINC001164910102 721754621 /nfs/dbraw/zinc/75/46/21/721754621.db2.gz MGBSMTAWNNEWMG-UHFFFAOYSA-N 1 1 402.502 3.459 20 0 HGADMO Cc1nc2ccc(N3CCc4c(C[N@@H+](C)Cc5ccco5)cncc4C3)nc2n1C ZINC001164910102 721754624 /nfs/dbraw/zinc/75/46/24/721754624.db2.gz MGBSMTAWNNEWMG-UHFFFAOYSA-N 1 1 402.502 3.459 20 0 HGADMO COC(=O)c1cnc(Cl)nc1N1C[C@@H]2CCC[C@@H]([N@@H+](C)Cc3ccccn3)[C@H]2C1 ZINC001165021352 721801169 /nfs/dbraw/zinc/80/11/69/721801169.db2.gz GKZKFUJGXLZJGX-JCGIZDLHSA-N 1 1 415.925 3.049 20 0 HGADMO COC(=O)c1cc(Cl)nc(N2C[C@@H]3CCC[C@@H]([N@@H+](C)Cc4ccccn4)[C@H]3C2)n1 ZINC001165028554 721801268 /nfs/dbraw/zinc/80/12/68/721801268.db2.gz ZGXJLTWEKZPDDF-QILLFSRXSA-N 1 1 415.925 3.049 20 0 HGADMO COC(=O)c1cc(Cl)nc(N2C[C@@H]3CCC[C@H]([N@@H+](C)Cc4ccccn4)[C@H]3C2)n1 ZINC001165028559 721801332 /nfs/dbraw/zinc/80/13/32/721801332.db2.gz ZGXJLTWEKZPDDF-ZVZYQTTQSA-N 1 1 415.925 3.049 20 0 HGADMO COC(=O)c1cnc(N2C[C@@H]3CCC[C@H]([N@@H+](C)Cc4ccccn4)[C@@H]3C2)cc1OC ZINC001165023946 721803470 /nfs/dbraw/zinc/80/34/70/721803470.db2.gz KJSZWJQYTCNXMD-DBVUQKKJSA-N 1 1 410.518 3.009 20 0 HGADMO Cn1c(=O)ccc2ccc(N3C[C@H]4CCC[C@@H]([N@@H+](C)Cc5ccccn5)[C@@H]4C3)nc21 ZINC001165021621 721813232 /nfs/dbraw/zinc/81/32/32/721813232.db2.gz FHKIIPGWRASELY-HMXCVIKNSA-N 1 1 403.530 3.065 20 0 HGADMO CCCNC(=O)c1cccnc1N1C[C@@H]2CCC[C@@H]([N@@H+](C)Cc3ccccn3)[C@H]2C1 ZINC001165023270 721823479 /nfs/dbraw/zinc/82/34/79/721823479.db2.gz IMXAZXIJSKTLAU-YUXAGFNASA-N 1 1 407.562 3.353 20 0 HGADMO COC(=O)c1nc(Cl)cc(N2C[C@@H]3CCC[C@H]([N@@H+](C)Cc4ccccn4)[C@@H]3C2)n1 ZINC001165030221 721827462 /nfs/dbraw/zinc/82/74/62/721827462.db2.gz ZBGWZNQREUUBBB-UAGQMJEPSA-N 1 1 415.925 3.049 20 0 HGADMO COCCOC(=O)c1ccnc(N2C[C@@H]3CCC[C@H]([N@@H+](C)Cc4ccccn4)[C@H]3C2)c1 ZINC001165027763 721829643 /nfs/dbraw/zinc/82/96/43/721829643.db2.gz TZULBGIICKBEJT-BVSLBCMMSA-N 1 1 424.545 3.017 20 0 HGADMO COc1cccc(OC)c1CN1CCC(N(C)c2cc(-n3ccnc3)cc[nH+]2)CC1 ZINC001165031208 721844296 /nfs/dbraw/zinc/84/42/96/721844296.db2.gz YBGSJIPNJVDQFP-UHFFFAOYSA-N 1 1 407.518 3.385 20 0 HGADMO COc1ccc(Oc2nc(Cl)ncc2N2CC[C@@H]3[C@H]2CC[N@@H+]3CCN(C)C)cc1 ZINC001164929641 721888738 /nfs/dbraw/zinc/88/87/38/721888738.db2.gz BXDWRBCPILXAAR-QZTJIDSGSA-N 1 1 417.941 3.146 20 0 HGADMO COc1ccc(Oc2nc(Cl)ncc2N2CC[C@@H]3[C@H]2CC[N@H+]3CCN(C)C)cc1 ZINC001164929641 721888740 /nfs/dbraw/zinc/88/87/40/721888740.db2.gz BXDWRBCPILXAAR-QZTJIDSGSA-N 1 1 417.941 3.146 20 0 HGADMO F[C@H](Oc1cccc(-c2ccc(Cl)nn2)c1)N1CC[NH+](C[C@@H]2CCCO2)CC1 ZINC001165043460 721921245 /nfs/dbraw/zinc/92/12/45/721921245.db2.gz KJVISTKPTAJIFE-PXNSSMCTSA-N 1 1 406.889 3.226 20 0 HGADMO F[C@H](Oc1cccc(-c2ccc(Cl)nn2)c1)N1CC[NH+](C[C@H]2CCCO2)CC1 ZINC001165043462 721921448 /nfs/dbraw/zinc/92/14/48/721921448.db2.gz KJVISTKPTAJIFE-XLIONFOSSA-N 1 1 406.889 3.226 20 0 HGADMO Cc1ccc(C[N@H+]2CCOC3(CCN(c4nc(Cl)nc5c4COC5)CC3)C2)cc1 ZINC001164941052 721923599 /nfs/dbraw/zinc/92/35/99/721923599.db2.gz ZVQXZQCHYFGINY-UHFFFAOYSA-N 1 1 414.937 3.340 20 0 HGADMO Cc1ccc(C[N@H+]2CCOC3(CCN(c4nc(Cl)nc(Cl)n4)CC3)C2)cc1 ZINC001164941029 721924044 /nfs/dbraw/zinc/92/40/44/721924044.db2.gz ZAFOKVVSUWEMPX-UHFFFAOYSA-N 1 1 408.333 3.358 20 0 HGADMO CCOC(=O)c1ncnc(N2CCC3(CC2)C[N@@H+](Cc2ccc(C)cc2)CCO3)c1C ZINC001164939343 721927387 /nfs/dbraw/zinc/92/73/87/721927387.db2.gz JHGFRZVJVZPRRR-UHFFFAOYSA-N 1 1 424.545 3.142 20 0 HGADMO CCN(CC)C(=O)c1cc(Cl)nc(N2CC[NH+](CCOc3ccccc3)CC2)c1 ZINC001165044684 721956991 /nfs/dbraw/zinc/95/69/91/721956991.db2.gz OGQSMNKKWJFSFD-UHFFFAOYSA-N 1 1 416.953 3.418 20 0 HGADMO CN(C)c1ccc(-c2ccnc(N3CC[NH+](CCOc4ccccc4)CC3)n2)cc1 ZINC001165043964 721958508 /nfs/dbraw/zinc/95/85/08/721958508.db2.gz AXAUFFLATSWXJU-UHFFFAOYSA-N 1 1 403.530 3.411 20 0 HGADMO CC1CCN(C(=O)c2ccc(N3CC[NH+](CCOc4ccccc4)CC3)nc2)CC1 ZINC000492938167 721959369 /nfs/dbraw/zinc/95/93/69/721959369.db2.gz XTEKAKOLWNNVQC-UHFFFAOYSA-N 1 1 408.546 3.155 20 0 HGADMO c1ccc(OCC[NH+]2CCN(c3ccc(-c4ccc5c(c4)OCCO5)nn3)CC2)cc1 ZINC001165045563 721959711 /nfs/dbraw/zinc/95/97/11/721959711.db2.gz YRNDYYYDMRFLQH-UHFFFAOYSA-N 1 1 418.497 3.116 20 0 HGADMO COc1cc(N2CCC3(CC2)C(=O)NCCN3Cc2ccccc2)[nH+]c2ccccc21 ZINC001164945850 721977068 /nfs/dbraw/zinc/97/70/68/721977068.db2.gz GQZHOSUDGMWNMT-UHFFFAOYSA-N 1 1 416.525 3.214 20 0 HGADMO COc1ccc2c[nH+]c(N3CCC4(CC3)C(=O)NCCN4Cc3ccccc3)cc2c1 ZINC001164947076 721977090 /nfs/dbraw/zinc/97/70/90/721977090.db2.gz NPHSHHYHOMKIDB-UHFFFAOYSA-N 1 1 416.525 3.214 20 0 HGADMO Cc1cc2ncnc(N3CCC4(CC3)C(=O)NCC[N@H+]4Cc3ccccc3)c2cc1C ZINC001164948278 721981056 /nfs/dbraw/zinc/98/10/56/721981056.db2.gz KQGDIUGIFKHLGO-UHFFFAOYSA-N 1 1 415.541 3.218 20 0 HGADMO Cc1cc2ncnc(N3CCC4(CC3)C(=O)NCC[N@@H+]4Cc3ccccc3)c2cc1C ZINC001164948278 721981060 /nfs/dbraw/zinc/98/10/60/721981060.db2.gz KQGDIUGIFKHLGO-UHFFFAOYSA-N 1 1 415.541 3.218 20 0 HGADMO CC[NH+](CC)Cc1nc2sc(C)c(C)c2c(N2C[C@@H]3COC[C@@]3(COC)C2)n1 ZINC001164952350 721995211 /nfs/dbraw/zinc/99/52/11/721995211.db2.gz OQQWPVNMVCXDJW-IERDGZPVSA-N 1 1 404.580 3.249 20 0 HGADMO CCOC(=O)c1cnc(N2CCC3(CC[N@@H+](Cc4cccnc4)C3)CC2)c(OC)c1 ZINC001164955505 722019429 /nfs/dbraw/zinc/01/94/29/722019429.db2.gz JSFQZKGBWZPFIJ-UHFFFAOYSA-N 1 1 410.518 3.154 20 0 HGADMO COc1ccc2ncnc(N3CCC4(CC3)COCC[N@@H+](Cc3ccncc3)C4)c2c1 ZINC001164958936 722054090 /nfs/dbraw/zinc/05/40/90/722054090.db2.gz HWKCHROKUCYRKQ-UHFFFAOYSA-N 1 1 419.529 3.152 20 0 HGADMO Clc1nc2cccnc2nc1N1CCC2(CC1)COCC[N@@H+](Cc1ccncc1)C2 ZINC001164963251 722055516 /nfs/dbraw/zinc/05/55/16/722055516.db2.gz JURGPJVGEFOXFK-UHFFFAOYSA-N 1 1 424.936 3.192 20 0 HGADMO COc1cc(Cl)cc(N2CCC3(CC2)COCC[N@@H+](Cc2ccncc2)C3)n1 ZINC001164963859 722055939 /nfs/dbraw/zinc/05/59/39/722055939.db2.gz OOQCLJAULYWRAT-UHFFFAOYSA-N 1 1 402.926 3.258 20 0 HGADMO c1cncc(-c2nccc(N3CCC4(CC3)COCC[N@H+](Cc3ccncc3)C4)n2)c1 ZINC001164963146 722057093 /nfs/dbraw/zinc/05/70/93/722057093.db2.gz HPCFWBZYPLPKND-UHFFFAOYSA-N 1 1 416.529 3.053 20 0 HGADMO Fc1ccc2nc(C(F)(F)N3C[C@@H]4C[N@@H+](CC5CC5)C[C@H](C3)O4)nc(Cl)c2c1 ZINC001164967941 722071479 /nfs/dbraw/zinc/07/14/79/722071479.db2.gz VQHIGCKMALQHQC-OKILXGFUSA-N 1 1 412.843 3.267 20 0 HGADMO Fc1ccc2nc(C(F)(F)N3C[C@@H]4C[N@H+](CC5CC5)C[C@H](C3)O4)nc(Cl)c2c1 ZINC001164967941 722071483 /nfs/dbraw/zinc/07/14/83/722071483.db2.gz VQHIGCKMALQHQC-OKILXGFUSA-N 1 1 412.843 3.267 20 0 HGADMO CC(=O)N1[C@H](Cn2cccn2)C[C@@H]2C[N@H+](C(C)(C)c3ccnc(Cl)c3)CC[C@@H]21 ZINC001164970767 722081403 /nfs/dbraw/zinc/08/14/03/722081403.db2.gz RLUQSBMMLFKMLP-NEWSRXKRSA-N 1 1 401.942 3.178 20 0 HGADMO FC(F)(c1cccc(Cl)n1)N1CC[C@@H]2C[N@@H+](Cc3cccnc3)CCO[C@H]2C1 ZINC001164983409 722100680 /nfs/dbraw/zinc/10/06/80/722100680.db2.gz PYVPYQKCSVHCAO-SJORKVTESA-N 1 1 408.880 3.402 20 0 HGADMO Cc1cc(Cl)nc(C(F)(F)N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)n1 ZINC001164977247 722101710 /nfs/dbraw/zinc/10/17/10/722101710.db2.gz FKEPTOAWBBMNOF-DLBZAZTESA-N 1 1 423.895 3.106 20 0 HGADMO c1ccc(Oc2cc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)ncn2)cc1 ZINC001164979355 722105721 /nfs/dbraw/zinc/10/57/21/722105721.db2.gz ICNDKDLLEBSEER-UNMCSNQZSA-N 1 1 417.513 3.391 20 0 HGADMO COc1ccc2nc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)ccc2c1 ZINC001164971936 722109639 /nfs/dbraw/zinc/10/96/39/722109639.db2.gz DUHCXFKFPVORPT-OFNKIYASSA-N 1 1 404.514 3.366 20 0 HGADMO Clc1ccc2ncc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)nc2c1 ZINC001164981083 722112729 /nfs/dbraw/zinc/11/27/29/722112729.db2.gz SKLVFPHLHRQPSB-LAUBAEHRSA-N 1 1 409.921 3.406 20 0 HGADMO Clc1ccc2c(cnnc2N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)c1 ZINC001164981167 722121345 /nfs/dbraw/zinc/12/13/45/722121345.db2.gz TZMGALLBHGFTCJ-UWJYYQICSA-N 1 1 409.921 3.406 20 0 HGADMO Clc1ccc2nc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)ncc2c1 ZINC001164978158 722122752 /nfs/dbraw/zinc/12/27/52/722122752.db2.gz NQRBQGKZUNNZGO-DYESRHJHSA-N 1 1 409.921 3.406 20 0 HGADMO CCOc1ccc(Cl)nc1N1CC[C@H]2C[N@@H+](Cc3cccnc3)CCO[C@H]2C1 ZINC001164981168 722124873 /nfs/dbraw/zinc/12/48/73/722124873.db2.gz UADDAZHNWPJOSI-HKUYNNGSSA-N 1 1 402.926 3.256 20 0 HGADMO CCCN(CCC)c1cncc(N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)n1 ZINC001164983833 722131184 /nfs/dbraw/zinc/13/11/84/722131184.db2.gz VNEPVHRWHPIXTC-VXKWHMMOSA-N 1 1 424.593 3.225 20 0 HGADMO c1ccc(-c2cnc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)cn2)cc1 ZINC001164978020 722140562 /nfs/dbraw/zinc/14/05/62/722140562.db2.gz JDTVVWJOZZOWFH-GMAHTHKFSA-N 1 1 401.514 3.266 20 0 HGADMO c1ccc(-c2cnc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)cn2)cc1 ZINC001164978022 722140915 /nfs/dbraw/zinc/14/09/15/722140915.db2.gz JDTVVWJOZZOWFH-JTHBVZDNSA-N 1 1 401.514 3.266 20 0 HGADMO Fc1ccc(-c2cc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)ncn2)cc1 ZINC001164984625 722144484 /nfs/dbraw/zinc/14/44/84/722144484.db2.gz XXBFVXASIFJYAM-OFNKIYASSA-N 1 1 419.504 3.405 20 0 HGADMO CSc1cc(N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)nc(SC)n1 ZINC001164974786 722156309 /nfs/dbraw/zinc/15/63/09/722156309.db2.gz QLGJLMONQXNIRI-DLBZAZTESA-N 1 1 417.604 3.043 20 0 HGADMO COC(=O)Cc1c(Cl)ncnc1N1CCC[C@]2(CC[N@H+]2Cc2cccc(F)c2)C1 ZINC001164993995 722197327 /nfs/dbraw/zinc/19/73/27/722197327.db2.gz KKPZFWNJHGMIDU-NRFANRHFSA-N 1 1 418.900 3.230 20 0 HGADMO COCCOC(=O)c1ccnc(N2CCC[C@]3(CC[N@H+]3Cc3cccc(F)c3)C2)c1 ZINC001164995726 722212200 /nfs/dbraw/zinc/21/22/00/722212200.db2.gz KEWDMBXLAMHOGZ-QHCPKHFHSA-N 1 1 413.493 3.269 20 0 HGADMO OC[C@H](Cc1ccc(F)cc1)[NH2+]Cc1c(Br)cncc1Br ZINC000571488414 1126097933 /nfs/dbraw/zinc/09/79/33/1126097933.db2.gz NHUNNTAVFIEXNU-LBPRGKRZSA-N 1 1 418.104 3.439 20 0 HGADMO CCOC(=O)[C@@]12CCO[C@@H]1CCN(c1ccc3c(n1)CC[N@H+](Cc1ccccc1)C3)C2 ZINC001164432023 718974479 /nfs/dbraw/zinc/97/44/79/718974479.db2.gz DUCBTJSQKPIJRF-RCZVLFRGSA-N 1 1 421.541 3.188 20 0 HGADMO CCOC(=O)c1c[nH]c2ncnc(N3CCC[C@H]4C[N@@H+](Cc5ccccc5)C[C@H]43)c12 ZINC001164624929 719066586 /nfs/dbraw/zinc/06/65/86/719066586.db2.gz MACWEWALEXCXHD-PKOBYXMFSA-N 1 1 405.502 3.235 20 0 HGADMO CCOC(=O)Cc1nc(Cl)cc(N2CCC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)n1 ZINC001164626800 719073868 /nfs/dbraw/zinc/07/38/68/719073868.db2.gz PJHCZANCBITQRX-QZTJIDSGSA-N 1 1 414.937 3.336 20 0 HGADMO Clc1ncc(N2CCOCC2)c(N2CCC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)n1 ZINC001164624970 719079970 /nfs/dbraw/zinc/07/99/70/719079970.db2.gz MHQMUFYRGKQFFI-UYAOXDASSA-N 1 1 413.953 3.067 20 0 HGADMO CCOC(=O)c1ncnc(Cl)c1N1CCC[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]21 ZINC001164625974 719092777 /nfs/dbraw/zinc/09/27/77/719092777.db2.gz HVOLGXXATQPDKE-DLBZAZTESA-N 1 1 400.910 3.408 20 0 HGADMO NC(=O)c1cc(Cl)ncc1C(F)(F)N1CCC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21 ZINC001164631691 719094685 /nfs/dbraw/zinc/09/46/85/719094685.db2.gz ZCRFENRSUBQYKN-QAPCUYQASA-N 1 1 420.891 3.480 20 0 HGADMO Cc1nc2c(nc(Cl)nc2N2CCc3c(C[NH+](C)C)nn(C(C)C)c3C2)s1 ZINC001164649596 719311793 /nfs/dbraw/zinc/31/17/93/719311793.db2.gz PMCRVOABPYVTOU-UHFFFAOYSA-N 1 1 405.959 3.450 20 0 HGADMO CC(C)n1cnc2c1nc(Cl)nc2N1CCc2c(C[NH+](C)C)nn(C(C)C)c2C1 ZINC001164651284 719313762 /nfs/dbraw/zinc/31/37/62/719313762.db2.gz ITQRLHBFDJNCGN-UHFFFAOYSA-N 1 1 416.961 3.462 20 0 HGADMO COC(=O)c1cc(Cl)c(N2CCc3c(C[NH+](C)C)nn(C(C)C)c3C2)nc1C ZINC001164655442 719317430 /nfs/dbraw/zinc/31/74/30/719317430.db2.gz XELZDIYMSAQDGX-UHFFFAOYSA-N 1 1 405.930 3.232 20 0 HGADMO C[N@H+]1CCO[C@@H]2CN(c3nc(Cl)nc(-c4ccc(-c5ccccc5)cc4)n3)C[C@H]21 ZINC001164669314 719394614 /nfs/dbraw/zinc/39/46/14/719394614.db2.gz URFGRJWHWVRFHQ-RTBURBONSA-N 1 1 407.905 3.378 20 0 HGADMO CCOC(=O)c1ccc(Cl)nc1-c1ccc(F)cc1N1C[C@@H]2OCC[N@@H+](C)[C@H]2C1 ZINC001164669215 719413192 /nfs/dbraw/zinc/41/31/92/719413192.db2.gz LIODOHVHCRMKBU-ROUUACIJSA-N 1 1 419.884 3.237 20 0 HGADMO CCOC(=O)c1ccc(Cl)nc1-c1ccc(F)cc1N1C[C@H]2OCC[N@@H+](C)[C@H]2C1 ZINC001164669216 719413637 /nfs/dbraw/zinc/41/36/37/719413637.db2.gz LIODOHVHCRMKBU-ZWKOTPCHSA-N 1 1 419.884 3.237 20 0 HGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2C[C@H](C(=O)N3CCCC3)C[C@H]3OCC[C@H]32)nc1 ZINC001164679415 719544751 /nfs/dbraw/zinc/54/47/51/719544751.db2.gz ZXSOFUJDVQGBFG-GXRSIYKFSA-N 1 1 412.578 3.235 20 0 HGADMO CNC(=O)C[N@H+]1CCCC12CCN(C(F)(F)c1cnc(Cl)cc1Cl)CC2 ZINC001164683906 719703632 /nfs/dbraw/zinc/70/36/32/719703632.db2.gz LWYYVBGSHQQVAT-UHFFFAOYSA-N 1 1 407.292 3.114 20 0 HGADMO CNC(=O)C[N@H+]1CCCC12CCN(C(F)(F)c1ccc(SC)c(Cl)n1)CC2 ZINC001164686029 719726476 /nfs/dbraw/zinc/72/64/76/719726476.db2.gz ONDHUIBGEBVYRK-UHFFFAOYSA-N 1 1 418.941 3.183 20 0 HGADMO CNC(=O)C[N@H+]1CCCC12CCN(c1c(C)nc(-c3ccccc3)nc1Cl)CC2 ZINC001164690133 719744599 /nfs/dbraw/zinc/74/45/99/719744599.db2.gz UEVMVBXTZLNFEJ-UHFFFAOYSA-N 1 1 413.953 3.286 20 0 HGADMO CNC(=O)C[N@H+]1CCCC12CCN(c1nc(C(F)F)nc3ccc(Cl)cc31)CC2 ZINC001164689387 719751505 /nfs/dbraw/zinc/75/15/05/719751505.db2.gz DOWBXYJLXPGKQJ-UHFFFAOYSA-N 1 1 423.895 3.402 20 0 HGADMO O=C1C[C@@H]2[C@H](CCN2c2nc(Cl)ccc2C[NH+]2CCCC2)N1Cc1cccnc1 ZINC001164691613 719769531 /nfs/dbraw/zinc/76/95/31/719769531.db2.gz PAZSLDBIWSTZSG-RBUKOAKNSA-N 1 1 411.937 3.106 20 0 HGADMO COC(=O)[C@@]1(C)C[C@H]([NH+]2CCOCC2)CCN1c1nccc2c(Cl)cccc21 ZINC001164702930 719852770 /nfs/dbraw/zinc/85/27/70/719852770.db2.gz OHVBTQNHVIEJTD-QVKFZJNVSA-N 1 1 403.910 3.121 20 0 HGADMO CCOC(=O)c1cc(C)cnc1N1CCC2(CC1)C[N@@H+](Cc1cccs1)CCO2 ZINC001164696163 719892725 /nfs/dbraw/zinc/89/27/25/719892725.db2.gz ABBXWRPNCSQRQS-UHFFFAOYSA-N 1 1 415.559 3.500 20 0 HGADMO c1csc(C[N@H+]2CCOC3(CCN(c4cncc(N5CCCCC5)n4)CC3)C2)c1 ZINC001164699145 719895920 /nfs/dbraw/zinc/89/59/20/719895920.db2.gz XRLFWEKVWURXBR-UHFFFAOYSA-N 1 1 413.591 3.400 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1nc(Cl)nc3[nH]cc(Cl)c31)C2 ZINC001164812709 720070044 /nfs/dbraw/zinc/07/00/44/720070044.db2.gz RHNNGVGZWAEJQS-BFUOFWGJSA-N 1 1 410.349 3.449 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(C(F)(F)c1nc(C)cc(Cl)n1)C2 ZINC001164808465 720074711 /nfs/dbraw/zinc/07/47/11/720074711.db2.gz HNKACJFYGKLUHU-CRAIPNDOSA-N 1 1 400.901 3.168 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(C(F)(F)Oc1cccnc1Cl)C2 ZINC001164807388 720090598 /nfs/dbraw/zinc/09/05/98/720090598.db2.gz FHPIEFBFZQBZJG-QAPCUYQASA-N 1 1 401.885 3.344 20 0 HGADMO COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1cc(Cl)nc(OC)n1)CC2 ZINC001164710002 720096907 /nfs/dbraw/zinc/09/69/07/720096907.db2.gz DYUGFBAKEBSAHT-QGZVFWFLSA-N 1 1 417.941 3.041 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1nc3ccc(OC)cc3nc1Cl)C2 ZINC001164810678 720102348 /nfs/dbraw/zinc/10/23/48/720102348.db2.gz KOLFTNVDDGFFGJ-ZHRRBRCNSA-N 1 1 416.953 3.477 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1nccc3ccc(C(=O)OC)cc31)C2 ZINC001164811071 720104132 /nfs/dbraw/zinc/10/41/32/720104132.db2.gz LEJHWRGKKUDIDM-RDPSFJRHSA-N 1 1 409.530 3.206 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(C(F)(F)c1ccc(OC)nc1Cl)C2 ZINC001164811739 720111697 /nfs/dbraw/zinc/11/16/97/720111697.db2.gz NBJURTGXLJSHMH-KXBFYZLASA-N 1 1 415.912 3.473 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(C(F)(F)c1cnc(Cl)cc1N)C2 ZINC001164811563 720121172 /nfs/dbraw/zinc/12/11/72/720121172.db2.gz MLZBNHPZGAMDTQ-KSSFIOAISA-N 1 1 400.901 3.047 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(C(F)(F)c1ccc(OC)c(Cl)n1)C2 ZINC001164813325 720127319 /nfs/dbraw/zinc/12/73/19/720127319.db2.gz QGGKXGJLJAQRHW-BEFAXECRSA-N 1 1 415.912 3.473 20 0 HGADMO CCOC(=O)c1c(C)cc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COC)nc1C ZINC001164816162 720132029 /nfs/dbraw/zinc/13/20/29/720132029.db2.gz XZPFRTWTTYDDDO-CVDCTZTESA-N 1 1 401.551 3.060 20 0 HGADMO COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1nccc(C(F)F)n1)CC2 ZINC001164712172 720135278 /nfs/dbraw/zinc/13/52/78/720135278.db2.gz KQQULTYRGQFVTE-KRWDZBQOSA-N 1 1 403.477 3.317 20 0 HGADMO CCSc1cncc(N2CCC3(C[C@@H](COC)[N@@H+](Cc4ccccn4)C3)CC2)n1 ZINC001164710497 720147451 /nfs/dbraw/zinc/14/74/51/720147451.db2.gz BZSIKJKTKVEQGO-IBGZPJMESA-N 1 1 413.591 3.491 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1nccc(-c3ccc(N(C)C)cc3)n1)C2 ZINC001164817538 720150710 /nfs/dbraw/zinc/15/07/10/720150710.db2.gz PUNQOEFSRGUIJY-OFVILXPXSA-N 1 1 421.589 3.394 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1cc3ccc(C(=O)OC)cc3cn1)C2 ZINC001164814394 720158769 /nfs/dbraw/zinc/15/87/69/720158769.db2.gz GBUDRJJXJCXYIR-URXFXBBRSA-N 1 1 409.530 3.206 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1cc3ccc(C(=O)OC)cc3cn1)C2 ZINC001164814397 720159023 /nfs/dbraw/zinc/15/90/23/720159023.db2.gz GBUDRJJXJCXYIR-ZJSXRUAMSA-N 1 1 409.530 3.206 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1ccc(-c3ccccc3OC)nn1)C2 ZINC001164819880 720170941 /nfs/dbraw/zinc/17/09/41/720170941.db2.gz YVGURGOQVWAGRI-YADARESESA-N 1 1 408.546 3.337 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1nc(-c3ccccn3)nc(C)c1C)C2 ZINC001164818682 720183237 /nfs/dbraw/zinc/18/32/37/720183237.db2.gz TZHDHGWBLMUKQO-RDPSFJRHSA-N 1 1 407.562 3.340 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1cc(-c3nc(C(C)C)no3)ccn1)C2 ZINC001164820246 720185961 /nfs/dbraw/zinc/18/59/61/720185961.db2.gz ZVRWIEUFNGPLRZ-WMZHIEFXSA-N 1 1 411.550 3.440 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1nc(-c3cccnc3)nc3c1CCC3)C2 ZINC001164816579 720186068 /nfs/dbraw/zinc/18/60/68/720186068.db2.gz LOGUCLZTIJRCFX-CPJSRVTESA-N 1 1 419.573 3.212 20 0 HGADMO CC(C)[N@@H+](C)Cc1cc(=O)n2c(n1)CN(c1cnc3cc(Cl)ccc3n1)CCC2 ZINC001164812609 720218673 /nfs/dbraw/zinc/21/86/73/720218673.db2.gz HIGHJUDEOVUXNQ-UHFFFAOYSA-N 1 1 412.925 3.090 20 0 HGADMO CCc1cc2c(ncnc2N2CCCn3c(=O)cc(C[N@@H+](C)C(C)C)nc3C2)s1 ZINC001164814059 720221577 /nfs/dbraw/zinc/22/15/77/720221577.db2.gz RWNZNVTVCUTCMV-UHFFFAOYSA-N 1 1 412.563 3.061 20 0 HGADMO Cc1nc(CN2C(=O)CC[C@H]3[C@@H]2CCN3c2ccc(C[N@H+](C)C3CC3)cn2)cs1 ZINC001164816033 720259919 /nfs/dbraw/zinc/25/99/19/720259919.db2.gz FOTVAYGUBNJJJB-PMACEKPBSA-N 1 1 411.575 3.211 20 0 HGADMO COC(=O)c1ccc(C(F)(F)N2CC[C@@H]3[C@H]2CC[N@@H+]3Cc2cccnc2)c(Cl)n1 ZINC001164722114 720377195 /nfs/dbraw/zinc/37/71/95/720377195.db2.gz BXKPGAWBNQLPCN-IAGOWNOFSA-N 1 1 422.863 3.315 20 0 HGADMO COC(=O)c1ccc(C(F)(F)N2CC[C@@H]3[C@H]2CC[N@H+]3Cc2cccnc2)c(Cl)n1 ZINC001164722114 720377203 /nfs/dbraw/zinc/37/72/03/720377203.db2.gz BXKPGAWBNQLPCN-IAGOWNOFSA-N 1 1 422.863 3.315 20 0 HGADMO COC(=O)c1nc(Cl)ccc1C(F)(F)N1CC[C@@H]2[C@H]1CC[N@@H+]2Cc1cccnc1 ZINC001164723161 720377331 /nfs/dbraw/zinc/37/73/31/720377331.db2.gz GIFOSUJRVWUQEI-HZPDHXFCSA-N 1 1 422.863 3.315 20 0 HGADMO COC(=O)c1nc(Cl)ccc1C(F)(F)N1CC[C@@H]2[C@H]1CC[N@H+]2Cc1cccnc1 ZINC001164723161 720377335 /nfs/dbraw/zinc/37/73/35/720377335.db2.gz GIFOSUJRVWUQEI-HZPDHXFCSA-N 1 1 422.863 3.315 20 0 HGADMO CC1CCN(C(=O)c2cccnc2N2CC[C@@H]3[C@@H]2CC[N@H+]3Cc2cccnc2)CC1 ZINC001164727975 720436306 /nfs/dbraw/zinc/43/63/06/720436306.db2.gz FMJQJMMKQJMUAA-YADHBBJMSA-N 1 1 405.546 3.202 20 0 HGADMO FC(F)(c1c2c(nnc1Cl)CCC2)N1CC[C@H]2[C@@H]1CC[N@@H+]2Cc1cccnc1 ZINC001164732032 720444957 /nfs/dbraw/zinc/44/49/57/720444957.db2.gz MVNWVROQKWLVLH-IRXDYDNUSA-N 1 1 405.880 3.412 20 0 HGADMO FC(F)(c1c2c(nnc1Cl)CCC2)N1CC[C@H]2[C@@H]1CC[N@H+]2Cc1cccnc1 ZINC001164732032 720444965 /nfs/dbraw/zinc/44/49/65/720444965.db2.gz MVNWVROQKWLVLH-IRXDYDNUSA-N 1 1 405.880 3.412 20 0 HGADMO FC(F)(c1nc2ccc(Cl)nc2[nH]1)N1CC[C@@H]2[C@H]1CC[N@@H+]2Cc1cccnc1 ZINC001164727135 720451502 /nfs/dbraw/zinc/45/15/02/720451502.db2.gz DCKMXLAIIGRKSF-HUUCEWRRSA-N 1 1 404.852 3.404 20 0 HGADMO FC(F)(c1nc2ccc(Cl)nc2[nH]1)N1CC[C@@H]2[C@H]1CC[N@H+]2Cc1cccnc1 ZINC001164727135 720451508 /nfs/dbraw/zinc/45/15/08/720451508.db2.gz DCKMXLAIIGRKSF-HUUCEWRRSA-N 1 1 404.852 3.404 20 0 HGADMO COC(=O)c1ccc(Cl)nc1N1CC[C@@H]2[C@@H](C[C@H](Cn3cccn3)[N@H+]2C(C)C)C1 ZINC001164841117 720507788 /nfs/dbraw/zinc/50/77/88/720507788.db2.gz XOEWGPSJTKEDDM-LZLYRXPVSA-N 1 1 417.941 3.096 20 0 HGADMO COC(=O)c1cc(Cl)nc(N2CC[C@@H]3[C@H](C[C@@H](Cn4cccn4)[N@H+]3C(C)C)C2)c1 ZINC001164835787 720513418 /nfs/dbraw/zinc/51/34/18/720513418.db2.gz LJTVLUJZNAWZQI-FGTMMUONSA-N 1 1 417.941 3.096 20 0 HGADMO COC(=O)c1cc(N2CC[C@@H]3[C@@H](C[C@@H](Cn4cccn4)[N@H+]3C(C)C)C2)ncc1Cl ZINC001164839035 720513593 /nfs/dbraw/zinc/51/35/93/720513593.db2.gz RZWUJGGVJDFNQB-TXPKVOOTSA-N 1 1 417.941 3.096 20 0 HGADMO COC(=O)c1c(Cl)ccnc1N1CC[C@@H]2[C@H](C[C@@H](Cn3cccn3)[N@H+]2C(C)C)C1 ZINC001164840072 720513670 /nfs/dbraw/zinc/51/36/70/720513670.db2.gz WHBXIDSVFSPAQO-SOLBZPMBSA-N 1 1 417.941 3.096 20 0 HGADMO CCOC(=O)c1cc(C)cc(N2CC[C@@H]3[C@H](C[C@H](Cn4cccn4)[N@H+]3C(C)C)C2)n1 ZINC001164834873 720519553 /nfs/dbraw/zinc/51/95/53/720519553.db2.gz HTSJFHCWLMRSAS-SFHLNBCPSA-N 1 1 411.550 3.141 20 0 HGADMO CC(C)[N@@H+]1[C@@H]2CCN(c3nc(Cl)nc4cccnc43)C[C@@H]2C[C@H]1Cn1cccn1 ZINC001164840061 720521619 /nfs/dbraw/zinc/52/16/19/720521619.db2.gz WFIIDIQKALAFKX-XYJFISCASA-N 1 1 411.941 3.253 20 0 HGADMO COc1cccc2cnc(N3CC[C@@H]4[C@H](C[C@H](Cn5cccn5)[N@H+]4C(C)C)C3)nc21 ZINC001164833645 720550841 /nfs/dbraw/zinc/55/08/41/720550841.db2.gz BBPCGFDVXOCHKL-VAMGGRTRSA-N 1 1 406.534 3.213 20 0 HGADMO COc1cccc2cnc(N3CC[C@@H]4[C@@H](C[C@@H](Cn5cccn5)[N@H+]4C(C)C)C3)nc21 ZINC001164833644 720551275 /nfs/dbraw/zinc/55/12/75/720551275.db2.gz BBPCGFDVXOCHKL-SLFFLAALSA-N 1 1 406.534 3.213 20 0 HGADMO Cc1cc(N2CC[C@@H]3[C@H](C[C@@H](Cn4cccn4)[N@@H+]3C(C)C)C2)nc(-c2ccncc2)n1 ZINC001164839491 720598386 /nfs/dbraw/zinc/59/83/86/720598386.db2.gz NLHWPRQZAPLZJY-BHIFYINESA-N 1 1 417.561 3.421 20 0 HGADMO FC(F)(c1cc(Cl)cnc1Cl)N1CC[N@@H+]2C[C@@H](Oc3cncnc3)C[C@H]2C1 ZINC001164746901 720627946 /nfs/dbraw/zinc/62/79/46/720627946.db2.gz YOOWIBOTUQCTJH-STQMWFEESA-N 1 1 416.259 3.065 20 0 HGADMO FC(F)(c1cc(Cl)cnc1Cl)N1CC[N@H+]2C[C@@H](Oc3cncnc3)C[C@H]2C1 ZINC001164746901 720627956 /nfs/dbraw/zinc/62/79/56/720627956.db2.gz YOOWIBOTUQCTJH-STQMWFEESA-N 1 1 416.259 3.065 20 0 HGADMO FC(F)(c1ccnc(Cl)c1Cl)N1CC[N@@H+]2C[C@H](Oc3cncnc3)C[C@@H]2C1 ZINC001164740317 720630166 /nfs/dbraw/zinc/63/01/66/720630166.db2.gz IMROQZFXLIMGRN-VXGBXAGGSA-N 1 1 416.259 3.065 20 0 HGADMO FC(F)(c1ccnc(Cl)c1Cl)N1CC[N@H+]2C[C@H](Oc3cncnc3)C[C@@H]2C1 ZINC001164740317 720630187 /nfs/dbraw/zinc/63/01/87/720630187.db2.gz IMROQZFXLIMGRN-VXGBXAGGSA-N 1 1 416.259 3.065 20 0 HGADMO CSc1cc(N2CC[C@@H]3[C@@H](C[C@@H](Cn4cccn4)[N@H+]3C(C)C)C2)nc(SC)n1 ZINC001164839798 720645399 /nfs/dbraw/zinc/64/53/99/720645399.db2.gz KGUTXFWBLKKFLA-YESZJQIVSA-N 1 1 418.636 3.495 20 0 HGADMO C[N@@H+](Cc1ccccc1)[C@@H]1COC2(C1)CCN(c1nccc(N3CCCC3)n1)CC2 ZINC001164840381 720654578 /nfs/dbraw/zinc/65/45/78/720654578.db2.gz MAUZADQJYJJLFZ-NRFANRHFSA-N 1 1 407.562 3.337 20 0 HGADMO Clc1cnc2cc(Cl)c(N3CC[N@H+]4C[C@H](Oc5cncnc5)C[C@H]4C3)cc2n1 ZINC001164740620 720678560 /nfs/dbraw/zinc/67/85/60/720678560.db2.gz RCTOBJARSGODIU-QWHCGFSZSA-N 1 1 417.300 3.069 20 0 HGADMO Cc1cc2nc(Cl)c(N3CC[N@H+]4C[C@H](Oc5cncnc5)C[C@@H]4C3)nc2cc1C ZINC001164742337 720726028 /nfs/dbraw/zinc/72/60/28/720726028.db2.gz OEMRUNCMTDEAAR-HZPDHXFCSA-N 1 1 410.909 3.032 20 0 HGADMO COc1ccc2c(cc(Cl)nc2N2CC[N@H+]3C[C@@H](Oc4cncnc4)C[C@@H]3C2)c1 ZINC001164744849 720732759 /nfs/dbraw/zinc/73/27/59/720732759.db2.gz SVWAWJILTFLRJF-WBVHZDCISA-N 1 1 411.893 3.029 20 0 HGADMO CC[C@H](C)c1nc(Cl)c(C)c(N2CC[N@H+]3C[C@H](Oc4cncnc4)C[C@H]3C2)n1 ZINC001164745960 720800667 /nfs/dbraw/zinc/80/06/67/720800667.db2.gz KZVKQMIKWFTOPT-CWRNSKLLSA-N 1 1 402.930 3.084 20 0 HGADMO Clc1ccc2c(Cl)ncnc2c1N1CC[N@H+]2C[C@@H](Oc3cncnc3)C[C@@H]2C1 ZINC001164747343 720805130 /nfs/dbraw/zinc/80/51/30/720805130.db2.gz NIPYRCHBTONIRS-OLZOCXBDSA-N 1 1 417.300 3.069 20 0 HGADMO COc1cc2cnc(Cl)cc2cc1N1CC[N@H+]2C[C@H](Oc3cncnc3)C[C@@H]2C1 ZINC001164749825 720807691 /nfs/dbraw/zinc/80/76/91/720807691.db2.gz UPKWFEQHBRGWQG-IAGOWNOFSA-N 1 1 411.893 3.029 20 0 HGADMO Cc1sc2ncnc(N3CC[C@@H]4[C@@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)c2c1C ZINC001164751999 720814999 /nfs/dbraw/zinc/81/49/99/720814999.db2.gz YJAMETKSJGTDHW-IPMKNSEASA-N 1 1 423.590 3.279 20 0 HGADMO Clc1ccc2cc(N3CC[C@@H]4[C@@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)ncc2n1 ZINC001164741186 720831500 /nfs/dbraw/zinc/83/15/00/720831500.db2.gz MAJVJDJBWFDXLT-CMKODMSKSA-N 1 1 423.952 3.254 20 0 HGADMO CCOc1ccc(Cl)nc1N1CC[C@@H]2[C@H](C[C@@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164745786 720833635 /nfs/dbraw/zinc/83/36/35/720833635.db2.gz NKLZGJAAECJGIM-FGTMMUONSA-N 1 1 416.957 3.105 20 0 HGADMO COCC[N@H+]1CCO[C@H]2CN(C(F)(F)c3cc(Cl)nc(Cl)c3)CC[C@H]2C1 ZINC001164857749 720835286 /nfs/dbraw/zinc/83/52/86/720835286.db2.gz YPEMSKRMVZJCSV-JSGCOSHPSA-N 1 1 410.292 3.107 20 0 HGADMO COCC[N@H+]1CCO[C@H]2CN(C(F)(F)c3ccc(Cl)nc3Cl)CC[C@@H]2C1 ZINC001164857160 720835378 /nfs/dbraw/zinc/83/53/78/720835378.db2.gz XXGNQZBMXKMBNP-OCCSQVGLSA-N 1 1 410.292 3.107 20 0 HGADMO COCC[N@H+]1CCO[C@H]2CN(C(F)(F)c3cc(Cl)cnc3Cl)CC[C@H]2C1 ZINC001164856527 720836955 /nfs/dbraw/zinc/83/69/55/720836955.db2.gz WSDOOMZNMKRDRA-WFASDCNBSA-N 1 1 410.292 3.107 20 0 HGADMO Fc1ccc2ccc(N3CC[C@@H]4[C@@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)nc2c1 ZINC001164745875 720849193 /nfs/dbraw/zinc/84/91/93/720849193.db2.gz OBNFQEKOZCUUIH-RCZSKKKRSA-N 1 1 406.509 3.345 20 0 HGADMO COCC[N@H+]1CCO[C@@H]2CN(c3nc(Cl)nc4c(Cl)cccc43)CC[C@H]2C1 ZINC001164851454 720850701 /nfs/dbraw/zinc/85/07/01/720850701.db2.gz HGHOSPPWIZKBOH-XJKSGUPXSA-N 1 1 411.333 3.110 20 0 HGADMO COCC[N@H+]1CCO[C@H]2CN(c3nc(Cl)nc4c(Cl)cccc43)CC[C@H]2C1 ZINC001164851451 720851074 /nfs/dbraw/zinc/85/10/74/720851074.db2.gz HGHOSPPWIZKBOH-BBRMVZONSA-N 1 1 411.333 3.110 20 0 HGADMO COc1cccc2c1ccnc2N1CC[C@@H]2[C@@H](C[C@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164739543 720851209 /nfs/dbraw/zinc/85/12/09/720851209.db2.gz BATQEWWUBFFDRG-NNMXDRDESA-N 1 1 418.545 3.214 20 0 HGADMO c1ncn(C[C@@H]2C[C@@H]3CN(c4ccc(COC5CCC5)cn4)CC[C@H]3[N@@H+]2CC2CC2)n1 ZINC001164748668 720855308 /nfs/dbraw/zinc/85/53/08/720855308.db2.gz LMUDNEVVBMQBAH-FUPPJEDESA-N 1 1 422.577 3.122 20 0 HGADMO Cc1cc2ncnc(N3CC[C@@H]4[C@@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)c2cc1C ZINC001164751116 720856119 /nfs/dbraw/zinc/85/61/19/720856119.db2.gz QCCOEQUCZKRYGY-MIZPHKNDSA-N 1 1 417.561 3.218 20 0 HGADMO CC(C)(c1ccnc(Cl)c1)N1CC[C@@H]2[C@@H](C[C@@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164752853 720860947 /nfs/dbraw/zinc/86/09/47/720860947.db2.gz UTVZFICNOKFJQO-YSIASYRMSA-N 1 1 414.985 3.437 20 0 HGADMO COCC[N@H+]1CCO[C@H]2CN(c3nc(Cl)cc4cc(OC)ccc43)CC[C@@H]2C1 ZINC001164851959 720865773 /nfs/dbraw/zinc/86/57/73/720865773.db2.gz BILLHZZNFIDPLS-BEFAXECRSA-N 1 1 405.926 3.070 20 0 HGADMO Cc1cc(C)nc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COCc2cccnc2)n1 ZINC001164748447 720869818 /nfs/dbraw/zinc/86/98/18/720869818.db2.gz DXOJWWPVYVEGNW-ISKFKSNPSA-N 1 1 407.562 3.244 20 0 HGADMO Clc1ncncc1N1CC[C@@]2(C1)C[N@@H+](CC1CC1)C[C@@H]2COCc1cccnc1 ZINC001164754346 720876232 /nfs/dbraw/zinc/87/62/32/720876232.db2.gz RHXOTWCXDZWCQV-KNQAVFIVSA-N 1 1 413.953 3.280 20 0 HGADMO COCC[N@H+]1CCO[C@H]2CN(c3c(C)nc(-c4ccccc4)nc3Cl)CC[C@H]2C1 ZINC001164859914 720879374 /nfs/dbraw/zinc/87/93/74/720879374.db2.gz NFASTLMSIBSHLU-OALUTQOASA-N 1 1 416.953 3.279 20 0 HGADMO Cc1cnc(C)nc1N1CC[C@]2(C1)C[N@@H+](CC1CC1)C[C@H]2COCc1cccnc1 ZINC001164755352 720884033 /nfs/dbraw/zinc/88/40/33/720884033.db2.gz LFTOLMLZCCYTPM-LADGPHEKSA-N 1 1 407.562 3.244 20 0 HGADMO Cc1cnc(C)nc1N1CC[C@@]2(C1)C[N@@H+](CC1CC1)C[C@H]2COCc1cccnc1 ZINC001164755353 720884214 /nfs/dbraw/zinc/88/42/14/720884214.db2.gz LFTOLMLZCCYTPM-UPVQGACJSA-N 1 1 407.562 3.244 20 0 HGADMO COCC[N@H+]1CCO[C@@H]2CN(C(F)(F)C3(c4ccnc(Cl)c4)CC3)CC[C@H]2C1 ZINC001164860512 720891041 /nfs/dbraw/zinc/89/10/41/720891041.db2.gz OTQGKABHDAHSMP-DOTOQJQBSA-N 1 1 415.912 3.029 20 0 HGADMO COCC[N@H+]1CCO[C@H]2CN(c3nc(Cl)cc4cc(F)c(OC)cc43)CC[C@H]2C1 ZINC001164855960 720892902 /nfs/dbraw/zinc/89/29/02/720892902.db2.gz DSINOWCFLJBYTH-LIRRHRJNSA-N 1 1 423.916 3.209 20 0 HGADMO CCOC(=O)c1cc2cccnc2nc1N1CCn2c(C[N@@H+](C)C(C)C)cnc2[C@@H]1C ZINC001164862468 720960062 /nfs/dbraw/zinc/96/00/62/720960062.db2.gz VSMCUZMHQDRCEI-INIZCTEOSA-N 1 1 422.533 3.424 20 0 HGADMO CC(C)[N@@H+](C)Cc1cnc2n1CCN(C(F)(F)COc1ccc(Cl)nn1)[C@H]2C ZINC001164861953 721000813 /nfs/dbraw/zinc/00/08/13/721000813.db2.gz RQZLQMYQUILNDK-ZDUSSCGKSA-N 1 1 414.888 3.215 20 0 HGADMO CC(C)[N@@H+](C)Cc1cnc2n1CCN(C(F)(F)c1nc3[nH]cnc3c(Cl)n1)[C@H]2C ZINC001164858147 721005243 /nfs/dbraw/zinc/00/52/43/721005243.db2.gz IFELZUGVVRVDLT-NSHDSACASA-N 1 1 424.887 3.121 20 0 HGADMO CCC[N@H+]1CCCC[C@@H]1c1ccc(N2CC[C@@H]3[C@@H]2CCN3C(=O)c2cnn(C)c2)nc1 ZINC001164761549 721039002 /nfs/dbraw/zinc/03/90/02/721039002.db2.gz GJZKBBLMMLMUNZ-BHIFYINESA-N 1 1 422.577 3.246 20 0 HGADMO c1ccc(Oc2cc(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@@H]4C3)ncn2)cc1 ZINC001164868031 721061534 /nfs/dbraw/zinc/06/15/34/721061534.db2.gz MHLZAHIMDDBYOI-CTNGQTDRSA-N 1 1 403.486 3.144 20 0 HGADMO Fc1ccc(-c2ccnc(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@@H]4C3)n2)cc1 ZINC001164864382 721081965 /nfs/dbraw/zinc/08/19/65/721081965.db2.gz FRKQEFAOIWQTQP-NHCUHLMSSA-N 1 1 405.477 3.157 20 0 HGADMO Fc1ccc(Cl)nc1C(F)(F)N1CC[N@H+]2C[C@@H](OCc3cccnc3)C[C@H]2C1 ZINC001164864055 721084586 /nfs/dbraw/zinc/08/45/86/721084586.db2.gz DSUHZOQAMQHPLQ-GJZGRUSLSA-N 1 1 412.843 3.294 20 0 HGADMO c1cn(C2CCCC2)c2ncnc(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@@H]4C3)c12 ZINC001164866336 721098178 /nfs/dbraw/zinc/09/81/78/721098178.db2.gz SGPIRBJAQUSIMN-RTWAWAEBSA-N 1 1 418.545 3.421 20 0 HGADMO Cc1cc(Cl)nc(C(F)(F)N2CC[N@H+]3C[C@@H](OCc4cccnc4)C[C@H]3C2)c1 ZINC001164865464 721103214 /nfs/dbraw/zinc/10/32/14/721103214.db2.gz LNCIFLSDHBVEQT-IRXDYDNUSA-N 1 1 408.880 3.463 20 0 HGADMO FC(F)(COc1cccc(Cl)n1)N1CC[N@H+]2C[C@H](OCc3cccnc3)C[C@@H]2C1 ZINC001164864889 721108303 /nfs/dbraw/zinc/10/83/03/721108303.db2.gz HFCUWDMNAFKGLL-IAGOWNOFSA-N 1 1 424.879 3.077 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4nc(Cl)nc5cccc(F)c54)C[C@@H]3C2)cn1 ZINC001164773926 721108505 /nfs/dbraw/zinc/10/85/05/721108505.db2.gz ZHLBBWOWMBDRJD-CABCVRRESA-N 1 1 400.889 3.114 20 0 HGADMO Cc1cccc(-c2ccc(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@@H]4C3)nn2)c1 ZINC001164878967 721146908 /nfs/dbraw/zinc/14/69/08/721146908.db2.gz RDGAAKFPKNMLNH-FGZHOGPDSA-N 1 1 401.514 3.327 20 0 HGADMO COc1cccc(-c2ccc(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@@H]4C3)nn2)c1 ZINC001164874452 721146917 /nfs/dbraw/zinc/14/69/17/721146917.db2.gz KAVLYCLGXKQUAQ-IRLDBZIGSA-N 1 1 417.513 3.027 20 0 HGADMO COc1ccccc1-c1ccc(N2CC[N@H+]3C[C@@H](OCc4cccnc4)C[C@H]3C2)nn1 ZINC001164872508 721147511 /nfs/dbraw/zinc/14/75/11/721147511.db2.gz HJVWIQARMKVMHK-PMACEKPBSA-N 1 1 417.513 3.027 20 0 HGADMO COc1ccccc1-c1cc(N2CC[N@H+]3C[C@@H](OCc4cccnc4)C[C@H]3C2)ncn1 ZINC001164879424 721155005 /nfs/dbraw/zinc/15/50/05/721155005.db2.gz SDHBCSLWXJAUEF-PMACEKPBSA-N 1 1 417.513 3.027 20 0 HGADMO Cc1nc2c3ccccc3oc2c(N2C[C@@H]3CC[N@H+](Cc4cnn(C)c4)C[C@@H]3C2)n1 ZINC001164771381 721162340 /nfs/dbraw/zinc/16/23/40/721162340.db2.gz SLQNHJRHBIMIBU-ZWKOTPCHSA-N 1 1 402.502 3.376 20 0 HGADMO CC(C)c1noc(-c2ccnc(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@H]4C3)c2)n1 ZINC001164871081 721167012 /nfs/dbraw/zinc/16/70/12/721167012.db2.gz DINJZMUNUCNYPM-PMACEKPBSA-N 1 1 420.517 3.130 20 0 HGADMO CC(C)c1noc(-c2ccnc(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@H]4C3)c2)n1 ZINC001164871083 721167565 /nfs/dbraw/zinc/16/75/65/721167565.db2.gz DINJZMUNUCNYPM-VQTJNVASSA-N 1 1 420.517 3.130 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4nccc(Oc5cccc(F)c5)n4)C[C@@H]3C2)cn1 ZINC001164762621 721179912 /nfs/dbraw/zinc/17/99/12/721179912.db2.gz DBEKQAOSKQAYJM-MSOLQXFVSA-N 1 1 408.481 3.100 20 0 HGADMO Clc1cc(-c2ccncc2)nc(N2CC[N@H+]3C[C@@H](OCc4cccnc4)C[C@@H]3C2)n1 ZINC001164880734 721182333 /nfs/dbraw/zinc/18/23/33/721182333.db2.gz XJLHLSBQYMOXNE-MOPGFXCFSA-N 1 1 422.920 3.067 20 0 HGADMO Cc1ccc(C)c(-c2ccc(N3C[C@H]4CC[N@H+](Cc5cnn(C)c5)C[C@@H]4C3)nn2)c1 ZINC001164772867 721212130 /nfs/dbraw/zinc/21/21/30/721212130.db2.gz VQDPRUIITUKMMP-NHCUHLMSSA-N 1 1 402.546 3.452 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4nc(C(F)F)nc5ccc(F)cc54)C[C@@H]3C2)cn1 ZINC001164766735 721230365 /nfs/dbraw/zinc/23/03/65/721230365.db2.gz VIGIBSHMTZSSDW-CABCVRRESA-N 1 1 416.451 3.398 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4ccnc(CSc5ccccc5)n4)C[C@H]3C2)cn1 ZINC001164769863 721238367 /nfs/dbraw/zinc/23/83/67/721238367.db2.gz ZWFPFABCCCHRLV-WOJBJXKFSA-N 1 1 420.586 3.461 20 0 HGADMO Clc1nc2c(ncn2Cc2ccccc2)c(N2CC3(C2)CC[N@@H+](CC2CC2)C3)n1 ZINC001164773020 721283953 /nfs/dbraw/zinc/28/39/53/721283953.db2.gz LUBBAAKHKKAJBH-UHFFFAOYSA-N 1 1 408.937 3.450 20 0 HGADMO CCOC(=O)c1ccc(C(F)(F)N2CCC3(CC(N(C)C)=[NH+]O3)CC2)c(Cl)n1 ZINC001164876731 721326720 /nfs/dbraw/zinc/32/67/20/721326720.db2.gz PPJPRXQQLOSUPE-UHFFFAOYSA-N 1 1 416.856 3.091 20 0 HGADMO CN(C)C1=[NH+]OC2(C1)CCN(C(F)(F)COC(=O)Nc1cccnc1Cl)CC2 ZINC001164876346 721327387 /nfs/dbraw/zinc/32/73/87/721327387.db2.gz OZLVYAOMMHJNQY-UHFFFAOYSA-N 1 1 417.844 3.006 20 0 HGADMO COc1cc(Cl)cnc1N1CCC[C@@]2(C1)COCC[N@H+](Cc1c(C)noc1C)C2 ZINC001164776328 721336614 /nfs/dbraw/zinc/33/66/14/721336614.db2.gz DRZGDRVKXPNYIR-OAQYLSRUSA-N 1 1 420.941 3.467 20 0 HGADMO COc1cc(Cl)cnc1N1CCC[C@@]2(C1)COCC[N@@H+](Cc1c(C)noc1C)C2 ZINC001164776328 721336617 /nfs/dbraw/zinc/33/66/17/721336617.db2.gz DRZGDRVKXPNYIR-OAQYLSRUSA-N 1 1 420.941 3.467 20 0 HGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@@]2(CCCN(c3cc(Cl)nnc3C)C2)C1 ZINC001164777286 721341071 /nfs/dbraw/zinc/34/10/71/721341071.db2.gz FLCAJZHMWGLZEC-FQEVSTJZSA-N 1 1 405.930 3.162 20 0 HGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@@]2(CCCN(c3cc(Cl)nnc3C)C2)C1 ZINC001164777286 721341074 /nfs/dbraw/zinc/34/10/74/721341074.db2.gz FLCAJZHMWGLZEC-FQEVSTJZSA-N 1 1 405.930 3.162 20 0 HGADMO Cc1noc(C)c1CN1CCOC[C@@]2(CCCN(c3[nH+]ccc4c3ccn4C)C2)C1 ZINC001164778832 721342303 /nfs/dbraw/zinc/34/23/03/721342303.db2.gz PBAONEQPIKZODQ-QHCPKHFHSA-N 1 1 409.534 3.297 20 0 HGADMO CCOc1ccc(N2CCC[C@@]3(C2)COCC[N@@H+](Cc2c(C)noc2C)C3)nc1 ZINC001164780082 721344917 /nfs/dbraw/zinc/34/49/17/721344917.db2.gz ZKNJYIIKXDYITF-JOCHJYFZSA-N 1 1 400.523 3.204 20 0 HGADMO CCc1c(Cl)ncnc1N1CCC[C@]2(C1)COCC[N@H+](Cc1c(C)noc1C)C2 ZINC001164787012 721369087 /nfs/dbraw/zinc/36/90/87/721369087.db2.gz XFAVWXFECURNMT-NRFANRHFSA-N 1 1 419.957 3.416 20 0 HGADMO CCc1c(Cl)ncnc1N1CCC[C@]2(C1)COCC[N@@H+](Cc1c(C)noc1C)C2 ZINC001164787012 721369091 /nfs/dbraw/zinc/36/90/91/721369091.db2.gz XFAVWXFECURNMT-NRFANRHFSA-N 1 1 419.957 3.416 20 0 HGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@@]2(CCCN(c3cnc4c(n3)CCCC4)C2)C1 ZINC001164782308 721372299 /nfs/dbraw/zinc/37/22/99/721372299.db2.gz MVCQKXLXVLJMSZ-QHCPKHFHSA-N 1 1 411.550 3.079 20 0 HGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@@]2(CCCN(c3cnc4c(n3)CCCC4)C2)C1 ZINC001164782308 721372301 /nfs/dbraw/zinc/37/23/01/721372301.db2.gz MVCQKXLXVLJMSZ-QHCPKHFHSA-N 1 1 411.550 3.079 20 0 HGADMO COc1ccc2nc(Cl)nc(N3C[C@@H]4C[NH+](Cc5nccs5)C[C@H]4C3)c2c1 ZINC001164780121 721389203 /nfs/dbraw/zinc/38/92/03/721389203.db2.gz DQLCYIVOUBGGJB-STQMWFEESA-N 1 1 401.923 3.317 20 0 HGADMO O=C(NC1CCCCC1)c1cccnc1N1C[C@@H]2C[N@@H+](Cc3nccs3)C[C@@H]2C1 ZINC001164782188 721393816 /nfs/dbraw/zinc/39/38/16/721393816.db2.gz FDLZRNDGRBSICO-CALCHBBNSA-N 1 1 411.575 3.169 20 0 HGADMO O=C(NC1CCCCC1)c1cccnc1N1C[C@@H]2C[N@H+](Cc3nccs3)C[C@@H]2C1 ZINC001164782188 721393820 /nfs/dbraw/zinc/39/38/20/721393820.db2.gz FDLZRNDGRBSICO-CALCHBBNSA-N 1 1 411.575 3.169 20 0 HGADMO COc1cccc2ccc(N3CC[C@]4(C3)CCC[C@H](CN3CC[NH+](C)CC3)O4)nc21 ZINC001164893619 721395090 /nfs/dbraw/zinc/39/50/90/721395090.db2.gz WEKQOOQWPCDCCW-YKSBVNFPSA-N 1 1 410.562 3.009 20 0 HGADMO COc1cccc2ccc(N3CC[C@@]4(C3)CCC[C@@H](CN3CC[NH+](C)CC3)O4)nc21 ZINC001164893616 721395795 /nfs/dbraw/zinc/39/57/95/721395795.db2.gz WEKQOOQWPCDCCW-GBXCKJPGSA-N 1 1 410.562 3.009 20 0 HGADMO C[NH+]1CCN(C[C@@H]2CCC[C@@]3(CCN(c4cnc5c(Cl)cccc5n4)C3)O2)CC1 ZINC001164886685 721402332 /nfs/dbraw/zinc/40/23/32/721402332.db2.gz KSQQEAONQICCAO-JTSKRJEESA-N 1 1 415.969 3.049 20 0 HGADMO C[NH+]1CCN(C[C@H]2CCC[C@@]3(CCN(c4cnc5ccc(Cl)cc5n4)C3)O2)CC1 ZINC001164885640 721405937 /nfs/dbraw/zinc/40/59/37/721405937.db2.gz GWSPDCUGJQTDJB-GCJKJVERSA-N 1 1 415.969 3.049 20 0 HGADMO COc1ccc2nc(Cl)cc(N3C[C@H]4C[NH+](Cc5nccs5)C[C@@H]4C3)c2n1 ZINC001164788989 721412599 /nfs/dbraw/zinc/41/25/99/721412599.db2.gz UBRFMWWMHDWGEB-CHWSQXEVSA-N 1 1 401.923 3.317 20 0 HGADMO CN(C)c1ccc(-c2ccnc(N3C[C@@H]4C[N@@H+](Cc5nccs5)C[C@@H]4C3)n2)cc1 ZINC001164791037 721421927 /nfs/dbraw/zinc/42/19/27/721421927.db2.gz YZLAVOYZRQMRBP-HDICACEKSA-N 1 1 406.559 3.234 20 0 HGADMO CN(C)c1ccc(-c2ccnc(N3C[C@@H]4C[N@H+](Cc5nccs5)C[C@@H]4C3)n2)cc1 ZINC001164791037 721421928 /nfs/dbraw/zinc/42/19/28/721421928.db2.gz YZLAVOYZRQMRBP-HDICACEKSA-N 1 1 406.559 3.234 20 0 HGADMO Cc1cccc(-c2ccc(N3CC[C@@]4(C3)CCC[C@@H](CN3CC[NH+](C)CC3)O4)nn2)c1 ZINC001164898783 721434859 /nfs/dbraw/zinc/43/48/59/721434859.db2.gz WZIZBDBIDAOJSB-WIOPSUGQSA-N 1 1 421.589 3.217 20 0 HGADMO COc1cccc2c1ccnc2N1CC[C@]2(C1)CCC[C@H](CN1CC[NH+](C)CC1)O2 ZINC001164896207 721439422 /nfs/dbraw/zinc/43/94/22/721439422.db2.gz RBYHSBRQSHEKSW-DVECYGJZSA-N 1 1 410.562 3.009 20 0 HGADMO CC(C)c1c(Cl)ncnc1N1CC[C@]2(C1)CCC[C@@H](CN1CC[NH+](C)CC1)O2 ZINC001164892235 721446774 /nfs/dbraw/zinc/44/67/74/721446774.db2.gz HTVLTDHPWLMPNE-UWJYYQICSA-N 1 1 407.990 3.019 20 0 HGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1nc(Cl)nc(C)c1C)CC2 ZINC001164789388 721448391 /nfs/dbraw/zinc/44/83/91/721448391.db2.gz VGQUETLFUDHKBP-LJQANCHMSA-N 1 1 423.001 3.481 20 0 HGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1ncc3ccccc3n1)CC2 ZINC001164785950 721448411 /nfs/dbraw/zinc/44/84/11/721448411.db2.gz JZJRYVJGYUTCJY-NRFANRHFSA-N 1 1 410.562 3.364 20 0 HGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1cc(Cl)nnc1C)CC2 ZINC001164790391 721454868 /nfs/dbraw/zinc/45/48/68/721454868.db2.gz YRUGDRBAJLBOEZ-SFHVURJKSA-N 1 1 408.974 3.172 20 0 HGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1cc(N)cc(Cl)n1)CC2 ZINC001164787659 721456133 /nfs/dbraw/zinc/45/61/33/721456133.db2.gz PCCSWXRTUXTGRW-GOSISDBHSA-N 1 1 408.974 3.051 20 0 HGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1ncncc1C(C)C)CC2 ZINC001164786806 721459385 /nfs/dbraw/zinc/45/93/85/721459385.db2.gz PLHAJSOUVURZDV-FQEVSTJZSA-N 1 1 402.583 3.334 20 0 HGADMO CCC[N@H+]1CCCC[C@@H]1c1ccc(N2CC[C@@H]3O[C@H](C(=O)NCC4CC4)C[C@H]32)nc1 ZINC001164890844 721459479 /nfs/dbraw/zinc/45/94/79/721459479.db2.gz SSUGUAFZTLFYPH-CZYKHXBRSA-N 1 1 412.578 3.281 20 0 HGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1nc(Cl)ccc1OC)CC2 ZINC001164786455 721461481 /nfs/dbraw/zinc/46/14/81/721461481.db2.gz OEXYIGXTHNCJFF-GOSISDBHSA-N 1 1 423.985 3.478 20 0 HGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1cnc(Cl)cc1N)CC2 ZINC001164786911 721464814 /nfs/dbraw/zinc/46/48/14/721464814.db2.gz QMQFFWWSDQPBIZ-QGZVFWFLSA-N 1 1 408.974 3.051 20 0 HGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1cc(C3CCC3)ncn1)CC2 ZINC001164790073 721469995 /nfs/dbraw/zinc/46/99/95/721469995.db2.gz QQCDIHTWZKKDHP-OAQYLSRUSA-N 1 1 414.594 3.478 20 0 HGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1cc(C3CCC3)ncn1)CC2 ZINC001164790071 721470144 /nfs/dbraw/zinc/47/01/44/721470144.db2.gz QQCDIHTWZKKDHP-NRFANRHFSA-N 1 1 414.594 3.478 20 0 HGADMO CC[N@H+]1CCCC[C@H]1c1ccc(N2Cc3nccn3C[C@@H](Cn3cccn3)C2)nc1 ZINC001164897683 721487796 /nfs/dbraw/zinc/48/77/96/721487796.db2.gz UACBSNVKUHXKBG-CTNGQTDRSA-N 1 1 405.550 3.358 20 0 HGADMO COC(=O)c1cc(Cl)nc(N2CCC3(CC([N@@H+](C)Cc4ccncc4)C3)CC2)n1 ZINC001164792185 721489894 /nfs/dbraw/zinc/48/98/94/721489894.db2.gz HWRMZKOJJRXQFF-UHFFFAOYSA-N 1 1 415.925 3.193 20 0 HGADMO CCOC(=O)c1cc(C)nc(N2CCC3(CC([N@@H+](C)Cc4ccncc4)C3)CC2)n1 ZINC001164792462 721492518 /nfs/dbraw/zinc/49/25/18/721492518.db2.gz PDPDAQWETWJPPF-UHFFFAOYSA-N 1 1 409.534 3.238 20 0 HGADMO CCOC(=O)c1ncnc(N2CCC3(CC([N@@H+](C)Cc4ccncc4)C3)CC2)c1C ZINC001164792527 721496529 /nfs/dbraw/zinc/49/65/29/721496529.db2.gz QEJFBPIYRSEODA-UHFFFAOYSA-N 1 1 409.534 3.238 20 0 HGADMO COC(=O)c1cnc(N2CC[N@H+]3C[C@H](Oc4cccc(F)c4)C[C@@H]3C2)c(Cl)c1 ZINC001164900463 721508775 /nfs/dbraw/zinc/50/87/75/721508775.db2.gz RCQMGVOYLYJVAZ-NVXWUHKLSA-N 1 1 405.857 3.003 20 0 HGADMO COC(=O)c1cc(N2CC[N@H+]3C[C@H](Oc4cccc(F)c4)C[C@@H]3C2)ncc1Cl ZINC001164899595 721514288 /nfs/dbraw/zinc/51/42/88/721514288.db2.gz LGINNCUIZATLDO-GDBMZVCRSA-N 1 1 405.857 3.003 20 0 HGADMO Fc1cccc(O[C@@H]2C[C@@H]3CN(c4nc(Cl)nc5c4CSC5)CC[N@H+]3C2)c1 ZINC001164901625 721524500 /nfs/dbraw/zinc/52/45/00/721524500.db2.gz XTMLLXBEJAVHFX-UKRRQHHQSA-N 1 1 406.914 3.358 20 0 HGADMO Cc1cc(C(F)(F)N2CC[N@H+]3C[C@H](Oc4cccc(F)c4)C[C@@H]3C2)nc(Cl)n1 ZINC001164900059 721526426 /nfs/dbraw/zinc/52/64/26/721526426.db2.gz NQMQYYMTWWTZDC-GDBMZVCRSA-N 1 1 412.843 3.464 20 0 HGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2nc(Cl)nc3c2CSC3)[C@@H]2CCCO[C@@H]12 ZINC001164800848 721542923 /nfs/dbraw/zinc/54/29/23/721542923.db2.gz DSXDKKQBVICKLU-KZNAEPCWSA-N 1 1 417.966 3.140 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2nc(Cl)nc3c2CSC3)[C@@H]2CCCO[C@@H]12 ZINC001164800848 721542927 /nfs/dbraw/zinc/54/29/27/721542927.db2.gz DSXDKKQBVICKLU-KZNAEPCWSA-N 1 1 417.966 3.140 20 0 HGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2nc(Cl)nc3c2CSC3)[C@H]2CCCO[C@H]12 ZINC001164800836 721543117 /nfs/dbraw/zinc/54/31/17/721543117.db2.gz DSXDKKQBVICKLU-KSZLIROESA-N 1 1 417.966 3.140 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2nc(Cl)nc3c2CSC3)[C@H]2CCCO[C@H]12 ZINC001164800836 721543121 /nfs/dbraw/zinc/54/31/21/721543121.db2.gz DSXDKKQBVICKLU-KSZLIROESA-N 1 1 417.966 3.140 20 0 HGADMO COC(=O)/C=C/c1cc(C)cnc1N1CC[N@H+]2C[C@H](Oc3cccc(F)c3)C[C@H]2C1 ZINC001164906912 721547833 /nfs/dbraw/zinc/54/78/33/721547833.db2.gz LTMREJWRDKQNLU-VKEZQZQQSA-N 1 1 411.477 3.057 20 0 HGADMO CCOC(=O)c1cnc2cc(N3CC[N@H+]4C[C@H](Oc5cccc(F)c5)C[C@H]4C3)[nH]cc1-2 ZINC001164908712 721550996 /nfs/dbraw/zinc/55/09/96/721550996.db2.gz QGZZADVWTBGHRX-FUHWJXTLSA-N 1 1 424.476 3.221 20 0 HGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2nc(Cl)nc3ncsc32)[C@H]2CCCO[C@@H]12 ZINC001164805423 721555526 /nfs/dbraw/zinc/55/55/26/721555526.db2.gz NTTNLCDDLDAXCX-RRFJBIMHSA-N 1 1 416.938 3.003 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2nc(Cl)nc3ncsc32)[C@H]2CCCO[C@@H]12 ZINC001164805423 721555528 /nfs/dbraw/zinc/55/55/28/721555528.db2.gz NTTNLCDDLDAXCX-RRFJBIMHSA-N 1 1 416.938 3.003 20 0 HGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2ccc(-c3cccs3)nn2)[C@@H]2CCCO[C@@H]12 ZINC001164806696 721564556 /nfs/dbraw/zinc/56/45/56/721564556.db2.gz QXDZMTAUYGPURO-WOIUINJBSA-N 1 1 407.543 3.468 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2ccc(-c3cccs3)nn2)[C@@H]2CCCO[C@@H]12 ZINC001164806696 721564563 /nfs/dbraw/zinc/56/45/63/721564563.db2.gz QXDZMTAUYGPURO-WOIUINJBSA-N 1 1 407.543 3.468 20 0 HGADMO COc1cc(OC)c2ncnc(N3CC[N@H+]4C[C@@H](Oc5cccc(F)c5)C[C@@H]4C3)c2c1 ZINC001164905446 721565933 /nfs/dbraw/zinc/56/59/33/721565933.db2.gz HNCOROBYWJLBAJ-APWZRJJASA-N 1 1 424.476 3.128 20 0 HGADMO Fc1cccc(O[C@@H]2C[C@H]3CN(c4nc5c(nc4Cl)CCCC5)CC[N@H+]3C2)c1 ZINC001164910234 721566248 /nfs/dbraw/zinc/56/62/48/721566248.db2.gz WBZZRNNGKPMKIH-DOTOQJQBSA-N 1 1 402.901 3.490 20 0 HGADMO CCCN(CCC)c1cc(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@H]3OCCC[C@H]32)ncn1 ZINC001164802913 721566938 /nfs/dbraw/zinc/56/69/38/721566938.db2.gz ISLDEUIWUIXTSY-DPLHUUCSSA-N 1 1 424.593 3.366 20 0 HGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2cc(-c3ccccc3)ncn2)[C@@H]2CCCO[C@@H]12 ZINC001164804033 721575560 /nfs/dbraw/zinc/57/55/60/721575560.db2.gz KYOVOODODCASEG-CQOQZXRMSA-N 1 1 401.514 3.407 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2cc(-c3ccccc3)ncn2)[C@@H]2CCCO[C@@H]12 ZINC001164804033 721575562 /nfs/dbraw/zinc/57/55/62/721575562.db2.gz KYOVOODODCASEG-CQOQZXRMSA-N 1 1 401.514 3.407 20 0 HGADMO Cc1cc(C(F)(F)N2C[C@H]([N@H+](C)Cc3cccnc3)[C@H]3OCCC[C@H]32)c(Cl)nn1 ZINC001164802486 721580409 /nfs/dbraw/zinc/58/04/09/721580409.db2.gz GEXKWNJWULEOHW-SQNIBIBYSA-N 1 1 423.895 3.247 20 0 HGADMO Cc1cc(C(F)(F)N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@H]3OCCC[C@H]32)c(Cl)nn1 ZINC001164802486 721580410 /nfs/dbraw/zinc/58/04/10/721580410.db2.gz GEXKWNJWULEOHW-SQNIBIBYSA-N 1 1 423.895 3.247 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2nccc3c4c([nH]c32)CCC4)[C@H]2CCCO[C@H]12 ZINC001164808291 721589435 /nfs/dbraw/zinc/58/94/35/721589435.db2.gz QGQQQYQTYPONKM-XJUOHMSHSA-N 1 1 403.530 3.315 20 0 HGADMO CCc1nc(N2C[C@H]([N@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@@H]32)c(Cl)nc1C ZINC001164806804 721590628 /nfs/dbraw/zinc/59/06/28/721590628.db2.gz MZJAZTWRJDNFLI-GBESFXJTSA-N 1 1 401.942 3.264 20 0 HGADMO CCc1nc(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@@H]32)c(Cl)nc1C ZINC001164806804 721590630 /nfs/dbraw/zinc/59/06/30/721590630.db2.gz MZJAZTWRJDNFLI-GBESFXJTSA-N 1 1 401.942 3.264 20 0 HGADMO CC(C)C(=O)N1CCC[C@@]12CCN(c1ncnc3c1CC[N@H+](Cc1ccccc1)C3)C2 ZINC001165007395 721725318 /nfs/dbraw/zinc/72/53/18/721725318.db2.gz CJZZWRBKQIAKGO-VWLOTQADSA-N 1 1 419.573 3.262 20 0 HGADMO CC(C)C(=O)N1CCC[C@@]12CCN(c1ncnc3c1CC[N@@H+](Cc1ccccc1)C3)C2 ZINC001165007395 721725322 /nfs/dbraw/zinc/72/53/22/721725322.db2.gz CJZZWRBKQIAKGO-VWLOTQADSA-N 1 1 419.573 3.262 20 0 HGADMO CN(C)c1nc(Cl)cc(N2C[C@@H]3CCC[C@@H]([N@@H+](C)Cc4ccccn4)[C@@H]3C2)n1 ZINC001165028840 721800011 /nfs/dbraw/zinc/80/00/11/721800011.db2.gz ZXANTJRALVYHCV-CGTJXYLNSA-N 1 1 400.958 3.328 20 0 HGADMO Cn1cnc2c1nc(Cl)nc2N1C[C@H]2[C@@H](C1)CCC[C@H]2[N@@H+](C)Cc1ccccn1 ZINC001165018579 721808343 /nfs/dbraw/zinc/80/83/43/721808343.db2.gz BJVLVNUMQUAHTK-HYVNUMGLSA-N 1 1 411.941 3.149 20 0 HGADMO CCOC(=O)c1ncnc(N2C[C@@H]3CCC[C@@H]([N@@H+](C)Cc4ccccn4)[C@H]3C2)c1C ZINC001165023610 721814942 /nfs/dbraw/zinc/81/49/42/721814942.db2.gz IJXVQSQFSBSZSE-YSIASYRMSA-N 1 1 409.534 3.094 20 0 HGADMO CON(C)C(=O)c1cc(C)cnc1N1C[C@@H]2CCC[C@H]([N@@H+](C)Cc3ccccn3)[C@@H]2C1 ZINC001165023587 721819921 /nfs/dbraw/zinc/81/99/21/721819921.db2.gz ICNDTQNOARCCCW-BWAGFHJFSA-N 1 1 423.561 3.155 20 0 HGADMO COc1cnc2c(c1)ncnc2N1C[C@@H]2CCC[C@@H]([N@@H+](C)Cc3ccccn3)[C@@H]2C1 ZINC001165025918 721820882 /nfs/dbraw/zinc/82/08/82/721820882.db2.gz OESPJYOWAFULLV-LDQXTDLNSA-N 1 1 404.518 3.165 20 0 HGADMO C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@@H]2CN(c3nc(C(N)=O)cc4ccccc43)C[C@H]21 ZINC001165030546 721825840 /nfs/dbraw/zinc/82/58/40/721825840.db2.gz ZSKMLURMGQOBJV-JMUQELJHSA-N 1 1 415.541 3.466 20 0 HGADMO COCCOC(=O)c1ccnc(N2C[C@@H]3CCC[C@@H]([N@@H+](C)Cc4ccccn4)[C@@H]3C2)c1 ZINC001165027768 721829750 /nfs/dbraw/zinc/82/97/50/721829750.db2.gz TZULBGIICKBEJT-KSEOMHKRSA-N 1 1 424.545 3.017 20 0 HGADMO Cc1ccc(Oc2nc(Cl)ncc2N2CC[C@@H]3[C@H]2CC[N@H+]3CCN(C)C)cc1 ZINC001164933627 721888491 /nfs/dbraw/zinc/88/84/91/721888491.db2.gz NMCWHDFLNQKVGG-QZTJIDSGSA-N 1 1 401.942 3.445 20 0 HGADMO Cc1ccc(Oc2nc(Cl)ncc2N2CC[C@@H]3[C@H]2CC[N@@H+]3CCN(C)C)cc1 ZINC001164933627 721888492 /nfs/dbraw/zinc/88/84/92/721888492.db2.gz NMCWHDFLNQKVGG-QZTJIDSGSA-N 1 1 401.942 3.445 20 0 HGADMO COc1cccc(Oc2nc(Cl)ncc2N2CC[C@@H]3[C@H]2CC[N@@H+]3CCN(C)C)c1 ZINC001164932571 721888800 /nfs/dbraw/zinc/88/88/00/721888800.db2.gz JEXDYKRJIVQUIY-QZTJIDSGSA-N 1 1 417.941 3.146 20 0 HGADMO COc1cccc(Oc2nc(Cl)ncc2N2CC[C@@H]3[C@H]2CC[N@H+]3CCN(C)C)c1 ZINC001164932571 721888803 /nfs/dbraw/zinc/88/88/03/721888803.db2.gz JEXDYKRJIVQUIY-QZTJIDSGSA-N 1 1 417.941 3.146 20 0 HGADMO COc1ccccc1Oc1nc(Cl)ncc1N1CC[C@@H]2[C@H]1CC[N@@H+]2CCN(C)C ZINC001164934415 721889046 /nfs/dbraw/zinc/88/90/46/721889046.db2.gz RLNUGAATSIFHJM-HZPDHXFCSA-N 1 1 417.941 3.146 20 0 HGADMO COc1ccccc1Oc1nc(Cl)ncc1N1CC[C@@H]2[C@H]1CC[N@H+]2CCN(C)C ZINC001164934415 721889048 /nfs/dbraw/zinc/88/90/48/721889048.db2.gz RLNUGAATSIFHJM-HZPDHXFCSA-N 1 1 417.941 3.146 20 0 HGADMO CCOC(=O)Cc1ccc(N2CCC3(CC2)C[N@@H+](Cc2ccc(C)cc2)CCO3)nc1 ZINC001164940955 721926570 /nfs/dbraw/zinc/92/65/70/721926570.db2.gz XHCJSMSAYHUMHG-UHFFFAOYSA-N 1 1 423.557 3.367 20 0 HGADMO Cc1ccc(C[N@H+]2CCOC3(CCN(c4nc(Cl)cc(N(C)C)n4)CC3)C2)cc1 ZINC001164940927 721927351 /nfs/dbraw/zinc/92/73/51/721927351.db2.gz WSTJMEOPCOLLBH-UHFFFAOYSA-N 1 1 415.969 3.376 20 0 HGADMO COC(=O)c1c(Cl)ccnc1N1CCC2(CC[N@@H+](Cc3cccnc3)C2)CC1 ZINC001164954297 722013412 /nfs/dbraw/zinc/01/34/12/722013412.db2.gz JZAMSHUUNCKILK-UHFFFAOYSA-N 1 1 400.910 3.409 20 0 HGADMO CC(C)(C)OC(=O)c1cnc(Cl)cc1N1CC[NH+](CCc2ccccn2)CC1 ZINC001165055797 722014156 /nfs/dbraw/zinc/01/41/56/722014156.db2.gz LDUTVTOSKOVINC-UHFFFAOYSA-N 1 1 402.926 3.450 20 0 HGADMO FC(F)(c1ccc(Cl)nn1)N1CCC2(CC1)COCC[N@@H+](Cc1ccncc1)C2 ZINC001164961948 722054186 /nfs/dbraw/zinc/05/41/86/722054186.db2.gz ZPZPEILMNUPLJF-UHFFFAOYSA-N 1 1 423.895 3.189 20 0 HGADMO COc1ccc2ncc(N3CCC4(CC3)COCC[N@@H+](Cc3ccncc3)C4)nc2c1 ZINC001164963820 722056269 /nfs/dbraw/zinc/05/62/69/722056269.db2.gz MJFZQZGKPRVIQO-UHFFFAOYSA-N 1 1 419.529 3.152 20 0 HGADMO COc1cccc2cnc(N3CCC4(CC3)COCC[N@@H+](Cc3ccncc3)C4)nc21 ZINC001164962976 722056824 /nfs/dbraw/zinc/05/68/24/722056824.db2.gz GIYXGSGMXUDEHG-UHFFFAOYSA-N 1 1 419.529 3.152 20 0 HGADMO c1cc2c(nc(C3CC3)nc2N2CCC3(CC2)COCC[N@H+](Cc2ccncc2)C3)[nH]1 ZINC001164963693 722061694 /nfs/dbraw/zinc/06/16/94/722061694.db2.gz BZAFLVKZHYHAPD-UHFFFAOYSA-N 1 1 418.545 3.349 20 0 HGADMO FC(F)(c1cc(Cl)nc(-c2ccncc2)n1)N1C[C@@H]2C[N@@H+](CC3CC3)C[C@H](C1)O2 ZINC001164967515 722074956 /nfs/dbraw/zinc/07/49/56/722074956.db2.gz SRRLANFERQQVNH-IYBDPMFKSA-N 1 1 421.879 3.036 20 0 HGADMO FC(F)(c1cc(Cl)nc(-c2ccncc2)n1)N1C[C@@H]2C[N@H+](CC3CC3)C[C@H](C1)O2 ZINC001164967515 722074957 /nfs/dbraw/zinc/07/49/57/722074957.db2.gz SRRLANFERQQVNH-IYBDPMFKSA-N 1 1 421.879 3.036 20 0 HGADMO CCC[N@H+]1CCCC[C@@H]1c1ccc(N2CCO[C@@]3(CCCN(C(C)=O)C3)C2)nc1 ZINC001164969089 722084179 /nfs/dbraw/zinc/08/41/79/722084179.db2.gz JVEZIXNXELHDBM-FYYLOGMGSA-N 1 1 400.567 3.236 20 0 HGADMO FC(F)(c1ccnc(Cl)c1)N1CC[C@@H]2C[N@@H+](Cc3cccnc3)CCO[C@@H]2C1 ZINC001164986541 722100766 /nfs/dbraw/zinc/10/07/66/722100766.db2.gz ZGZOVUHCEZCHKK-SJLPKXTDSA-N 1 1 408.880 3.402 20 0 HGADMO Cc1cc(C(F)(F)N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)nc(Cl)n1 ZINC001164974998 722109810 /nfs/dbraw/zinc/10/98/10/722109810.db2.gz JEDBUHGQVQZAGQ-IAGOWNOFSA-N 1 1 423.895 3.106 20 0 HGADMO Clc1ccc2cnc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)nc2c1 ZINC001164981008 722125908 /nfs/dbraw/zinc/12/59/08/722125908.db2.gz RXZJGVYTNBTKFP-GHTZIAJQSA-N 1 1 409.921 3.406 20 0 HGADMO c1cncc(C[N@H+]2CCO[C@H]3CN(c4ncnc5sc6c(c54)CCC6)CC[C@@H]3C2)c1 ZINC001164980365 722139236 /nfs/dbraw/zinc/13/92/36/722139236.db2.gz NFSIRPJQQMFSEX-MJGOQNOKSA-N 1 1 421.570 3.302 20 0 HGADMO Cc1cc(C(F)(F)N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)c(Cl)nn1 ZINC001164979700 722143400 /nfs/dbraw/zinc/14/34/00/722143400.db2.gz LTJUJBGYAWGQLX-SJLPKXTDSA-N 1 1 423.895 3.106 20 0 HGADMO c1ccc(Cc2nccc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)n2)cc1 ZINC001164985060 722147057 /nfs/dbraw/zinc/14/70/57/722147057.db2.gz ZATCDMUFLIUBBL-XZOQPEGZSA-N 1 1 415.541 3.190 20 0 HGADMO CCc1nc2sccc2c(N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)n1 ZINC001164980954 722150554 /nfs/dbraw/zinc/15/05/54/722150554.db2.gz OFZWXTHKQZPEDM-HKUYNNGSSA-N 1 1 409.559 3.376 20 0 HGADMO CSc1ccc2ncnc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)c2c1 ZINC001164972558 722153964 /nfs/dbraw/zinc/15/39/64/722153964.db2.gz IKCCJTLQNCHQCS-GCJKJVERSA-N 1 1 421.570 3.474 20 0 HGADMO Fc1cccc(CN2CC[C@@]23CCCN(c2nc(Cl)nc4c2C[NH2+]CC4)C3)c1 ZINC001164995307 722191686 /nfs/dbraw/zinc/19/16/86/722191686.db2.gz UGAUZPTUYKXOGO-OAQYLSRUSA-N 1 1 401.917 3.160 20 0 HGADMO CON(C)C(=O)c1cc(C)cnc1N1CCC[C@]2(CC[N@H+]2Cc2cccc(F)c2)C1 ZINC001164993775 722206019 /nfs/dbraw/zinc/20/60/19/722206019.db2.gz BEMMRNIKXOIOOX-QHCPKHFHSA-N 1 1 412.509 3.407 20 0 HGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2CCO[C@@H]3C[C@H](C(=O)NC(C)C)C[C@@H]32)nc1 ZINC001164997854 722216895 /nfs/dbraw/zinc/21/68/95/722216895.db2.gz SMXIPZSKMWHYGF-MXEMCNAFSA-N 1 1 400.567 3.137 20 0 HGADMO COc1cccc2c1CC[C@@]2(CO)[NH2+]Cc1c[nH]c(=NC(=O)OC(C)(C)C)s1 ZINC001179447672 1126152273 /nfs/dbraw/zinc/15/22/73/1126152273.db2.gz NYOLOMIGVYYVCK-FQEVSTJZSA-N 1 1 405.520 3.422 20 0 HGADMO CC(C)(C)C(=O)Nc1ccnc(N2CCC23CCCC3)c1C[N@@H+]1CC[C@@H](CO)C1 ZINC001164400011 718845260 /nfs/dbraw/zinc/84/52/60/718845260.db2.gz NEJVDSVPTACFHO-QGZVFWFLSA-N 1 1 400.567 3.403 20 0 HGADMO CC(C)(C)C(=O)Nc1ccnc(N2CCC23CCCC3)c1C[N@H+]1CC[C@@H](CO)C1 ZINC001164400011 718845262 /nfs/dbraw/zinc/84/52/62/718845262.db2.gz NEJVDSVPTACFHO-QGZVFWFLSA-N 1 1 400.567 3.403 20 0 HGADMO NC(=O)c1ccc(C(F)(F)N2CCC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)nc1Cl ZINC001164626574 719056026 /nfs/dbraw/zinc/05/60/26/719056026.db2.gz SFZDTRFCUXHOAL-NVXWUHKLSA-N 1 1 420.891 3.480 20 0 HGADMO O=C1NCc2c1c(N1CCC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@H]31)nc(Cl)c2F ZINC001164628945 719083156 /nfs/dbraw/zinc/08/31/56/719083156.db2.gz VDGQHSCHZLZOMW-GDBMZVCRSA-N 1 1 400.885 3.218 20 0 HGADMO CCOC(=O)c1nc2ccn(C)c2c(N2CCC[C@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)n1 ZINC001164632399 719091733 /nfs/dbraw/zinc/09/17/33/719091733.db2.gz ZITVRGGHCKFFAV-ICSRJNTNSA-N 1 1 419.529 3.246 20 0 HGADMO CS(=O)(=O)c1ccc(Cl)nc1N1CCC[C@H]2C[N@H+](Cc3ccccc3)C[C@H]21 ZINC001164621776 719094407 /nfs/dbraw/zinc/09/44/07/719094407.db2.gz AUFYDSOKYXQZJE-DLBZAZTESA-N 1 1 405.951 3.239 20 0 HGADMO CS(=O)(=O)c1ccc(Cl)nc1N1CCC[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]21 ZINC001164621776 719094413 /nfs/dbraw/zinc/09/44/13/719094413.db2.gz AUFYDSOKYXQZJE-DLBZAZTESA-N 1 1 405.951 3.239 20 0 HGADMO O=c1ccccn1Cc1ccc(N2CCC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)nc1 ZINC001164632558 719100317 /nfs/dbraw/zinc/10/03/17/719100317.db2.gz ZRSWAQPOPNBMRV-DHIUTWEWSA-N 1 1 400.526 3.392 20 0 HGADMO COc1nnc(Cl)cc1C(F)(F)N1CCc2c(C[NH+](C)C)nn(C(C)C)c2C1 ZINC001164650865 719317938 /nfs/dbraw/zinc/31/79/38/719317938.db2.gz FCKSKRUAAFCESE-UHFFFAOYSA-N 1 1 414.888 3.085 20 0 HGADMO CC(C)C[NH+]1CCN(C(F)(F)c2nc(Cl)ncc2C(=O)OCC2CC2)CC1 ZINC001164654450 719332353 /nfs/dbraw/zinc/33/23/53/719332353.db2.gz QDPFUMXVLYPITQ-UHFFFAOYSA-N 1 1 402.873 3.020 20 0 HGADMO COc1ccnc(N2CCC3(C[C@H](CC(=O)NCC[NH+](C)C)c4ccccc43)CC2)c1 ZINC001164683045 719657417 /nfs/dbraw/zinc/65/74/17/719657417.db2.gz UOHUXEANKBWZAJ-IBGZPJMESA-N 1 1 422.573 3.184 20 0 HGADMO CCOC(=O)c1c(C)ncnc1N1CCC2(CCC[N@H+]2Cc2csc(C)n2)CC1 ZINC001164692750 719809298 /nfs/dbraw/zinc/80/92/98/719809298.db2.gz MCWLQMMDDVYMPW-UHFFFAOYSA-N 1 1 415.563 3.362 20 0 HGADMO COC(=O)[C@]1(C)C[C@H]([NH+]2CCOCC2)CCN1c1nc(Cl)cc2ccc(C)cc21 ZINC001164700577 719861792 /nfs/dbraw/zinc/86/17/92/719861792.db2.gz ICTJGUOMJOCDEU-VGSWGCGISA-N 1 1 417.937 3.429 20 0 HGADMO COC(=O)[C@@]1(C)C[C@H]([NH+]2CCOCC2)CCN1c1cc(Cl)nc2c(F)cccc12 ZINC001164705371 719878094 /nfs/dbraw/zinc/87/80/94/719878094.db2.gz YKLSPHPAILEOTE-SPLOXXLWSA-N 1 1 421.900 3.260 20 0 HGADMO COC(=O)[C@@]1(C)C[C@@H]([NH+]2CCOCC2)CCN1c1nc(Cl)cc2cccc(F)c21 ZINC001164700834 719880674 /nfs/dbraw/zinc/88/06/74/719880674.db2.gz MJKGSIPLIMVSSK-YCRPNKLZSA-N 1 1 421.900 3.260 20 0 HGADMO COC(=O)c1c(C)cc(C)nc1N1CCC2(CC1)C[N@@H+](Cc1cccs1)CCO2 ZINC001164694586 719891795 /nfs/dbraw/zinc/89/17/95/719891795.db2.gz AHFHDOZUCKAEBK-UHFFFAOYSA-N 1 1 415.559 3.418 20 0 HGADMO c1csc(C[N@H+]2CCOC3(CCN(c4ccc(-c5ccccn5)nn4)CC3)C2)c1 ZINC001164706848 719899295 /nfs/dbraw/zinc/89/92/95/719899295.db2.gz LFFMSFOYZQNOJT-UHFFFAOYSA-N 1 1 407.543 3.472 20 0 HGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2CCc3nnc(Cn4cccc4)n3CC2)nc1 ZINC001164710056 720091274 /nfs/dbraw/zinc/09/12/74/720091274.db2.gz GJROHYWMPONBTD-HXUWFJFHSA-N 1 1 405.550 3.133 20 0 HGADMO COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1ncc(C)c(NC3CC3)n1)CC2 ZINC001164709624 720093305 /nfs/dbraw/zinc/09/33/05/720093305.db2.gz BNTLEVMGVWXEKG-NRFANRHFSA-N 1 1 422.577 3.262 20 0 HGADMO COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1nc(Cl)ncc1OC)CC2 ZINC001164710347 720096626 /nfs/dbraw/zinc/09/66/26/720096626.db2.gz JDPMESVZFXZVRK-QGZVFWFLSA-N 1 1 417.941 3.041 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(C(F)(F)c1cnc(Cl)cc1N)C2 ZINC001164811561 720122325 /nfs/dbraw/zinc/12/23/25/720122325.db2.gz MLZBNHPZGAMDTQ-KBXCAEBGSA-N 1 1 400.901 3.047 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1cc(Cl)nc3ccc(OC)nc31)C2 ZINC001164814965 720122737 /nfs/dbraw/zinc/12/27/37/720122737.db2.gz UTUKHQPWVPPNDL-AOMKIAJQSA-N 1 1 416.953 3.477 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1nc(Cl)nc3cccc(OC)c31)C2 ZINC001164814376 720124893 /nfs/dbraw/zinc/12/48/93/720124893.db2.gz SDIDVPXIZIUKQK-OPAMFIHVSA-N 1 1 416.953 3.477 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1cncc(Oc3cccc(OC)c3)n1)C2 ZINC001164813320 720146759 /nfs/dbraw/zinc/14/67/59/720146759.db2.gz QFDVVPCEEDQKBV-NTKDMRAZSA-N 1 1 424.545 3.462 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1ccc(-c3ccccc3OC)nn1)C2 ZINC001164819878 720170287 /nfs/dbraw/zinc/17/02/87/720170287.db2.gz YVGURGOQVWAGRI-NTKDMRAZSA-N 1 1 408.546 3.337 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1ccc3c(cccc3C(=O)OC)n1)C2 ZINC001164812436 720186645 /nfs/dbraw/zinc/18/66/45/720186645.db2.gz AQKGTLXCATVIJE-UUOWRZLLSA-N 1 1 409.530 3.206 20 0 HGADMO CC(C)[N@@H+](C)Cc1cc(=O)n2c(n1)CN(c1nccc(-c3ccc(F)cc3)n1)CCC2 ZINC001164812903 720220337 /nfs/dbraw/zinc/22/03/37/720220337.db2.gz KDMPZOSNQJUVJP-UHFFFAOYSA-N 1 1 422.508 3.090 20 0 HGADMO CC(C)[N@@H+](C)Cc1cc(=O)n2c(n1)CN(c1ccc3c(Cl)ccnc3n1)CCC2 ZINC001164813547 720226664 /nfs/dbraw/zinc/22/66/64/720226664.db2.gz OLVQFIVROSUGKL-UHFFFAOYSA-N 1 1 412.925 3.090 20 0 HGADMO Cc1ccc(-c2ccc(N3CCCn4c(=O)cc(C[N@H+](C)C(C)C)nc4C3)nn2)cc1 ZINC001164812322 720234476 /nfs/dbraw/zinc/23/44/76/720234476.db2.gz FIYPQYUSVNZJOK-UHFFFAOYSA-N 1 1 418.545 3.259 20 0 HGADMO CSc1ccc2ncnc(N3CCCn4c(=O)cc(C[N@@H+](C)C(C)C)nc4C3)c2c1 ZINC001164818071 720243638 /nfs/dbraw/zinc/24/36/38/720243638.db2.gz WYOQQMCHHZSNMT-UHFFFAOYSA-N 1 1 424.574 3.159 20 0 HGADMO CCOC(=O)c1nc2ccccc2c(N2CC[C@H]3[C@@H]2CC[N@H+]3Cc2cccnc2)n1 ZINC001164726642 720340202 /nfs/dbraw/zinc/34/02/02/720340202.db2.gz QTIUWCQPZBUDMP-PMACEKPBSA-N 1 1 403.486 3.055 20 0 HGADMO COC(=O)c1ccc2nc(Cl)c(N3CC[C@H]4[C@H]3CC[N@@H+]4Cc3cccnc3)nc2c1 ZINC001164724492 720341246 /nfs/dbraw/zinc/34/12/46/720341246.db2.gz KJOFHJTZKZMZLP-RBUKOAKNSA-N 1 1 423.904 3.318 20 0 HGADMO COC(=O)c1ccc2nc(Cl)c(N3CC[C@H]4[C@H]3CC[N@H+]4Cc3cccnc3)nc2c1 ZINC001164724492 720341254 /nfs/dbraw/zinc/34/12/54/720341254.db2.gz KJOFHJTZKZMZLP-RBUKOAKNSA-N 1 1 423.904 3.318 20 0 HGADMO CC1CCN(C(=O)c2cccnc2N2CC[C@@H]3[C@H]2CC[N@H+]3Cc2cccnc2)CC1 ZINC001164727971 720435222 /nfs/dbraw/zinc/43/52/22/720435222.db2.gz FMJQJMMKQJMUAA-FGZHOGPDSA-N 1 1 405.546 3.202 20 0 HGADMO COc1ccc(-c2ccc(N3CC[C@@H]4[C@H]3CC[N@H+]4Cc3cccnc3)nn2)c(OC)c1 ZINC001164735366 720457538 /nfs/dbraw/zinc/45/75/38/720457538.db2.gz WQXFFJDUPXAMDD-FGZHOGPDSA-N 1 1 417.513 3.409 20 0 HGADMO CC(C)[N@@H+]1[C@@H]2CCN(c3nc(Cl)nc4c3SCC4)C[C@@H]2C[C@H]1Cn1cccn1 ZINC001164833641 720530262 /nfs/dbraw/zinc/53/02/62/720530262.db2.gz BBLYDWIMDKREBF-YQQAZPJKSA-N 1 1 418.998 3.353 20 0 HGADMO COc1c(Cl)nc(C)nc1N1CC[C@@H]2[C@@H](C[C@H](Cn3cccn3)[N@H+]2C(C)C)C1 ZINC001164839317 720543778 /nfs/dbraw/zinc/54/37/78/720543778.db2.gz QFXNLTAMKXAXDJ-GVDBMIGSSA-N 1 1 404.946 3.021 20 0 HGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@@H]2CN(c3ccc(C(=O)NC(C)(C)C)cn3)CC[C@@H]21 ZINC001164837344 720546175 /nfs/dbraw/zinc/54/61/75/720546175.db2.gz LTYCYQDXIJXVDH-HKBOAZHASA-N 1 1 424.593 3.184 20 0 HGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@H]2CN(c3nc(Cl)nc4ncsc43)CC[C@@H]21 ZINC001164838501 720548705 /nfs/dbraw/zinc/54/87/05/720548705.db2.gz ODFPUEYPFPJFCE-KKUMJFAQSA-N 1 1 417.970 3.314 20 0 HGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@H]2CN(c3ccnc(-c4cccnc4)n3)CC[C@@H]21 ZINC001164835436 720557877 /nfs/dbraw/zinc/55/78/77/720557877.db2.gz HJHFTHLXUSOCIG-ACRUOGEOSA-N 1 1 403.534 3.113 20 0 HGADMO CC(C)[N@@H+]1[C@@H]2CCN(c3nccc(-c4cccnc4F)n3)C[C@@H]2C[C@H]1Cn1cccn1 ZINC001164841414 720573807 /nfs/dbraw/zinc/57/38/07/720573807.db2.gz VFGUEUQLABXACX-BBTUJRGHSA-N 1 1 421.524 3.252 20 0 HGADMO Cc1cc(N2CC[C@@H]3[C@H](C[C@H](Cn4cccn4)[N@@H+]3C(C)C)C2)nc(-c2ccncc2)n1 ZINC001164839493 720598240 /nfs/dbraw/zinc/59/82/40/720598240.db2.gz NLHWPRQZAPLZJY-YPAWHYETSA-N 1 1 417.561 3.421 20 0 HGADMO Cc1cc(N2CC[C@@H]3[C@@H](C[C@@H](Cn4cccn4)[N@@H+]3C(C)C)C2)nc(-c2ccncc2)n1 ZINC001164839492 720598845 /nfs/dbraw/zinc/59/88/45/720598845.db2.gz NLHWPRQZAPLZJY-FDFHNCONSA-N 1 1 417.561 3.421 20 0 HGADMO CC(C)[N@@H+]1[C@@H]2CCN(c3ccc(N4CCC(C)CC4)nn3)C[C@H]2C[C@H]1Cn1cccn1 ZINC001164840079 720607246 /nfs/dbraw/zinc/60/72/46/720607246.db2.gz OWSHSJWKXXCATJ-BHIFYINESA-N 1 1 423.609 3.287 20 0 HGADMO COc1cccc2ncnc(N3CC[C@@H]4[C@@H](C[C@@H](Cn5cccn5)[N@H+]4C(C)C)C3)c21 ZINC001164837167 720609212 /nfs/dbraw/zinc/60/92/12/720609212.db2.gz HJEHKXSDWPPBRU-CMKODMSKSA-N 1 1 406.534 3.213 20 0 HGADMO FC(F)(c1cc(Cl)ncc1Cl)N1CC[N@@H+]2C[C@H](Oc3cncnc3)C[C@@H]2C1 ZINC001164739625 720621396 /nfs/dbraw/zinc/62/13/96/720621396.db2.gz GGIAFQVIIFRALE-VXGBXAGGSA-N 1 1 416.259 3.065 20 0 HGADMO FC(F)(c1cc(Cl)ncc1Cl)N1CC[N@H+]2C[C@H](Oc3cncnc3)C[C@@H]2C1 ZINC001164739625 720621412 /nfs/dbraw/zinc/62/14/12/720621412.db2.gz GGIAFQVIIFRALE-VXGBXAGGSA-N 1 1 416.259 3.065 20 0 HGADMO Clc1cc(Cl)c(N2CC[N@@H+]3C[C@@H](Oc4cncnc4)C[C@@H]3C2)c(Cl)n1 ZINC001164738192 720658083 /nfs/dbraw/zinc/65/80/83/720658083.db2.gz IMEIDNSGMMLAFK-MNOVXSKESA-N 1 1 400.697 3.174 20 0 HGADMO Clc1cc(Cl)c(N2CC[N@H+]3C[C@@H](Oc4cncnc4)C[C@@H]3C2)c(Cl)n1 ZINC001164738192 720658097 /nfs/dbraw/zinc/65/80/97/720658097.db2.gz IMEIDNSGMMLAFK-MNOVXSKESA-N 1 1 400.697 3.174 20 0 HGADMO Clc1cc(Cl)c(N2CC[N@@H+]3C[C@@H](Oc4cncnc4)C[C@H]3C2)c(Cl)n1 ZINC001164738195 720658699 /nfs/dbraw/zinc/65/86/99/720658699.db2.gz IMEIDNSGMMLAFK-QWRGUYRKSA-N 1 1 400.697 3.174 20 0 HGADMO Clc1cc(Cl)c(N2CC[N@H+]3C[C@@H](Oc4cncnc4)C[C@H]3C2)c(Cl)n1 ZINC001164738195 720658707 /nfs/dbraw/zinc/65/87/07/720658707.db2.gz IMEIDNSGMMLAFK-QWRGUYRKSA-N 1 1 400.697 3.174 20 0 HGADMO C[N@@H+](Cc1ccccc1)[C@@H]1COC2(C1)CCN(c1ccc(Cl)c(C(N)=O)n1)CC2 ZINC001164838139 720665950 /nfs/dbraw/zinc/66/59/50/720665950.db2.gz GBGZJIFHZHDPJL-KRWDZBQOSA-N 1 1 414.937 3.094 20 0 HGADMO Clc1ccc2nc(N3CC[N@H+]4C[C@@H](Oc5cncnc5)C[C@H]4C3)c(Cl)nc2c1 ZINC001164737835 720672420 /nfs/dbraw/zinc/67/24/20/720672420.db2.gz HIDWSBLCINBWQK-KBPBESRZSA-N 1 1 417.300 3.069 20 0 HGADMO c1ccc(-c2nc3ccccc3c(N3CC[N@@H+]4C[C@H](Oc5cncnc5)C[C@@H]4C3)n2)cc1 ZINC001164737565 720677574 /nfs/dbraw/zinc/67/75/74/720677574.db2.gz GECIPGOTGKGKCR-WOJBJXKFSA-N 1 1 424.508 3.429 20 0 HGADMO FC(F)(c1ccc(Cl)c(Cl)n1)N1CC[N@@H+]2C[C@H](Oc3cncnc3)C[C@H]2C1 ZINC001164738985 720693723 /nfs/dbraw/zinc/69/37/23/720693723.db2.gz LVMFKITUDQNXFK-NWDGAFQWSA-N 1 1 416.259 3.065 20 0 HGADMO FC(F)(c1ccc(Cl)c(Cl)n1)N1CC[N@H+]2C[C@H](Oc3cncnc3)C[C@H]2C1 ZINC001164738985 720693727 /nfs/dbraw/zinc/69/37/27/720693727.db2.gz LVMFKITUDQNXFK-NWDGAFQWSA-N 1 1 416.259 3.065 20 0 HGADMO CN(C)c1cc(Cl)nc(N2CCC3(C[C@H]([N@@H+](C)Cc4ccccc4)CO3)CC2)n1 ZINC001164845325 720695003 /nfs/dbraw/zinc/69/50/03/720695003.db2.gz YEHACTPWHUINPI-SFHVURJKSA-N 1 1 415.969 3.456 20 0 HGADMO COC(=O)c1cc(C)cc(N2CCC3(C[C@H]([N@@H+](C)Cc4ccccc4)CO3)CC2)n1 ZINC001164843653 720699459 /nfs/dbraw/zinc/69/94/59/720699459.db2.gz PVOWRODRJIEORQ-FQEVSTJZSA-N 1 1 409.530 3.437 20 0 HGADMO CC[C@H](C)c1nc(Cl)c(C)c(N2CC[N@H+]3C[C@@H](Oc4cncnc4)C[C@H]3C2)n1 ZINC001164745959 720800935 /nfs/dbraw/zinc/80/09/35/720800935.db2.gz KZVKQMIKWFTOPT-BPUTZDHNSA-N 1 1 402.930 3.084 20 0 HGADMO CCC[N@H+]1CCCC[C@@H]1c1ccc(N2C[C@H](NC(=O)C3CCC3)[C@@H]3COC[C@@H]32)nc1 ZINC001164849746 720804275 /nfs/dbraw/zinc/80/42/75/720804275.db2.gz SSTGNCBMFMUOFY-KJJMTIBFSA-N 1 1 412.578 3.139 20 0 HGADMO CCC[N@H+]1CCCC[C@@H]1c1ccc(N2C[C@H](NC(=O)C3CCC3)[C@H]3COC[C@H]32)nc1 ZINC001164849742 720804377 /nfs/dbraw/zinc/80/43/77/720804377.db2.gz SSTGNCBMFMUOFY-CIAFKFPVSA-N 1 1 412.578 3.139 20 0 HGADMO Clc1ccc(Cl)c(N2CC[C@@H]3[C@H](C[C@@H](Cn4cncn4)[N@H+]3CC3CC3)C2)n1 ZINC001164745123 720822678 /nfs/dbraw/zinc/82/26/78/720822678.db2.gz WKSIARVKJTYAQI-HLLBOEOZSA-N 1 1 407.349 3.359 20 0 HGADMO CSc1cc(Cl)ncc1N1CC[C@@H]2[C@@H](C[C@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164738359 720823926 /nfs/dbraw/zinc/82/39/26/720823926.db2.gz FBECGFCZGHICCU-GVDBMIGSSA-N 1 1 418.998 3.428 20 0 HGADMO Clc1ccc2c(cnnc2N2CC[C@@H]3[C@@H](C[C@H](Cn4cncn4)[N@H+]3CC3CC3)C2)c1 ZINC001164741857 720831598 /nfs/dbraw/zinc/83/15/98/720831598.db2.gz OQFGWBITVVCIGH-FBBABVLZSA-N 1 1 423.952 3.254 20 0 HGADMO Clc1ccc2nc(N3CC[C@@H]4[C@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)ncc2c1 ZINC001164741172 720832415 /nfs/dbraw/zinc/83/24/15/720832415.db2.gz DNVHENNWRAJVKT-SLYNCCJLSA-N 1 1 423.952 3.254 20 0 HGADMO CSc1ccnc(Cl)c1N1CC[C@@H]2[C@@H](C[C@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164746693 720835897 /nfs/dbraw/zinc/83/58/97/720835897.db2.gz PZDVADFMKWXSDM-GVDBMIGSSA-N 1 1 418.998 3.428 20 0 HGADMO COCC[N@H+]1CCO[C@@H]2CN(C(F)(F)c3cc(Cl)nc(Cl)c3)CC[C@@H]2C1 ZINC001164857759 720836151 /nfs/dbraw/zinc/83/61/51/720836151.db2.gz YPEMSKRMVZJCSV-TZMCWYRMSA-N 1 1 410.292 3.107 20 0 HGADMO COc1cc(N2CC[C@@H]3[C@H](C[C@@H](Cn4cncn4)[N@H+]3CC3CC3)C2)nc2ccccc21 ZINC001164744691 720839938 /nfs/dbraw/zinc/83/99/38/720839938.db2.gz LDBRUSWCTTYLFM-XQBPLPMBSA-N 1 1 418.545 3.214 20 0 HGADMO c1ncn(C[C@H]2C[C@@H]3CN(c4cc(-c5ccccc5)ncn4)CC[C@H]3[N@H+]2CC2CC2)n1 ZINC001164748951 720845688 /nfs/dbraw/zinc/84/56/88/720845688.db2.gz VERXEFRJKQKEDI-MQSCRBSSSA-N 1 1 415.545 3.115 20 0 HGADMO Fc1ccc2ccc(N3CC[C@@H]4[C@@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)nc2c1 ZINC001164745871 720849108 /nfs/dbraw/zinc/84/91/08/720849108.db2.gz OBNFQEKOZCUUIH-CZTZKLFOSA-N 1 1 406.509 3.345 20 0 HGADMO COCC[N@H+]1CCO[C@H]2CN(c3nc(Cl)nc4cc(Cl)ccc43)CC[C@@H]2C1 ZINC001164859604 720854303 /nfs/dbraw/zinc/85/43/03/720854303.db2.gz USUBELJHYOPBNQ-DYVFJYSZSA-N 1 1 411.333 3.110 20 0 HGADMO COCC[N@H+]1CCO[C@@H]2CN(c3nc4cc(C)c(C)cc4nc3Cl)CC[C@@H]2C1 ZINC001164853521 720864072 /nfs/dbraw/zinc/86/40/72/720864072.db2.gz GVVPICRSWYSWTF-VQIMIIECSA-N 1 1 404.942 3.074 20 0 HGADMO COCC[N@H+]1CCO[C@@H]2CN(c3ncnc4cc(Cl)c(Cl)cc43)CC[C@H]2C1 ZINC001164854374 720867031 /nfs/dbraw/zinc/86/70/31/720867031.db2.gz JOYJTNRHQSMSKW-SCLBCKFNSA-N 1 1 411.333 3.110 20 0 HGADMO COCC[N@H+]1CCO[C@H]2CN(c3cc(-c4ccc(Cl)nn4)ccc3F)CC[C@H]2C1 ZINC001164859951 720881519 /nfs/dbraw/zinc/88/15/19/720881519.db2.gz NKKCNBDPBXPBAU-JXFKEZNVSA-N 1 1 420.916 3.110 20 0 HGADMO CCOc1cnc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COCc2cccnc2)nc1 ZINC001164751589 720882022 /nfs/dbraw/zinc/88/20/22/720882022.db2.gz CNWQRHGLRXAQGY-ZJSXRUAMSA-N 1 1 423.561 3.025 20 0 HGADMO Cc1cnc(C)nc1N1CC[C@@]2(C1)C[N@@H+](CC1CC1)C[C@@H]2COCc1cccnc1 ZINC001164755354 720884305 /nfs/dbraw/zinc/88/43/05/720884305.db2.gz LFTOLMLZCCYTPM-VWNXMTODSA-N 1 1 407.562 3.244 20 0 HGADMO COCC[N@H+]1CCO[C@H]2CN(C(F)(F)Sc3ccc(Cl)nc3)CC[C@H]2C1 ZINC001164860012 720890331 /nfs/dbraw/zinc/89/03/31/720890331.db2.gz NVAZILHLZPEFSU-ZFWWWQNUSA-N 1 1 407.914 3.047 20 0 HGADMO Cc1cnc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COCc2cccnc2)c(N)c1 ZINC001164756244 720900618 /nfs/dbraw/zinc/90/06/18/720900618.db2.gz OQXLCIBVDRHFDC-URXFXBBRSA-N 1 1 407.562 3.122 20 0 HGADMO Cc1cc(NC(=O)c2cccnc2N2CCn3c(C[N@H+](C)C(C)C)cnc3[C@H]2C)no1 ZINC001164858902 721000276 /nfs/dbraw/zinc/00/02/76/721000276.db2.gz JDAKBWFTIVMYPX-MRXNPFEDSA-N 1 1 423.521 3.248 20 0 HGADMO CC(C)[N@@H+](C)Cc1cnc2n1CCN(c1ncc(C(=O)N(C)C)cc1Cl)[C@H]2C ZINC001164858022 721006049 /nfs/dbraw/zinc/00/60/49/721006049.db2.gz GHYLTHDZHYALPF-AWEZNQCLSA-N 1 1 404.946 3.055 20 0 HGADMO C[N@@H+](Cc1ccc(N2CCC[C@@]3(C[C@@H](OCc4ccccn4)CO3)C2)nc1)C1CC1 ZINC001164765362 721030902 /nfs/dbraw/zinc/03/09/02/721030902.db2.gz OVGNMPLFJBDSBM-ISKFKSNPSA-N 1 1 408.546 3.416 20 0 HGADMO FC(F)(c1cnc(Cl)cc1Cl)N1CCc2[nH+]cc(Cn3cccn3)n2CC1 ZINC001164862617 721031344 /nfs/dbraw/zinc/03/13/44/721031344.db2.gz MVUZSNUXGYMSTB-UHFFFAOYSA-N 1 1 413.259 3.437 20 0 HGADMO FC(F)(c1ccc(Cl)c(Cl)n1)N1CCc2[nH+]cc(Cn3cccn3)n2CC1 ZINC001164862036 721032180 /nfs/dbraw/zinc/03/21/80/721032180.db2.gz KLHYVQAFKVNPPA-UHFFFAOYSA-N 1 1 413.259 3.437 20 0 HGADMO Fc1ccc(-c2ccnc(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@H]4C3)n2)cc1 ZINC001164864388 721081946 /nfs/dbraw/zinc/08/19/46/721081946.db2.gz FRKQEFAOIWQTQP-SFTDATJTSA-N 1 1 405.477 3.157 20 0 HGADMO FC(F)(COc1ccnc(Cl)c1)N1CC[N@H+]2C[C@H](OCc3cccnc3)C[C@H]2C1 ZINC001164863407 721083966 /nfs/dbraw/zinc/08/39/66/721083966.db2.gz CGCDYNSVKZDEGB-FUHWJXTLSA-N 1 1 424.879 3.077 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4nc5cc(F)c(F)cc5nc4Cl)C[C@H]3C2)cn1 ZINC001164769023 721114630 /nfs/dbraw/zinc/11/46/30/721114630.db2.gz OUCFRDLULAWAEN-ZIAGYGMSSA-N 1 1 418.879 3.253 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4nc(Cl)nc5c4CCCCC5)C[C@@H]3C2)cn1 ZINC001164773261 721122577 /nfs/dbraw/zinc/12/25/77/721122577.db2.gz XOASRQFQZMHGJK-SJORKVTESA-N 1 1 400.958 3.091 20 0 HGADMO Fc1cccc(Oc2ccnc(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@H]4C3)n2)c1 ZINC001164880704 721125417 /nfs/dbraw/zinc/12/54/17/721125417.db2.gz XDODDAXTJKZJNT-PZJWPPBQSA-N 1 1 421.476 3.283 20 0 HGADMO Fc1cc2ncnc(Cl)c2c(N2CC[N@H+]3C[C@@H](OCc4cccnc4)C[C@@H]3C2)c1 ZINC001164879574 721128840 /nfs/dbraw/zinc/12/88/40/721128840.db2.gz UAVVYXYQOFXPSG-SJORKVTESA-N 1 1 413.884 3.297 20 0 HGADMO Cc1nc2sc3c(c2c(N2CC[N@H+]4C[C@H](OCc5cccnc5)C[C@H]4C2)n1)CCC3 ZINC001164874570 721140159 /nfs/dbraw/zinc/14/01/59/721140159.db2.gz KRRGRCFRGKRRHB-ZWKOTPCHSA-N 1 1 421.570 3.363 20 0 HGADMO COc1ccccc1-c1ccnc(N2CC[N@H+]3C[C@@H](OCc4cccnc4)C[C@@H]3C2)n1 ZINC001164881078 721155289 /nfs/dbraw/zinc/15/52/89/721155289.db2.gz YXFYNYPYFZPIMK-UXHICEINSA-N 1 1 417.513 3.027 20 0 HGADMO Fc1cccc(-c2ccc(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@@H]4C3)nn2)c1 ZINC001164880687 721162789 /nfs/dbraw/zinc/16/27/89/721162789.db2.gz XCPPNVZLFFQOBP-NHCUHLMSSA-N 1 1 405.477 3.157 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4ccc(-c5ccccc5Cl)nn4)C[C@@H]3C2)cn1 ZINC001164768524 721164629 /nfs/dbraw/zinc/16/46/29/721164629.db2.gz LHGRLKZCVHNGDI-MSOLQXFVSA-N 1 1 408.937 3.489 20 0 HGADMO CSc1ccc2ncnc(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@@H]4C3)c2c1 ZINC001164878638 721180012 /nfs/dbraw/zinc/18/00/12/721180012.db2.gz QTWPWRHSLOSFGB-QZTJIDSGSA-N 1 1 407.543 3.226 20 0 HGADMO COc1cc2nc(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@H]4C3)ccc2c(OC)c1 ZINC001164872696 721180023 /nfs/dbraw/zinc/18/00/23/721180023.db2.gz IEIORFVVCCCCLH-ICSRJNTNSA-N 1 1 420.513 3.127 20 0 HGADMO COc1cc2ccnc(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@@H]4C3)c2cc1F ZINC001164877584 721184332 /nfs/dbraw/zinc/18/43/32/721184332.db2.gz OUCKOVXRWJXJDC-RTBURBONSA-N 1 1 408.477 3.257 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4ncnc5[nH]c6ccc(Cl)cc6c54)C[C@@H]3C2)cn1 ZINC001164765062 721185734 /nfs/dbraw/zinc/18/57/34/721185734.db2.gz HOKTZBCPNXGBLK-HOTGVXAUSA-N 1 1 421.936 3.456 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4ncnc5[nH]c6ccc(Cl)cc6c54)C[C@H]3C2)cn1 ZINC001164765068 721185776 /nfs/dbraw/zinc/18/57/76/721185776.db2.gz HOKTZBCPNXGBLK-JKSUJKDBSA-N 1 1 421.936 3.456 20 0 HGADMO CC(C)n1ccc2c1nc(Cl)nc2N1C[C@@H]2CC[N@@H+](Cc3cnn(C)c3)C[C@@H]2C1 ZINC001164771438 721186337 /nfs/dbraw/zinc/18/63/37/721186337.db2.gz PVBLRPXTMJMCMD-DLBZAZTESA-N 1 1 413.957 3.357 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4nc(Cl)nc5c(Cl)nccc54)C[C@@H]3C2)cn1 ZINC001164762038 721189755 /nfs/dbraw/zinc/18/97/55/721189755.db2.gz CCTAQZYGCRCHOB-KBPBESRZSA-N 1 1 418.332 3.023 20 0 HGADMO Cc1cc(OCc2ccccc2)nc(N2C[C@H]3CC[N@H+](Cc4cnn(C)c4)C[C@@H]3C2)n1 ZINC001164767246 721230998 /nfs/dbraw/zinc/23/09/98/721230998.db2.gz WMDITDSAIXENFQ-FGZHOGPDSA-N 1 1 418.545 3.056 20 0 HGADMO Cc1c(Cl)nc(C2CCC2)nc1N1C[C@@H]2C[N@@H+](Cc3cnn(C)c3)CC[C@@H]2C1 ZINC001164767139 721237921 /nfs/dbraw/zinc/23/79/21/721237921.db2.gz VXDQUJOXNAIMLH-MSOLQXFVSA-N 1 1 400.958 3.398 20 0 HGADMO Cc1c(Cl)nc(C2CCC2)nc1N1C[C@@H]2CC[N@H+](Cc3cnn(C)c3)C[C@@H]2C1 ZINC001164767145 721238777 /nfs/dbraw/zinc/23/87/77/721238777.db2.gz VXDQUJOXNAIMLH-ZWKOTPCHSA-N 1 1 400.958 3.398 20 0 HGADMO CC(C)(c1ccnc(Cl)c1)[N@@H+]1C[C@@H]2CN(S(=O)(=O)c3ccccc3)C[C@@H]2C1 ZINC001164876902 721310297 /nfs/dbraw/zinc/31/02/97/721310297.db2.gz GZHMIKLHOKFRFX-IYBDPMFKSA-N 1 1 405.951 3.223 20 0 HGADMO CC(C)(c1ccnc(Cl)c1)[N@H+]1C[C@@H]2CN(S(=O)(=O)c3ccccc3)C[C@@H]2C1 ZINC001164876902 721310298 /nfs/dbraw/zinc/31/02/98/721310298.db2.gz GZHMIKLHOKFRFX-IYBDPMFKSA-N 1 1 405.951 3.223 20 0 HGADMO C[NH+]1CCC(Oc2ccnc(N3CCO[C@@H]4C[C@H](COc5ccccn5)C[C@@H]43)c2)CC1 ZINC001164880059 721314710 /nfs/dbraw/zinc/31/47/10/721314710.db2.gz PAJRMBSLQPYMBF-BVYCBKJFSA-N 1 1 424.545 3.012 20 0 HGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@]2(CCCN(c3ncc4ccccc4n3)C2)C1 ZINC001164778661 721330981 /nfs/dbraw/zinc/33/09/81/721330981.db2.gz XZGSADIANLQSOC-HSZRJFAPSA-N 1 1 407.518 3.354 20 0 HGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@]2(CCCN(c3ncc4ccccc4n3)C2)C1 ZINC001164778661 721330984 /nfs/dbraw/zinc/33/09/84/721330984.db2.gz XZGSADIANLQSOC-HSZRJFAPSA-N 1 1 407.518 3.354 20 0 HGADMO CCc1ncnc(Cl)c1N1CCC[C@]2(C1)COCC[N@H+](Cc1c(C)noc1C)C2 ZINC001164775780 721337147 /nfs/dbraw/zinc/33/71/47/721337147.db2.gz ADYHPWSZDGXPCR-NRFANRHFSA-N 1 1 419.957 3.416 20 0 HGADMO CCc1ncnc(Cl)c1N1CCC[C@]2(C1)COCC[N@@H+](Cc1c(C)noc1C)C2 ZINC001164775780 721337155 /nfs/dbraw/zinc/33/71/55/721337155.db2.gz ADYHPWSZDGXPCR-NRFANRHFSA-N 1 1 419.957 3.416 20 0 HGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@]2(CCCN(c3cc(Cl)nnc3C)C2)C1 ZINC001164777288 721340697 /nfs/dbraw/zinc/34/06/97/721340697.db2.gz FLCAJZHMWGLZEC-HXUWFJFHSA-N 1 1 405.930 3.162 20 0 HGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@]2(CCCN(c3cc(Cl)nnc3C)C2)C1 ZINC001164777288 721340701 /nfs/dbraw/zinc/34/07/01/721340701.db2.gz FLCAJZHMWGLZEC-HXUWFJFHSA-N 1 1 405.930 3.162 20 0 HGADMO COc1cc(Cl)ncc1N1CCC[C@]2(C1)COCC[N@@H+](Cc1c(C)noc1C)C2 ZINC001164777836 721344446 /nfs/dbraw/zinc/34/44/46/721344446.db2.gz IPNCBWDQGMITRN-NRFANRHFSA-N 1 1 420.941 3.467 20 0 HGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@@]2(CCCN(c3cc(C(C)(C)C)ncn3)C2)C1 ZINC001164787116 721366221 /nfs/dbraw/zinc/36/62/21/721366221.db2.gz ZGFZKQWYQUWCAP-QHCPKHFHSA-N 1 1 413.566 3.498 20 0 HGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@@]2(CCCN(c3cc(C(C)(C)C)ncn3)C2)C1 ZINC001164787116 721366222 /nfs/dbraw/zinc/36/62/22/721366222.db2.gz ZGFZKQWYQUWCAP-QHCPKHFHSA-N 1 1 413.566 3.498 20 0 HGADMO C[NH+]1CCN(C[C@@H]2CCC[C@]3(CCN(C(F)(F)c4ccc(Cl)nc4)C3)O2)CC1 ZINC001164894121 721377797 /nfs/dbraw/zinc/37/77/97/721377797.db2.gz XTEGBPQQDUMJDL-PKOBYXMFSA-N 1 1 414.928 3.045 20 0 HGADMO COc1ccc2nc(N3CC[C@]4(C3)CCC[C@@H](CN3CC[NH+](C)CC3)O4)c(C)cc2c1 ZINC001164887119 721380706 /nfs/dbraw/zinc/38/07/06/721380706.db2.gz HAKMCMFAEIVXEN-DHLKQENFSA-N 1 1 424.589 3.317 20 0 HGADMO C[NH+]1CCN(C[C@@H]2CCC[C@]3(CCN(c4ncnc5c(Cl)cccc54)C3)O2)CC1 ZINC001164884398 721393738 /nfs/dbraw/zinc/39/37/38/721393738.db2.gz APMPCVIWERWSOK-HTAPYJJXSA-N 1 1 415.969 3.049 20 0 HGADMO COc1ccc2nc(N3C[C@@H]4C[NH+](Cc5nccs5)C[C@H]4C3)c(Cl)nc2c1 ZINC001164784364 721405443 /nfs/dbraw/zinc/40/54/43/721405443.db2.gz JSXZEQCKOMQNEI-STQMWFEESA-N 1 1 401.923 3.317 20 0 HGADMO CCOC(=O)c1cc(Cl)nc(N2C[C@@H]3C[NH+](Cc4nccs4)C[C@H]3C2)c1C ZINC001164788259 721409250 /nfs/dbraw/zinc/40/92/50/721409250.db2.gz RQTRWNXCEQAEFG-KBPBESRZSA-N 1 1 406.939 3.245 20 0 HGADMO C[NH+]1CCN(C[C@@H]2CCC[C@@]3(CCN(c4ncc5cc(Cl)ccc5n4)C3)O2)CC1 ZINC001164887204 721416744 /nfs/dbraw/zinc/41/67/44/721416744.db2.gz LJQWWMRZAJWMEC-UGKGYDQZSA-N 1 1 415.969 3.049 20 0 HGADMO COc1cccc(Oc2cncc(N3C[C@H]4C[NH+](Cc5nccs5)C[C@@H]4C3)n2)c1 ZINC001164785002 721419631 /nfs/dbraw/zinc/41/96/31/721419631.db2.gz MCNPMXHHVBQLTI-HZPDHXFCSA-N 1 1 409.515 3.302 20 0 HGADMO FC(F)(c1nc2ccc(Cl)nc2[nH]1)N1C[C@@H]2C[NH+](Cc3nccs3)C[C@H]2C1 ZINC001164786604 721429049 /nfs/dbraw/zinc/42/90/49/721429049.db2.gz PAAVCKYLNLUQMS-QWRGUYRKSA-N 1 1 410.881 3.181 20 0 HGADMO c1csc(C[N@H+]2C[C@H]3CN(c4nc(-c5cccnc5)nc5c4CCC5)C[C@H]3C2)n1 ZINC001164785699 721432639 /nfs/dbraw/zinc/43/26/39/721432639.db2.gz OBMQAFOTJXRRFD-CALCHBBNSA-N 1 1 404.543 3.052 20 0 HGADMO c1csc(C[N@@H+]2C[C@H]3CN(c4nc(-c5cccnc5)nc5c4CCC5)C[C@H]3C2)n1 ZINC001164785699 721432642 /nfs/dbraw/zinc/43/26/42/721432642.db2.gz OBMQAFOTJXRRFD-CALCHBBNSA-N 1 1 404.543 3.052 20 0 HGADMO Cc1cccc(-c2ccc(N3CC[C@]4(C3)CCC[C@@H](CN3CC[NH+](C)CC3)O4)nn2)c1 ZINC001164898779 721434915 /nfs/dbraw/zinc/43/49/15/721434915.db2.gz WZIZBDBIDAOJSB-DHLKQENFSA-N 1 1 421.589 3.217 20 0 HGADMO CC(C)c1c(Cl)ncnc1N1CC[C@@]2(C1)CCC[C@@H](CN1CC[NH+](C)CC1)O2 ZINC001164892230 721446192 /nfs/dbraw/zinc/44/61/92/721446192.db2.gz HTVLTDHPWLMPNE-LAUBAEHRSA-N 1 1 407.990 3.019 20 0 HGADMO Cc1c(Cl)nc(C(C)C)nc1N1CC[C@@]2(C1)CCC[C@H](CN1CC[NH+](C)CC1)O2 ZINC001164895447 721446722 /nfs/dbraw/zinc/44/67/22/721446722.db2.gz PDQNQWWFSUPLBI-XMSQKQJNSA-N 1 1 422.017 3.327 20 0 HGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1cc(OC)cc(Cl)n1)CC2 ZINC001164785798 721458298 /nfs/dbraw/zinc/45/82/98/721458298.db2.gz NPOVVHRBPLODMG-GOSISDBHSA-N 1 1 423.985 3.478 20 0 HGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1ccc3cccnc3n1)CC2 ZINC001164784676 721458345 /nfs/dbraw/zinc/45/83/45/721458345.db2.gz JMDCGSUMTJWINJ-OAQYLSRUSA-N 1 1 410.562 3.364 20 0 HGADMO CCC[N@H+]1CCCC[C@@H]1c1ccc(N2CC[C@@H]3O[C@H](C(=O)NCC4CC4)C[C@@H]32)nc1 ZINC001164890845 721459304 /nfs/dbraw/zinc/45/93/04/721459304.db2.gz SSUGUAFZTLFYPH-MLNNCEHLSA-N 1 1 412.578 3.281 20 0 HGADMO CCCc1ccnc(N2CCC3(C[C@H](COCC4CC4)[N@@H+](CCOC)C3)CC2)n1 ZINC001164784495 721463499 /nfs/dbraw/zinc/46/34/99/721463499.db2.gz ILJGWKLEFAONOG-OAQYLSRUSA-N 1 1 402.583 3.163 20 0 HGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1cnc(Cl)cc1N)CC2 ZINC001164786909 721464511 /nfs/dbraw/zinc/46/45/11/721464511.db2.gz QMQFFWWSDQPBIZ-KRWDZBQOSA-N 1 1 408.974 3.051 20 0 HGADMO CC1(C)OCc2c1nc(Cl)nc2N1CC[N@H+]2C[C@H](Oc3cccc(F)c3)C[C@@H]2C1 ZINC001164901682 721524839 /nfs/dbraw/zinc/52/48/39/721524839.db2.gz XYJNBCYZAIHITI-GDBMZVCRSA-N 1 1 418.900 3.376 20 0 HGADMO Cc1c[nH]c2nc(Cl)nc(N3CC[N@H+]4C[C@@H](Oc5cccc(F)c5)C[C@H]4C3)c12 ZINC001164899054 721525267 /nfs/dbraw/zinc/52/52/67/721525267.db2.gz JUFHBKIZBBVVMG-HOCLYGCPSA-N 1 1 401.873 3.401 20 0 HGADMO Fc1cccc(O[C@H]2C[C@H]3CN(c4nc(Cl)nc5c4SCC5)CC[N@H+]3C2)c1 ZINC001164903957 721526583 /nfs/dbraw/zinc/52/65/83/721526583.db2.gz DLAYVFCHLRUCMD-ZFWWWQNUSA-N 1 1 406.914 3.259 20 0 HGADMO Cc1cc(Cl)nc(C(F)(F)N2C[C@H]([N@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@@H]32)n1 ZINC001164803651 721528914 /nfs/dbraw/zinc/52/89/14/721528914.db2.gz IMWOBSZQRCWLFC-XYJFISCASA-N 1 1 423.895 3.247 20 0 HGADMO Cc1cc(Cl)nc(C(F)(F)N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@@H]32)n1 ZINC001164803651 721528917 /nfs/dbraw/zinc/52/89/17/721528917.db2.gz IMWOBSZQRCWLFC-XYJFISCASA-N 1 1 423.895 3.247 20 0 HGADMO Fc1cccc(O[C@@H]2C[C@@H]3CN(c4nc(Cl)nc5ncsc54)CC[N@H+]3C2)c1 ZINC001164908615 721535726 /nfs/dbraw/zinc/53/57/26/721535726.db2.gz PUODREVGXFWMMC-TZMCWYRMSA-N 1 1 405.886 3.221 20 0 HGADMO CCOC(=O)c1cnc(N2CC[N@H+]3C[C@H](Oc4cccc(F)c4)C[C@@H]3C2)c(Cl)c1 ZINC001164907165 721536723 /nfs/dbraw/zinc/53/67/23/721536723.db2.gz MJHKSDGYAFPVNA-SJLPKXTDSA-N 1 1 419.884 3.393 20 0 HGADMO COC(=O)/C=C/c1cc(C)cnc1N1CC[N@H+]2C[C@H](Oc3cccc(F)c3)C[C@@H]2C1 ZINC001164906913 721547325 /nfs/dbraw/zinc/54/73/25/721547325.db2.gz LTMREJWRDKQNLU-WBWXQYNJSA-N 1 1 411.477 3.057 20 0 HGADMO Nc1cc(C(F)(F)N2CC[N@H+]3C[C@H](Oc4cccc(F)c4)C[C@@H]3C2)cnc1Cl ZINC001164911397 721550658 /nfs/dbraw/zinc/55/06/58/721550658.db2.gz WQVJDNVXPDLMSF-GDBMZVCRSA-N 1 1 412.843 3.343 20 0 HGADMO Cc1cc(C(F)(F)N2CC[N@H+]3C[C@@H](Oc4cccc(F)c4)C[C@H]3C2)c(Cl)nn1 ZINC001164911404 721555270 /nfs/dbraw/zinc/55/52/70/721555270.db2.gz ZBTCGYFJZZCFHE-HOCLYGCPSA-N 1 1 412.843 3.464 20 0 HGADMO CCOC(=O)c1c(C)cc(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@H]3OCCC[C@H]32)nc1C ZINC001164805406 721562373 /nfs/dbraw/zinc/56/23/73/721562373.db2.gz NRVPBORBNQNGEZ-QTEQDKRBSA-N 1 1 424.545 3.138 20 0 HGADMO CN(C)C(=O)[C@H]1CC12CCN(c1ccc3c(n1)CC[N@H+](Cc1ccccc1)C3)CC2 ZINC001164906609 721569303 /nfs/dbraw/zinc/56/93/03/721569303.db2.gz KGNFAPVUVCSEQX-OAQYLSRUSA-N 1 1 404.558 3.335 20 0 HGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2ncnc3sc4c(c32)CCC4)[C@@H]2CCCO[C@H]12 ZINC001164798571 721575943 /nfs/dbraw/zinc/57/59/43/721575943.db2.gz BLMZCXOITRYDOC-OPYAIIAOSA-N 1 1 421.570 3.443 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2ncnc3sc4c(c32)CCC4)[C@@H]2CCCO[C@H]12 ZINC001164798571 721575947 /nfs/dbraw/zinc/57/59/47/721575947.db2.gz BLMZCXOITRYDOC-OPYAIIAOSA-N 1 1 421.570 3.443 20 0 HGADMO CCOC(=O)c1ccnc(N2CCC(F)(F)[C@@]3(CC[N@@H+](Cc4ccccn4)C3)C2)c1 ZINC001164906523 721585381 /nfs/dbraw/zinc/58/53/81/721585381.db2.gz NIBHLMQQKAGEKD-OAQYLSRUSA-N 1 1 416.472 3.391 20 0 HGADMO COc1cnc(SC)nc1N1CCC(F)(F)[C@@]2(CC[N@@H+](Cc3ccccn3)C2)C1 ZINC001164908496 721586203 /nfs/dbraw/zinc/58/62/03/721586203.db2.gz ZNCNPGXNMGCCOL-LJQANCHMSA-N 1 1 421.517 3.340 20 0 HGADMO COC(=O)c1ccc(C)nc1N1CCC(F)(F)[C@]2(CC[N@@H+](Cc3ccccn3)C2)C1 ZINC001164908413 721587170 /nfs/dbraw/zinc/58/71/70/721587170.db2.gz ZAGGPWDJXIPNRN-NRFANRHFSA-N 1 1 416.472 3.309 20 0 HGADMO COc1cc(N2CCC(F)(F)[C@]3(CC[N@@H+](Cc4ccccn4)C3)C2)nc(SC)n1 ZINC001164905583 721704214 /nfs/dbraw/zinc/70/42/14/721704214.db2.gz HUKQZNPGIVJSIY-IBGZPJMESA-N 1 1 421.517 3.340 20 0 HGADMO FC1(F)CCN(c2cncc(N3CCCC3)n2)C[C@]12CC[N@@H+](Cc1ccccn1)C2 ZINC001164907323 721715441 /nfs/dbraw/zinc/71/54/41/721715441.db2.gz QXPQPWQKMTYEGV-OAQYLSRUSA-N 1 1 414.504 3.210 20 0 HGADMO FC1(F)CCN(c2cncc(N3CCCC3)n2)C[C@@]12CC[N@@H+](Cc1ccccn1)C2 ZINC001164907322 721716521 /nfs/dbraw/zinc/71/65/21/721716521.db2.gz QXPQPWQKMTYEGV-NRFANRHFSA-N 1 1 414.504 3.210 20 0 HGADMO CC[N@H+]1CCCC[C@H]1c1ccc(N2CCCn3c(CN(C)C(C)C)nnc3C2)nc1 ZINC001165010349 721720158 /nfs/dbraw/zinc/72/01/58/721720158.db2.gz GKYUWWCPOUFKEB-FQEVSTJZSA-N 1 1 411.598 3.471 20 0 HGADMO CC(C)C(=O)N1CCC[C@]12CCN(c1ncnc3c1CC[N@H+](Cc1ccccc1)C3)C2 ZINC001165007393 721725102 /nfs/dbraw/zinc/72/51/02/721725102.db2.gz CJZZWRBKQIAKGO-RUZDIDTESA-N 1 1 419.573 3.262 20 0 HGADMO CC(C)C(=O)N1CCC[C@]12CCN(c1ncnc3c1CC[N@@H+](Cc1ccccc1)C3)C2 ZINC001165007393 721725107 /nfs/dbraw/zinc/72/51/07/721725107.db2.gz CJZZWRBKQIAKGO-RUZDIDTESA-N 1 1 419.573 3.262 20 0 HGADMO C[N@H+](Cc1ccco1)Cc1cncc2c1CCN(c1nc(Cl)nc3nc[nH]c31)C2 ZINC001164907961 721744519 /nfs/dbraw/zinc/74/45/19/721744519.db2.gz FAUKEIMSPOAHHG-UHFFFAOYSA-N 1 1 409.881 3.189 20 0 HGADMO C[N@@H+](Cc1ccco1)Cc1cncc2c1CCN(c1nc(Cl)nc3nc[nH]c31)C2 ZINC001164907961 721744521 /nfs/dbraw/zinc/74/45/21/721744521.db2.gz FAUKEIMSPOAHHG-UHFFFAOYSA-N 1 1 409.881 3.189 20 0 HGADMO COC(=O)c1cc(C)nc(N2CCc3c(C[N@H+](C)Cc4ccco4)cncc3C2)c1 ZINC001164909427 721745665 /nfs/dbraw/zinc/74/56/65/721745665.db2.gz SNVPVHMFCRITHH-UHFFFAOYSA-N 1 1 406.486 3.359 20 0 HGADMO COC(=O)c1cc(C)nc(N2CCc3c(C[N@@H+](C)Cc4ccco4)cncc3C2)c1 ZINC001164909427 721745666 /nfs/dbraw/zinc/74/56/66/721745666.db2.gz SNVPVHMFCRITHH-UHFFFAOYSA-N 1 1 406.486 3.359 20 0 HGADMO C[N@H+](Cc1ccco1)Cc1cncc2c1CCN([C@@H](F)Oc1cncc(Cl)n1)C2 ZINC001164910481 721764749 /nfs/dbraw/zinc/76/47/49/721764749.db2.gz GKCHNGCWKPZXGK-HXUWFJFHSA-N 1 1 417.872 3.440 20 0 HGADMO C[N@@H+](Cc1ccco1)Cc1cncc2c1CCN([C@@H](F)Oc1cncc(Cl)n1)C2 ZINC001164910481 721764751 /nfs/dbraw/zinc/76/47/51/721764751.db2.gz GKCHNGCWKPZXGK-HXUWFJFHSA-N 1 1 417.872 3.440 20 0 HGADMO C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@H]2CN(c3ccc(CN4CCOCC4)cn3)C[C@@H]21 ZINC001165017742 721801866 /nfs/dbraw/zinc/80/18/66/721801866.db2.gz AINWXMRYDYSLKV-OEMFJLHTSA-N 1 1 421.589 3.046 20 0 HGADMO COC(=O)c1cnc(N2C[C@@H]3CCC[C@@H]([N@@H+](C)Cc4ccccn4)[C@@H]3C2)cc1OC ZINC001165023950 721803624 /nfs/dbraw/zinc/80/36/24/721803624.db2.gz KJSZWJQYTCNXMD-PWIZWCRZSA-N 1 1 410.518 3.009 20 0 HGADMO COC(=O)c1cc(OC)cnc1N1C[C@@H]2CCC[C@H]([N@@H+](C)Cc3ccccn3)[C@@H]2C1 ZINC001165024045 721807164 /nfs/dbraw/zinc/80/71/64/721807164.db2.gz KVVSHVDYPNKTGG-DQLDELGASA-N 1 1 410.518 3.009 20 0 HGADMO COC(=O)c1cc(F)c(C)nc1N1C[C@@H]2CCC[C@@H]([N@@H+](C)Cc3ccccn3)[C@@H]2C1 ZINC001165023582 721812241 /nfs/dbraw/zinc/81/22/41/721812241.db2.gz HYLJCIMQTFGXQR-LDQXTDLNSA-N 1 1 412.509 3.448 20 0 HGADMO Cn1c(=O)ccc2ccc(N3C[C@@H]4CCC[C@@H]([N@@H+](C)Cc5ccccn5)[C@@H]4C3)nc21 ZINC001165021619 721813218 /nfs/dbraw/zinc/81/32/18/721813218.db2.gz FHKIIPGWRASELY-CEWLAPEOSA-N 1 1 403.530 3.065 20 0 HGADMO C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@H]2CN(c3ccc(C(=O)NC4CC4)cn3)C[C@H]21 ZINC001165027406 721814438 /nfs/dbraw/zinc/81/44/38/721814438.db2.gz URGGWCZXMYSATC-VLCRHTCISA-N 1 1 405.546 3.106 20 0 HGADMO C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@H]2CN(c3nc(C(N)=O)cc4ccccc43)C[C@H]21 ZINC001165030548 721825794 /nfs/dbraw/zinc/82/57/94/721825794.db2.gz ZSKMLURMGQOBJV-QTGUNEKASA-N 1 1 415.541 3.466 20 0 HGADMO CN(C)CC[N@H+]1CC[C@H]2[C@H]1CCN2c1nc(-c2ccccc2)nc(-c2ccccc2)n1 ZINC001164924079 721861437 /nfs/dbraw/zinc/86/14/37/721861437.db2.gz BSHYMQJXEVDRHB-YADHBBJMSA-N 1 1 414.557 3.420 20 0 HGADMO C[NH+](C)CCN1CC[C@H]2[C@H]1CCN2c1nc(-c2ccccc2)nc(-c2ccccc2)n1 ZINC001164924079 721861438 /nfs/dbraw/zinc/86/14/38/721861438.db2.gz BSHYMQJXEVDRHB-YADHBBJMSA-N 1 1 414.557 3.420 20 0 HGADMO CN(C)CC[N@H+]1CC[C@H]2[C@H]1CCN2c1nnc(Cc2ccccc2)c2ccccc21 ZINC001164929403 721877021 /nfs/dbraw/zinc/87/70/21/721877021.db2.gz BGASTMWZDYQDSI-RPWUZVMVSA-N 1 1 401.558 3.435 20 0 HGADMO C[NH+](C)CCN1CC[C@H]2[C@H]1CCN2c1nnc(Cc2ccccc2)c2ccccc21 ZINC001164929403 721877022 /nfs/dbraw/zinc/87/70/22/721877022.db2.gz BGASTMWZDYQDSI-RPWUZVMVSA-N 1 1 401.558 3.435 20 0 HGADMO C[C@@H]1CCCCN1c1nc2ccccc2nc1N1CC[C@@H]2[C@@H]1CC[N@@H+]2CCN(C)C ZINC001164936283 721878569 /nfs/dbraw/zinc/87/85/69/721878569.db2.gz ZDPGHOKKDAQHLU-QIJUGHKUSA-N 1 1 408.594 3.223 20 0 HGADMO C[C@@H]1CCCCN1c1nc2ccccc2nc1N1CC[C@@H]2[C@@H]1CC[N@H+]2CCN(C)C ZINC001164936283 721878570 /nfs/dbraw/zinc/87/85/70/721878570.db2.gz ZDPGHOKKDAQHLU-QIJUGHKUSA-N 1 1 408.594 3.223 20 0 HGADMO Cc1c(C)n(Cc2ccccc2)c2ncnc(N3CC[C@@H]4[C@H]3CC[N@@H+]4CCN(C)C)c12 ZINC001164931501 721879147 /nfs/dbraw/zinc/87/91/47/721879147.db2.gz FZQSEFTZNABTRU-FGZHOGPDSA-N 1 1 418.589 3.311 20 0 HGADMO Cc1c(C)n(Cc2ccccc2)c2ncnc(N3CC[C@@H]4[C@H]3CCN4CC[NH+](C)C)c12 ZINC001164931501 721879148 /nfs/dbraw/zinc/87/91/48/721879148.db2.gz FZQSEFTZNABTRU-FGZHOGPDSA-N 1 1 418.589 3.311 20 0 HGADMO Cc1sc2nc(C[NH+]3CCCCC3)nc(N3CC[C@H]4[C@@H]3CCC(=O)N4C)c2c1C ZINC001164930046 721893455 /nfs/dbraw/zinc/89/34/55/721893455.db2.gz BHINBPYVTBNCRP-IRXDYDNUSA-N 1 1 413.591 3.494 20 0 HGADMO COC(=O)c1cc(C)cc(N2CCC3(CC2)C[N@@H+](Cc2ccc(C)cc2)CCO3)n1 ZINC001164939168 721928306 /nfs/dbraw/zinc/92/83/06/721928306.db2.gz JTJAJMIMYXKFKT-UHFFFAOYSA-N 1 1 409.530 3.356 20 0 HGADMO O=C1NCC[N@@H+](Cc2ccccc2)C12CCN(c1nc(Cl)cc3[nH]ccc31)CC2 ZINC001164946730 721971407 /nfs/dbraw/zinc/97/14/07/721971407.db2.gz VPESHXDHMVKDKI-UHFFFAOYSA-N 1 1 409.921 3.187 20 0 HGADMO O=C1NCC[N@H+](Cc2ccccc2)C12CCN(c1nc(Cl)cc3[nH]ccc31)CC2 ZINC001164946730 721971410 /nfs/dbraw/zinc/97/14/10/721971410.db2.gz VPESHXDHMVKDKI-UHFFFAOYSA-N 1 1 409.921 3.187 20 0 HGADMO COC(=O)CCN(Cc1ccco1)c1ncnc2c1CC[N@H+](Cc1ccccc1)C2 ZINC001165050511 721982079 /nfs/dbraw/zinc/98/20/79/721982079.db2.gz UHRLIPHNRKAJOP-UHFFFAOYSA-N 1 1 406.486 3.198 20 0 HGADMO COC(=O)CCN(Cc1ccco1)c1ncnc2c1CC[N@@H+](Cc1ccccc1)C2 ZINC001165050511 721982083 /nfs/dbraw/zinc/98/20/83/721982083.db2.gz UHRLIPHNRKAJOP-UHFFFAOYSA-N 1 1 406.486 3.198 20 0 HGADMO CCOC(=O)c1cnc(-c2cccs2)nc1N1CC[NH+](CCc2ccccn2)CC1 ZINC001165053424 722011568 /nfs/dbraw/zinc/01/15/68/722011568.db2.gz FRYMBUYDFXCOTD-UHFFFAOYSA-N 1 1 423.542 3.142 20 0 HGADMO COC(=O)c1cc2ccncc2nc1N1CCC2(CC[N@@H+](Cc3cccnc3)C2)CC1 ZINC001164952963 722018528 /nfs/dbraw/zinc/01/85/28/722018528.db2.gz PWLLEJSRXOJOES-UHFFFAOYSA-N 1 1 417.513 3.304 20 0 HGADMO O=C(c1ccnc(N2CCC3(CC[N@@H+](Cc4cccnc4)C3)CC2)c1)N1CCCC1 ZINC001164955461 722020175 /nfs/dbraw/zinc/02/01/75/722020175.db2.gz HQIUYIXVFPMHJR-UHFFFAOYSA-N 1 1 405.546 3.205 20 0 HGADMO Clc1nc2ncccc2c(N2CCC3(CC2)COCC[N@@H+](Cc2ccncc2)C3)n1 ZINC001164961947 722053665 /nfs/dbraw/zinc/05/36/65/722053665.db2.gz ZPQNIQGZCLMRQA-UHFFFAOYSA-N 1 1 424.936 3.192 20 0 HGADMO CCOC(=O)c1cnc(N2CCC3(CC2)COCC[N@@H+](Cc2ccncc2)C3)c(C)c1 ZINC001164962264 722054497 /nfs/dbraw/zinc/05/44/97/722054497.db2.gz CCYIWLICADGEKY-UHFFFAOYSA-N 1 1 424.545 3.081 20 0 HGADMO Cc1nc(C)c(N2CCC3(CC2)COCC[N@@H+](Cc2ccncc2)C3)c(Cl)n1 ZINC001164964327 722055105 /nfs/dbraw/zinc/05/51/05/722055105.db2.gz UYZVSJFDDCSAPB-UHFFFAOYSA-N 1 1 401.942 3.261 20 0 HGADMO F[C@H](Oc1cccc(Cl)n1)N1CCC2(CC1)COCC[N@@H+](Cc1ccncc1)C2 ZINC001164962481 722055990 /nfs/dbraw/zinc/05/59/90/722055990.db2.gz DVPYBTRSZWNKRI-FQEVSTJZSA-N 1 1 420.916 3.377 20 0 HGADMO Cc1nc(Cl)c(N2CCC3(CC2)COCC[N@@H+](Cc2ccncc2)C3)nc1C ZINC001164962232 722056078 /nfs/dbraw/zinc/05/60/78/722056078.db2.gz BWZMOSSGOLLHGS-UHFFFAOYSA-N 1 1 401.942 3.261 20 0 HGADMO FC(F)(Oc1ccc2c(Cl)ncnc2c1)N1C[C@@H]2C[N@@H+](CC3CC3)C[C@H](C1)O2 ZINC001164966988 722074222 /nfs/dbraw/zinc/07/42/22/722074222.db2.gz IKJNAOYLBCKFSI-GASCZTMLSA-N 1 1 410.852 3.007 20 0 HGADMO FC(F)(Oc1ccc2c(Cl)ncnc2c1)N1C[C@@H]2C[N@H+](CC3CC3)C[C@H](C1)O2 ZINC001164966988 722074223 /nfs/dbraw/zinc/07/42/23/722074223.db2.gz IKJNAOYLBCKFSI-GASCZTMLSA-N 1 1 410.852 3.007 20 0 HGADMO C[NH+]1CCC(Oc2ccnc(N3CCc4onc(COc5ccccn5)c4C3)c2)CC1 ZINC001164969168 722083135 /nfs/dbraw/zinc/08/31/35/722083135.db2.gz KTSAAEXTBZQFKT-UHFFFAOYSA-N 1 1 421.501 3.079 20 0 HGADMO CCC[N@H+]1CCCC[C@@H]1c1ccc(N2CCO[C@]3(CCCN(C(C)=O)C3)C2)nc1 ZINC001164969093 722084198 /nfs/dbraw/zinc/08/41/98/722084198.db2.gz JVEZIXNXELHDBM-GGAORHGYSA-N 1 1 400.567 3.236 20 0 HGADMO Cc1nc2ccc(F)cc2c(N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)n1 ZINC001164984387 722108014 /nfs/dbraw/zinc/10/80/14/722108014.db2.gz TWXHELHCSBGPOQ-AVRDEDQJSA-N 1 1 407.493 3.200 20 0 HGADMO FC(F)(Oc1ccc(Cl)nc1)N1CC[C@@H]2C[N@@H+](Cc3cccnc3)CCO[C@H]2C1 ZINC001164978301 722108847 /nfs/dbraw/zinc/10/88/47/722108847.db2.gz OKKUUVULGLIBMY-AEFFLSMTSA-N 1 1 424.879 3.282 20 0 HGADMO COc1ccc2nc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)ccc2c1 ZINC001164971935 722109571 /nfs/dbraw/zinc/10/95/71/722109571.db2.gz DUHCXFKFPVORPT-NZQKXSOJSA-N 1 1 404.514 3.366 20 0 HGADMO Clc1ccnc2cc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)ncc12 ZINC001164971856 722113475 /nfs/dbraw/zinc/11/34/75/722113475.db2.gz CRRZQASFVTUBEB-UTKZUKDTSA-N 1 1 409.921 3.406 20 0 HGADMO CCOc1cc(Cl)nc(N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)c1 ZINC001164981526 722114676 /nfs/dbraw/zinc/11/46/76/722114676.db2.gz ULVPKFUMFIWVRM-IEBWSBKVSA-N 1 1 402.926 3.256 20 0 HGADMO Clc1ccc2c(cnnc2N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)c1 ZINC001164981166 722121745 /nfs/dbraw/zinc/12/17/45/722121745.db2.gz TZMGALLBHGFTCJ-UTKZUKDTSA-N 1 1 409.921 3.406 20 0 HGADMO Clc1cccc2nc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)ncc12 ZINC001164975107 722123130 /nfs/dbraw/zinc/12/31/30/722123130.db2.gz JLCPAMYMXYSYAU-LAUBAEHRSA-N 1 1 409.921 3.406 20 0 HGADMO CCOc1ccc(Cl)nc1N1CC[C@@H]2C[N@@H+](Cc3cccnc3)CCO[C@H]2C1 ZINC001164981170 722125136 /nfs/dbraw/zinc/12/51/36/722125136.db2.gz UADDAZHNWPJOSI-MJGOQNOKSA-N 1 1 402.926 3.256 20 0 HGADMO Cc1ccc(-c2ccc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)nn2)o1 ZINC001164974402 722147834 /nfs/dbraw/zinc/14/78/34/722147834.db2.gz DRMFDXAFNSDCAI-UGKGYDQZSA-N 1 1 405.502 3.167 20 0 HGADMO Fc1ccccc1-c1ccc(N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)nn1 ZINC001164977039 722148182 /nfs/dbraw/zinc/14/81/82/722148182.db2.gz IAVBYYPFEVVSOE-AUSIDOKSSA-N 1 1 419.504 3.405 20 0 HGADMO CC(C)c1c(Cl)ncnc1N1CC[C@@H]2C[N@@H+](Cc3cccnc3)CCO[C@H]2C1 ZINC001164973350 722153275 /nfs/dbraw/zinc/15/32/75/722153275.db2.gz LXYYDISJJXIYRI-MSOLQXFVSA-N 1 1 401.942 3.376 20 0 HGADMO Fc1ccc(-c2cncc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)n2)cc1 ZINC001164971139 722153958 /nfs/dbraw/zinc/15/39/58/722153958.db2.gz AUDYYFGZWJBRDS-NZQKXSOJSA-N 1 1 419.504 3.405 20 0 HGADMO Cc1nc(CN2CCO[C@@H]3CCN(c4[nH+]cnc5[nH]c(C)c(C)c54)CC[C@@H]32)cs1 ZINC001164985920 722182363 /nfs/dbraw/zinc/18/23/63/722182363.db2.gz CFHWYULYKXUJLL-ZWKOTPCHSA-N 1 1 412.563 3.209 20 0 HGADMO CC(C)c1nc(N2CCc3ncnc(N4CC[NH+](C)CC4)c3CC2)cc(C(C)(C)C)n1 ZINC001165002758 722238616 /nfs/dbraw/zinc/23/86/16/722238616.db2.gz YJGBRLXFWAEMSH-UHFFFAOYSA-N 1 1 423.609 3.045 20 0 HGADMO Cc1ccc(C[C@@H](CO)[NH2+]Cc2c(Cl)cccc2N2CCN(C)CC2)cc1C ZINC001461549520 1126195228 /nfs/dbraw/zinc/19/52/28/1126195228.db2.gz LKYBBHNEIBWTLS-FQEVSTJZSA-N 1 1 401.982 3.402 20 0 HGADMO COC(=O)c1cc(C[N@H+]2CCC[C@@H](c3nn(-c4ccccc4)cc3C(N)=O)C2)c[nH]1 ZINC000328602559 569416615 /nfs/dbraw/zinc/41/66/15/569416615.db2.gz CBRPZDKLZPJPDH-MRXNPFEDSA-N 1 1 407.474 3.250 20 0 HGADMO c1cnc(-c2noc([C@@]34CCC[C@@H]3C[N@H+](Cc3ccc(N5CCCC5)nc3)C4)n2)cn1 ZINC000328604101 569417249 /nfs/dbraw/zinc/41/72/49/569417249.db2.gz INNKFEYNUNGNRB-WZONZLPQSA-N 1 1 417.517 3.076 20 0 HGADMO CCOC(=O)Cc1c(Cl)ncnc1N1CCC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]21 ZINC001164623601 719079936 /nfs/dbraw/zinc/07/99/36/719079936.db2.gz JWPLDNVHRDBNBA-IEBWSBKVSA-N 1 1 414.937 3.336 20 0 HGADMO O=c1ccccn1Cc1ccc(N2CCC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)nc1 ZINC001164632566 719100809 /nfs/dbraw/zinc/10/08/09/719100809.db2.gz ZRSWAQPOPNBMRV-PKTZIBPZSA-N 1 1 400.526 3.392 20 0 HGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2C[C@@H](N3CCCC3=O)[C@H]3OCCC[C@H]3C2)nc1 ZINC001164646022 719305725 /nfs/dbraw/zinc/30/57/25/719305725.db2.gz AVLUJUXDMCANRD-BLRYILKCSA-N 1 1 412.578 3.235 20 0 HGADMO Cc1cnc(N2CCC3(C[C@H](CC(=O)NCC[NH+](C)C)c4ccccc43)CC2)c(N)c1 ZINC001164682996 719675511 /nfs/dbraw/zinc/67/55/11/719675511.db2.gz QHLBSSFWWVNXJE-IBGZPJMESA-N 1 1 421.589 3.066 20 0 HGADMO CNC(=O)C[N@H+]1CCCC12CCN(c1cc(Cl)nc(-c3ccc(F)cc3)n1)CC2 ZINC001164689850 719745178 /nfs/dbraw/zinc/74/51/78/719745178.db2.gz LZTGGKAKWJYOQL-UHFFFAOYSA-N 1 1 417.916 3.117 20 0 HGADMO CCOC(=O)c1nccc(N2CCC3(CCC[N@H+]3Cc3csc(C)n3)CC2)n1 ZINC001164691265 719814702 /nfs/dbraw/zinc/81/47/02/719814702.db2.gz CFKLCLGJAYKEMM-UHFFFAOYSA-N 1 1 401.536 3.053 20 0 HGADMO CCOC(=O)c1cccc(N2CCC3(CC2)C[N@@H+](Cc2cccs2)CCO3)n1 ZINC001164695265 719890636 /nfs/dbraw/zinc/89/06/36/719890636.db2.gz KKVOBLPUWDFJNO-UHFFFAOYSA-N 1 1 401.532 3.191 20 0 HGADMO CC(C)COc1cncc(N2CCC3(CC2)C[N@@H+](Cc2cccs2)CCO3)n1 ZINC001164705945 719898234 /nfs/dbraw/zinc/89/82/34/719898234.db2.gz GHAKHUFQNUBBJV-UHFFFAOYSA-N 1 1 402.564 3.444 20 0 HGADMO COCc1cc(N2CC[C@]3(C2)C[N@H+](CC2CC2)C[C@H]3COC)nc(-c2ccccc2)n1 ZINC001164810392 720077298 /nfs/dbraw/zinc/07/72/98/720077298.db2.gz LMFCQEQRKIMCOL-SQJMNOBHSA-N 1 1 422.573 3.475 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(C(F)(F)c1cc(Cl)nc(OC)c1)C2 ZINC001164811405 720079821 /nfs/dbraw/zinc/07/98/21/720079821.db2.gz OGKGWXLTVCNLSA-QFBILLFUSA-N 1 1 415.912 3.473 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(C(F)(F)c1cc(Cl)nc(C)n1)C2 ZINC001164808533 720086260 /nfs/dbraw/zinc/08/62/60/720086260.db2.gz HWDMRYAKEDOSMB-YJBOKZPZSA-N 1 1 400.901 3.168 20 0 HGADMO CCOC(=O)c1ccnc(N2CCC3(C[C@@H](COC)[N@@H+](Cc4ccccn4)C3)CC2)c1 ZINC001164710034 720098285 /nfs/dbraw/zinc/09/82/85/720098285.db2.gz FZMMDJXRMDCWJA-NRFANRHFSA-N 1 1 424.545 3.161 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(C(F)(F)c1cc(C)nc(Cl)n1)C2 ZINC001164812354 720098604 /nfs/dbraw/zinc/09/86/04/720098604.db2.gz QTKNGDNURCGOKO-YJBOKZPZSA-N 1 1 400.901 3.168 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1nccc3ccc(C(=O)OC)cc31)C2 ZINC001164811069 720104794 /nfs/dbraw/zinc/10/47/94/720104794.db2.gz LEJHWRGKKUDIDM-GBXCKJPGSA-N 1 1 409.530 3.206 20 0 HGADMO COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1nnc(Cl)cc1F)CC2 ZINC001164716900 720119428 /nfs/dbraw/zinc/11/94/28/720119428.db2.gz LISLJXODEQGPLT-INIZCTEOSA-N 1 1 405.905 3.172 20 0 HGADMO COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1cc(C(=O)OC)c(C)cn1)CC2 ZINC001164718565 720124983 /nfs/dbraw/zinc/12/49/83/720124983.db2.gz SJIZLHQCYLBWMU-HXUWFJFHSA-N 1 1 424.545 3.079 20 0 HGADMO COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1cnc(Cl)cc1N)CC2 ZINC001164710472 720136080 /nfs/dbraw/zinc/13/60/80/720136080.db2.gz BREUBIHGSMTENT-KRWDZBQOSA-N 1 1 401.942 3.220 20 0 HGADMO COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1ncc(Cl)cc1N)CC2 ZINC001164710398 720137685 /nfs/dbraw/zinc/13/76/85/720137685.db2.gz AVIMJDZTBRGMBM-GOSISDBHSA-N 1 1 401.942 3.220 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1ncc3c(n1)-c1ccccc1CC3)C2 ZINC001164817805 720150110 /nfs/dbraw/zinc/15/01/10/720150110.db2.gz QHJGXRLFOWFUPE-SQJMNOBHSA-N 1 1 404.558 3.427 20 0 HGADMO COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1ncc3c(n1)CCCC3)CC2 ZINC001164713880 720151350 /nfs/dbraw/zinc/15/13/50/720151350.db2.gz TXMPYVKADLXDOD-NRFANRHFSA-N 1 1 407.562 3.258 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1cc(-c3ccccc3OC)ncn1)C2 ZINC001164812424 720175540 /nfs/dbraw/zinc/17/55/40/720175540.db2.gz ANSUWJVSZXZLEZ-YADARESESA-N 1 1 408.546 3.337 20 0 HGADMO CC(C)[N@@H+](C)Cc1cc(=O)n2c(n1)CN(c1nnc(Cl)c3ccsc31)CCC2 ZINC001164811445 720216531 /nfs/dbraw/zinc/21/65/31/720216531.db2.gz HZXUWJQYFPEYPN-UHFFFAOYSA-N 1 1 418.954 3.152 20 0 HGADMO CC(C)[N@@H+](C)Cc1cc(=O)n2c(n1)CN(c1cc3nccc(Cl)c3cn1)CCC2 ZINC001164812959 720221012 /nfs/dbraw/zinc/22/10/12/720221012.db2.gz KXYKYDSXXMAICF-UHFFFAOYSA-N 1 1 412.925 3.090 20 0 HGADMO CCOC(=O)c1sc2ncnc(N3CC[C@@H]4[C@H]3CC[N@H+]4Cc3cccnc3)c2c1C ZINC001164728390 720330573 /nfs/dbraw/zinc/33/05/73/720330573.db2.gz VLLHWSNPOQLXGW-IAGOWNOFSA-N 1 1 423.542 3.425 20 0 HGADMO COc1cc2nc(C)nc(N3CC[C@H]4[C@H]3CC[N@H+]4Cc3cccnc3)c2cc1OC ZINC001164723747 720386477 /nfs/dbraw/zinc/38/64/77/720386477.db2.gz HDDFPGVWCFZPLG-VQTJNVASSA-N 1 1 405.502 3.204 20 0 HGADMO CCOC(=O)c1nc(Cl)nc(Cl)c1N1CC[C@@H]2[C@@H]1CC[N@@H+]2Cc1cccnc1 ZINC001164729059 720396366 /nfs/dbraw/zinc/39/63/66/720396366.db2.gz UWPIDCINDBWIQH-KGLIPLIRSA-N 1 1 422.316 3.208 20 0 HGADMO CCOC(=O)c1nc(Cl)nc(Cl)c1N1CC[C@@H]2[C@@H]1CC[N@H+]2Cc1cccnc1 ZINC001164729059 720396374 /nfs/dbraw/zinc/39/63/74/720396374.db2.gz UWPIDCINDBWIQH-KGLIPLIRSA-N 1 1 422.316 3.208 20 0 HGADMO COC(=O)c1cc2c(N3CC[C@H]4[C@H]3CC[N@H+]4Cc3cccnc3)[nH]c(Cl)cc-2n1 ZINC001164731737 720412244 /nfs/dbraw/zinc/41/22/44/720412244.db2.gz MDLFKLCVALUDAD-ZWKOTPCHSA-N 1 1 411.893 3.251 20 0 HGADMO COC(=O)c1cnc(Cl)c(C(F)(F)N2CC[C@H]3[C@H]2CC[N@@H+]3Cc2cccnc2)c1 ZINC001164734397 720426709 /nfs/dbraw/zinc/42/67/09/720426709.db2.gz RXWXSZNJYVOLCW-DLBZAZTESA-N 1 1 422.863 3.315 20 0 HGADMO COC(=O)c1cnc(Cl)c(C(F)(F)N2CC[C@H]3[C@H]2CC[N@H+]3Cc2cccnc2)c1 ZINC001164734397 720426719 /nfs/dbraw/zinc/42/67/19/720426719.db2.gz RXWXSZNJYVOLCW-DLBZAZTESA-N 1 1 422.863 3.315 20 0 HGADMO COC(=O)c1cnc(Cl)cc1C(F)(F)N1CC[C@H]2[C@H]1CC[N@@H+]2Cc1cccnc1 ZINC001164727162 720436209 /nfs/dbraw/zinc/43/62/09/720436209.db2.gz DEQNAZJXBBGDAJ-DLBZAZTESA-N 1 1 422.863 3.315 20 0 HGADMO COC(=O)c1cnc(Cl)cc1C(F)(F)N1CC[C@H]2[C@H]1CC[N@H+]2Cc1cccnc1 ZINC001164727162 720436215 /nfs/dbraw/zinc/43/62/15/720436215.db2.gz DEQNAZJXBBGDAJ-DLBZAZTESA-N 1 1 422.863 3.315 20 0 HGADMO FC(F)(c1c2c(nnc1Cl)CCC2)N1CC[C@H]2[C@H]1CC[N@@H+]2Cc1cccnc1 ZINC001164732030 720443456 /nfs/dbraw/zinc/44/34/56/720443456.db2.gz MVNWVROQKWLVLH-DLBZAZTESA-N 1 1 405.880 3.412 20 0 HGADMO FC(F)(c1c2c(nnc1Cl)CCC2)N1CC[C@H]2[C@H]1CC[N@H+]2Cc1cccnc1 ZINC001164732030 720443468 /nfs/dbraw/zinc/44/34/68/720443468.db2.gz MVNWVROQKWLVLH-DLBZAZTESA-N 1 1 405.880 3.412 20 0 HGADMO Cc1cnc(N2CC[C@@H]3[C@H](C[C@H](Cn4cccn4)[N@@H+]3C(C)C)C2)nc1NCC1CC1 ZINC001164836531 720504667 /nfs/dbraw/zinc/50/46/67/720504667.db2.gz MXTPSYUJSWEXIA-NJDAHSKKSA-N 1 1 409.582 3.181 20 0 HGADMO CC(C)[N@@H+]1[C@@H]2CCN(C(F)(F)c3ccnc(Cl)n3)C[C@@H]2C[C@H]1Cn1cccn1 ZINC001164839382 720505014 /nfs/dbraw/zinc/50/50/14/720505014.db2.gz TUHGOMUZRBWWQR-HRCADAONSA-N 1 1 410.900 3.249 20 0 HGADMO COC(=O)c1cnc(Cl)cc1N1CC[C@@H]2[C@@H](C[C@H](Cn3cccn3)[N@H+]2C(C)C)C1 ZINC001164841231 720508517 /nfs/dbraw/zinc/50/85/17/720508517.db2.gz XYKDAGJROIFUHO-LZLYRXPVSA-N 1 1 417.941 3.096 20 0 HGADMO COC(=O)c1cc(Cl)cnc1N1CC[C@@H]2[C@@H](C[C@H](Cn3cccn3)[N@H+]2C(C)C)C1 ZINC001164833284 720511704 /nfs/dbraw/zinc/51/17/04/720511704.db2.gz CSFDUCMGNNPBAD-KVSKMBFKSA-N 1 1 417.941 3.096 20 0 HGADMO COc1ccc2cnc(N3CC[C@@H]4[C@@H](C[C@H](Cn5cccn5)[N@H+]4C(C)C)C3)nc2c1 ZINC001164839431 720526460 /nfs/dbraw/zinc/52/64/60/720526460.db2.gz UGRJUSKBFMNTQS-NNMXDRDESA-N 1 1 406.534 3.213 20 0 HGADMO CC(C)[N@@H+]1[C@@H]2CCN(c3nc(Cl)nc4cnccc43)C[C@H]2C[C@H]1Cn1cccn1 ZINC001164834913 720527349 /nfs/dbraw/zinc/52/73/49/720527349.db2.gz IFEAFYPKEXZQMK-JTDSTZFVSA-N 1 1 411.941 3.253 20 0 HGADMO CC(C)[N@@H+]1[C@@H]2CCN(C(F)(F)c3cnnc(Cl)c3)C[C@H]2C[C@H]1Cn1cccn1 ZINC001164841383 720545092 /nfs/dbraw/zinc/54/50/92/720545092.db2.gz URYVWIXXKKLUHC-HYVNUMGLSA-N 1 1 410.900 3.249 20 0 HGADMO CCOc1c(Cl)ncnc1N1CC[C@@H]2[C@H](C[C@H](Cn3cccn3)[N@H+]2C(C)C)C1 ZINC001164840187 720554760 /nfs/dbraw/zinc/55/47/60/720554760.db2.gz SBQKXMAREOWGRX-BRWVUGGUSA-N 1 1 404.946 3.103 20 0 HGADMO CC(C)[N@@H+]1[C@@H]2CCN(C(F)(F)c3cc(N)cc(Cl)n3)C[C@H]2C[C@H]1Cn1cccn1 ZINC001164840182 720558896 /nfs/dbraw/zinc/55/88/96/720558896.db2.gz SBOQOKWMTHRRDP-HYVNUMGLSA-N 1 1 424.927 3.436 20 0 HGADMO COC(=O)/C=C\c1cc(C)cnc1N1CC[C@@H]2[C@H](C[C@H](Cn3cccn3)[N@H+]2C(C)C)C1 ZINC001164842211 720580674 /nfs/dbraw/zinc/58/06/74/720580674.db2.gz UMDXKJOVRYTKOS-PJVMXSJMSA-N 1 1 423.561 3.151 20 0 HGADMO Cc1noc(-c2ccnc(N3CC[C@@H]4[C@@H](C[C@@H](Cn5cccn5)[N@@H+]4C(C)C)C3)c2)n1 ZINC001164842900 720613861 /nfs/dbraw/zinc/61/38/61/720613861.db2.gz WGDBCWBMIFAXAN-SLFFLAALSA-N 1 1 407.522 3.014 20 0 HGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@@H]2CN(c3ccc(-c4ccccn4)nn3)CC[C@@H]21 ZINC001164841664 720620739 /nfs/dbraw/zinc/62/07/39/720620739.db2.gz UAZWXTWACXEGAK-DXIQSLLYSA-N 1 1 403.534 3.113 20 0 HGADMO FC(F)(c1cc(Cl)nc(Cl)c1)N1CC[N@@H+]2C[C@@H](Oc3cncnc3)C[C@H]2C1 ZINC001164746288 720622337 /nfs/dbraw/zinc/62/23/37/720622337.db2.gz WXYFQJZNAZLETI-STQMWFEESA-N 1 1 416.259 3.065 20 0 HGADMO FC(F)(c1cc(Cl)nc(Cl)c1)N1CC[N@H+]2C[C@@H](Oc3cncnc3)C[C@H]2C1 ZINC001164746288 720622345 /nfs/dbraw/zinc/62/23/45/720622345.db2.gz WXYFQJZNAZLETI-STQMWFEESA-N 1 1 416.259 3.065 20 0 HGADMO CC(C)[N@H+]1[C@@H](Cn2cccn2)C[C@@H]2CN(c3cc(N4CCC[C@@H](C)C4)ncn3)CC[C@H]21 ZINC001164836250 720626041 /nfs/dbraw/zinc/62/60/41/720626041.db2.gz FNPIOQHVEOSFQR-GXRSIYKFSA-N 1 1 423.609 3.287 20 0 HGADMO FC(F)(c1cnc(Cl)cc1Cl)N1CC[N@@H+]2C[C@H](Oc3cncnc3)C[C@H]2C1 ZINC001164743802 720627654 /nfs/dbraw/zinc/62/76/54/720627654.db2.gz QTZZDPNKCNTZBM-NWDGAFQWSA-N 1 1 416.259 3.065 20 0 HGADMO FC(F)(c1cnc(Cl)cc1Cl)N1CC[N@H+]2C[C@H](Oc3cncnc3)C[C@H]2C1 ZINC001164743802 720627659 /nfs/dbraw/zinc/62/76/59/720627659.db2.gz QTZZDPNKCNTZBM-NWDGAFQWSA-N 1 1 416.259 3.065 20 0 HGADMO CSc1cc(N2CC[C@@H]3[C@H](C[C@@H](Cn4cccn4)[N@H+]3C(C)C)C2)nc(SC)n1 ZINC001164839793 720646143 /nfs/dbraw/zinc/64/61/43/720646143.db2.gz KGUTXFWBLKKFLA-IXDOHACOSA-N 1 1 418.636 3.495 20 0 HGADMO Clc1cnc2cc(Cl)c(N3CC[N@H+]4C[C@H](Oc5cncnc5)C[C@@H]4C3)cc2n1 ZINC001164740616 720679176 /nfs/dbraw/zinc/67/91/76/720679176.db2.gz RCTOBJARSGODIU-CHWSQXEVSA-N 1 1 417.300 3.069 20 0 HGADMO CCOC(=O)c1cnc(N2CCC3(C[C@@H]([N@@H+](C)Cc4ccccc4)CO3)CC2)nc1C ZINC001164845292 720687191 /nfs/dbraw/zinc/68/71/91/720687191.db2.gz XTXDPICASNVCKR-HXUWFJFHSA-N 1 1 424.545 3.222 20 0 HGADMO c1ccc(-c2nc(N3CC[N@@H+]4C[C@@H](Oc5cncnc5)C[C@@H]4C3)nc3ccccc32)cc1 ZINC001164739300 720690212 /nfs/dbraw/zinc/69/02/12/720690212.db2.gz MVZXXMKFDXWLKA-UXHICEINSA-N 1 1 424.508 3.429 20 0 HGADMO COc1ccc2c(c1)nc(Cl)cc2N1CC[N@H+]2C[C@@H](Oc3cncnc3)C[C@@H]2C1 ZINC001164744336 720694182 /nfs/dbraw/zinc/69/41/82/720694182.db2.gz ZJVWJCMGFHRSCN-ZBFHGGJFSA-N 1 1 411.893 3.029 20 0 HGADMO COc1cnc2c(c1)ncnc2N1CCC2(C[C@H]([N@@H+](C)Cc3ccccc3)CO2)CC1 ZINC001164839362 720706210 /nfs/dbraw/zinc/70/62/10/720706210.db2.gz LLNINIMVPAUBEL-IBGZPJMESA-N 1 1 419.529 3.293 20 0 HGADMO Cc1csc2c1nc(Cl)cc2N1CC[N@H+]2C[C@H](Oc3cncnc3)C[C@H]2C1 ZINC001164737876 720734749 /nfs/dbraw/zinc/73/47/49/720734749.db2.gz DDLBAHAXKDIQAH-UONOGXRCSA-N 1 1 401.923 3.390 20 0 HGADMO CCCCOc1cnc(N2CC[N@H+]3C[C@@H](Oc4cncnc4)C[C@H]3C2)c(Cl)c1 ZINC001164739012 720745671 /nfs/dbraw/zinc/74/56/71/720745671.db2.gz HMFLRRJXFFTFGV-RDJZCZTQSA-N 1 1 403.914 3.046 20 0 HGADMO CC[C@@H]1N(c2ncnc3c2CC[N@H+](Cc2ccccc2)C3)CCC[C@]12CCC(=O)N2 ZINC001164843905 720749815 /nfs/dbraw/zinc/74/98/15/720749815.db2.gz MNKHHZYGZRJSND-URXFXBBRSA-N 1 1 405.546 3.063 20 0 HGADMO CC[C@@H]1N(c2ncnc3c2CC[N@@H+](Cc2ccccc2)C3)CCC[C@]12CCC(=O)N2 ZINC001164843905 720749821 /nfs/dbraw/zinc/74/98/21/720749821.db2.gz MNKHHZYGZRJSND-URXFXBBRSA-N 1 1 405.546 3.063 20 0 HGADMO Clc1ccc2c(Cl)nnc(N3CC[N@H+]4C[C@H](Oc5cncnc5)C[C@@H]4C3)c2c1 ZINC001164748906 720792240 /nfs/dbraw/zinc/79/22/40/720792240.db2.gz RVBRDRQTFZODOV-ZIAGYGMSSA-N 1 1 417.300 3.069 20 0 HGADMO FC(F)(Sc1ccc(Cl)nc1)N1CC[N@@H+]2C[C@@H](Oc3cncnc3)C[C@H]2C1 ZINC001164748344 720803628 /nfs/dbraw/zinc/80/36/28/720803628.db2.gz QTOKFSAMLVLWKP-STQMWFEESA-N 1 1 413.881 3.005 20 0 HGADMO FC(F)(Sc1ccc(Cl)nc1)N1CC[N@H+]2C[C@@H](Oc3cncnc3)C[C@H]2C1 ZINC001164748344 720803629 /nfs/dbraw/zinc/80/36/29/720803629.db2.gz QTOKFSAMLVLWKP-STQMWFEESA-N 1 1 413.881 3.005 20 0 HGADMO FC(F)(c1ccc(Cl)nc1)N1CC[C@@H]2[C@H](C[C@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164743352 720808327 /nfs/dbraw/zinc/80/83/27/720808327.db2.gz FHWNOGKGTNNKPC-KBAYOESNSA-N 1 1 422.911 3.251 20 0 HGADMO Clc1nnc(N2CC[C@@H]3[C@H](C[C@@H](Cn4cncn4)[N@H+]3CC3CC3)C2)c2ccccc12 ZINC001164740752 720815179 /nfs/dbraw/zinc/81/51/79/720815179.db2.gz AIXVYZSOQRPTJW-FUHIMQAGSA-N 1 1 423.952 3.254 20 0 HGADMO c1ncn(C[C@H]2C[C@@H]3CN(c4ccc(-c5ccccc5)nn4)CC[C@H]3[N@H+]2CC2CC2)n1 ZINC001164738420 720816161 /nfs/dbraw/zinc/81/61/61/720816161.db2.gz FRDRKVKYWSKJSS-MQSCRBSSSA-N 1 1 415.545 3.115 20 0 HGADMO c1ncn(C[C@@H]2C[C@@H]3CN(c4ccnc(-c5ccccc5)n4)CC[C@H]3[N@H+]2CC2CC2)n1 ZINC001164741255 720816348 /nfs/dbraw/zinc/81/63/48/720816348.db2.gz MSIQJITYWLUIRT-BHIFYINESA-N 1 1 415.545 3.115 20 0 HGADMO Clc1cccc2c1ncnc2N1CC[C@@H]2[C@H](C[C@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164743332 720817300 /nfs/dbraw/zinc/81/73/00/720817300.db2.gz SGGIBFJQUAUQPY-MBOZVWFJSA-N 1 1 423.952 3.254 20 0 HGADMO CCOc1cc(Cl)nc(N2CC[C@@H]3[C@@H](C[C@@H](Cn4cncn4)[N@H+]3CC3CC3)C2)c1 ZINC001164746102 720826982 /nfs/dbraw/zinc/82/69/82/720826982.db2.gz XYLVJYKYMNNOJR-JENIJYKNSA-N 1 1 416.957 3.105 20 0 HGADMO Clc1ccc2cnc(N3CC[C@@H]4[C@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)nc2c1 ZINC001164748756 720834270 /nfs/dbraw/zinc/83/42/70/720834270.db2.gz UVMFJQWIOLVYCN-SLYNCCJLSA-N 1 1 423.952 3.254 20 0 HGADMO COCC[N@H+]1CCO[C@H]2CN(C(F)(F)c3cnc(Cl)cc3Cl)CC[C@H]2C1 ZINC001164857132 720837487 /nfs/dbraw/zinc/83/74/87/720837487.db2.gz XQOGRPJZOMLACV-WFASDCNBSA-N 1 1 410.292 3.107 20 0 HGADMO COCC[N@H+]1CCO[C@@H]2CN(C(F)(F)c3cnc(Cl)cc3Cl)CC[C@H]2C1 ZINC001164857131 720837611 /nfs/dbraw/zinc/83/76/11/720837611.db2.gz XQOGRPJZOMLACV-SWLSCSKDSA-N 1 1 410.292 3.107 20 0 HGADMO Fc1cccc2ccc(N3CC[C@@H]4[C@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)nc12 ZINC001164742387 720841600 /nfs/dbraw/zinc/84/16/00/720841600.db2.gz GEODDBNWWGOUSX-SFHLNBCPSA-N 1 1 406.509 3.345 20 0 HGADMO c1ncn(C[C@@H]2C[C@@H]3CN(c4cnc(-c5ccccc5)cn4)CC[C@H]3[N@H+]2CC2CC2)n1 ZINC001164750368 720847387 /nfs/dbraw/zinc/84/73/87/720847387.db2.gz XJHXYWZBPPIXIZ-FUPPJEDESA-N 1 1 415.545 3.115 20 0 HGADMO CCc1nc2sccc2c(N2CC[C@@H]3[C@H](C[C@H](Cn4cncn4)[N@H+]3CC3CC3)C2)n1 ZINC001164745996 720854024 /nfs/dbraw/zinc/85/40/24/720854024.db2.gz FBSXUAJGPGUQKV-ZHALLVOQSA-N 1 1 423.590 3.225 20 0 HGADMO COCC[N@H+]1CCO[C@@H]2CN(C(F)(F)c3ccc(SC)c(Cl)n3)CC[C@@H]2C1 ZINC001164852501 720861105 /nfs/dbraw/zinc/86/11/05/720861105.db2.gz DNXXYAQNSPYZJG-ZIAGYGMSSA-N 1 1 421.941 3.175 20 0 HGADMO c1cc2ncnc(N3CC[C@]4(C3)C[N@H+](CC3CC3)C[C@H]4COCc3cccnc3)c2[nH]1 ZINC001164752941 720871003 /nfs/dbraw/zinc/87/10/03/720871003.db2.gz NPFNJOMPFNEXQT-GBXCKJPGSA-N 1 1 418.545 3.108 20 0 HGADMO Clc1cncc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COCc2cccnc2)n1 ZINC001164747945 720872015 /nfs/dbraw/zinc/87/20/15/720872015.db2.gz CQPIJNXMTSQWRW-SIKLNZKXSA-N 1 1 413.953 3.280 20 0 HGADMO COCC[N@H+]1CCO[C@@H]2CN(c3nc4c(Cl)cccc4nc3Cl)CC[C@@H]2C1 ZINC001164865235 720886890 /nfs/dbraw/zinc/88/68/90/720886890.db2.gz ZAOVIBDCCFQDMZ-CZUORRHYSA-N 1 1 411.333 3.110 20 0 HGADMO COCC[N@H+]1CCO[C@H]2CN(c3cnc(Cl)nc3Oc3ccccc3)CC[C@@H]2C1 ZINC001164865047 720889059 /nfs/dbraw/zinc/88/90/59/720889059.db2.gz YBAHKQBDXGXYEW-APWZRJJASA-N 1 1 418.925 3.096 20 0 HGADMO COCC[N@H+]1CCO[C@@H]2CN(C(F)(F)Sc3ccc(Cl)nc3)CC[C@H]2C1 ZINC001164860003 720890188 /nfs/dbraw/zinc/89/01/88/720890188.db2.gz NVAZILHLZPEFSU-DZGCQCFKSA-N 1 1 407.914 3.047 20 0 HGADMO COCC[N@H+]1CCO[C@@H]2CN(c3nc(Cl)cc4cc(F)c(OC)cc43)CC[C@@H]2C1 ZINC001164855957 720893318 /nfs/dbraw/zinc/89/33/18/720893318.db2.gz DSINOWCFLJBYTH-AUUYWEPGSA-N 1 1 423.916 3.209 20 0 HGADMO CCc1nc(C)cc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COCc2cccnc2)n1 ZINC001164752210 720912599 /nfs/dbraw/zinc/91/25/99/720912599.db2.gz NOBWZPMLPCDHDA-RDGATRHJSA-N 1 1 421.589 3.498 20 0 HGADMO CC(C)[N@@H+](C)Cc1cnc2n1CCN(c1nccc(C(=O)OC(C)(C)C)n1)[C@@H]2C ZINC001164861743 720972378 /nfs/dbraw/zinc/97/23/78/720972378.db2.gz QOGQUOCUIAHRAH-OAHLLOKOSA-N 1 1 400.527 3.050 20 0 HGADMO CSc1nc2ncnc(N3CCn4c(C[N@@H+](C)C(C)C)cnc4[C@@H]3C)c2s1 ZINC001164859758 720983365 /nfs/dbraw/zinc/98/33/65/720983365.db2.gz MLKFCSDNXQYDEJ-LBPRGKRZSA-N 1 1 403.581 3.426 20 0 HGADMO Fc1ccc2nc(Cl)nc(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@H]4C3)c2c1 ZINC001164868735 721055869 /nfs/dbraw/zinc/05/58/69/721055869.db2.gz QEIAVNRWQBHIAY-IRXDYDNUSA-N 1 1 413.884 3.297 20 0 HGADMO Clc1ncnc2scc(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@@H]4C3)c21 ZINC001164868926 721074990 /nfs/dbraw/zinc/07/49/90/721074990.db2.gz RFSMMRSLNQZIFH-HUUCEWRRSA-N 1 1 401.923 3.219 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(C(F)(F)c4cc(Cl)nc(Cl)n4)C[C@H]3C2)cn1 ZINC001164773722 721079077 /nfs/dbraw/zinc/07/90/77/721079077.db2.gz YDXFAAFOAZAINO-CHWSQXEVSA-N 1 1 417.291 3.020 20 0 HGADMO Fc1ccc(Cl)nc1C(F)(F)N1CC[N@H+]2C[C@H](OCc3cccnc3)C[C@H]2C1 ZINC001164864058 721084437 /nfs/dbraw/zinc/08/44/37/721084437.db2.gz DSUHZOQAMQHPLQ-LSDHHAIUSA-N 1 1 412.843 3.294 20 0 HGADMO COc1cc2ccc(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@H]4C3)nc2cc1OC ZINC001164865442 721107819 /nfs/dbraw/zinc/10/78/19/721107819.db2.gz LIWYZEOUILINET-PMACEKPBSA-N 1 1 420.513 3.127 20 0 HGADMO Cc1ccc(Cl)nc1C(F)(F)N1CC[N@H+]2C[C@H](OCc3cccnc3)C[C@@H]2C1 ZINC001164864556 721109096 /nfs/dbraw/zinc/10/90/96/721109096.db2.gz GGSVBLCBVINJRS-IAGOWNOFSA-N 1 1 408.880 3.463 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4nc(Cl)nc5cccc(F)c54)C[C@@H]3C2)cn1 ZINC001164773927 721109097 /nfs/dbraw/zinc/10/90/97/721109097.db2.gz ZHLBBWOWMBDRJD-GJZGRUSLSA-N 1 1 400.889 3.114 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4cc(Cl)nc(Cc5ccccc5)n4)C[C@H]3C2)cn1 ZINC001164763353 721111285 /nfs/dbraw/zinc/11/12/85/721111285.db2.gz FGOTXAKTBRUPAS-VQTJNVASSA-N 1 1 422.964 3.413 20 0 HGADMO CC(C)(C)c1cc(Cl)nc(N2CC[N@H+]3C[C@@H](OCc4cccnc4)C[C@H]3C2)n1 ZINC001164872618 721127731 /nfs/dbraw/zinc/12/77/31/721127731.db2.gz HXWHLZCVOXFKNA-IRXDYDNUSA-N 1 1 401.942 3.302 20 0 HGADMO CCc1cc2c(nc(Cl)nc2N2CC[N@H+]3C[C@@H](OCc4cccnc4)C[C@@H]3C2)[nH]1 ZINC001164879099 721130234 /nfs/dbraw/zinc/13/02/34/721130234.db2.gz RTDVVZMHQUHGQY-SJORKVTESA-N 1 1 412.925 3.048 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4nc(Cl)ncc4-c4ccccc4)C[C@@H]3C2)cn1 ZINC001164763423 721137821 /nfs/dbraw/zinc/13/78/21/721137821.db2.gz FQOSVELUERHAKQ-OALUTQOASA-N 1 1 408.937 3.489 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4nc(Cl)ncc4-c4ccccc4)C[C@H]3C2)cn1 ZINC001164763424 721138130 /nfs/dbraw/zinc/13/81/30/721138130.db2.gz FQOSVELUERHAKQ-RBUKOAKNSA-N 1 1 408.937 3.489 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4nc(Cl)ncc4-c4ccccc4)C[C@H]3C2)cn1 ZINC001164763425 721138763 /nfs/dbraw/zinc/13/87/63/721138763.db2.gz FQOSVELUERHAKQ-RTBURBONSA-N 1 1 408.937 3.489 20 0 HGADMO COc1ccccc1-c1ccc(N2CC[N@H+]3C[C@H](OCc4cccnc4)C[C@@H]3C2)nn1 ZINC001164872514 721146722 /nfs/dbraw/zinc/14/67/22/721146722.db2.gz HJVWIQARMKVMHK-WOJBJXKFSA-N 1 1 417.513 3.027 20 0 HGADMO Fc1ccc2c(Cl)nnc(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@H]4C3)c2c1 ZINC001164878976 721169908 /nfs/dbraw/zinc/16/99/08/721169908.db2.gz RDHUHKQGKVBLLR-DLBZAZTESA-N 1 1 413.884 3.297 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4cccc(OCc5ccccc5)n4)C[C@H]3C2)cn1 ZINC001164768702 721173233 /nfs/dbraw/zinc/17/32/33/721173233.db2.gz LOQYPSZFKIPFES-FGZHOGPDSA-N 1 1 403.530 3.352 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4ncnc5[nH]c6ccc(Cl)cc6c54)C[C@@H]3C2)cn1 ZINC001164765056 721184988 /nfs/dbraw/zinc/18/49/88/721184988.db2.gz HOKTZBCPNXGBLK-CVEARBPZSA-N 1 1 421.936 3.456 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4ccc(NC(=O)OC(C)(C)C)cn4)C[C@H]3C2)cn1 ZINC001164764173 721188585 /nfs/dbraw/zinc/18/85/85/721188585.db2.gz GKIBLLILJOKEKK-ZWKOTPCHSA-N 1 1 412.538 3.120 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4ncccc4OCc4ccc(F)cc4)C[C@H]3C2)cn1 ZINC001164770880 721213628 /nfs/dbraw/zinc/21/36/28/721213628.db2.gz PALARRALXAMTLW-NHCUHLMSSA-N 1 1 421.520 3.492 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4cc5nc(Cl)cnc5cc4F)C[C@H]3C2)cn1 ZINC001164768508 721214182 /nfs/dbraw/zinc/21/41/82/721214182.db2.gz LFCDNGSEJVJQBN-HUUCEWRRSA-N 1 1 400.889 3.114 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4cc(SCc5ccccc5)ncn4)C[C@@H]3C2)cn1 ZINC001164769141 721222701 /nfs/dbraw/zinc/22/27/01/721222701.db2.gz LTHOJZYGUHIPQB-SFTDATJTSA-N 1 1 420.586 3.461 20 0 HGADMO CCN1C(=O)[C@]2(CC[C@@H]3CN(c4ccc([C@@H]5CCCC[N@H+]5CC)cn4)C[C@H]32)N=C1C ZINC001164876235 721234296 /nfs/dbraw/zinc/23/42/96/721234296.db2.gz YWUFKWXJEXYYMQ-IUBSTNSRSA-N 1 1 409.578 3.494 20 0 HGADMO Cc1c(Cl)nc(CC(C)C)nc1N1C[C@@H]2C[N@H+](Cc3cnn(C)c3)CC[C@@H]2C1 ZINC001164763938 721235102 /nfs/dbraw/zinc/23/51/02/721235102.db2.gz OHBMFIUUECDXRR-MSOLQXFVSA-N 1 1 402.974 3.329 20 0 HGADMO Cc1cc(-c2ccccc2F)nnc1N1C[C@@H]2CC[N@H+](Cc3cnn(C)c3)C[C@@H]2C1 ZINC001164761544 721236272 /nfs/dbraw/zinc/23/62/72/721236272.db2.gz JJLGDCZRBKMTHT-RBUKOAKNSA-N 1 1 406.509 3.283 20 0 HGADMO Cc1cc(-c2ccccc2F)nnc1N1C[C@@H]2CC[N@H+](Cc3cnn(C)c3)C[C@H]2C1 ZINC001164761543 721236511 /nfs/dbraw/zinc/23/65/11/721236511.db2.gz JJLGDCZRBKMTHT-OALUTQOASA-N 1 1 406.509 3.283 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4c(F)ccc5c(Cl)ncnc54)C[C@H]3C2)cn1 ZINC001164764886 721244024 /nfs/dbraw/zinc/24/40/24/721244024.db2.gz QIIOSFGVGYSOLM-LSDHHAIUSA-N 1 1 400.889 3.114 20 0 HGADMO CCN1CC[C@@]2(CN(c3ccc4c(n3)CC[N@H+](Cc3ccccc3)C4)C[C@@H]2C)C1=O ZINC001164777295 721317793 /nfs/dbraw/zinc/31/77/93/721317793.db2.gz JNQWZOGNMFFMMW-DFBJGRDBSA-N 1 1 404.558 3.335 20 0 HGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2CC[C@H]3OCC[C@]3(C(=O)NCC3CC3)C2)nc1 ZINC001164882876 721345619 /nfs/dbraw/zinc/34/56/19/721345619.db2.gz IGZNSKPHKUSBLF-LGVFNWMJSA-N 1 1 412.578 3.140 20 0 HGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@]2(CCCN(c3cnc(-c4ccco4)cn3)C2)C1 ZINC001164779394 721346128 /nfs/dbraw/zinc/34/61/28/721346128.db2.gz SYBYWGFBKSEIIW-HSZRJFAPSA-N 1 1 423.517 3.460 20 0 HGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@]2(CCCN(c3cnc(-c4ccco4)cn3)C2)C1 ZINC001164779394 721346130 /nfs/dbraw/zinc/34/61/30/721346130.db2.gz SYBYWGFBKSEIIW-HSZRJFAPSA-N 1 1 423.517 3.460 20 0 HGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@]2(CCCN(c3ncnc4[nH]c(C)c(C)c43)C2)C1 ZINC001164776196 721352411 /nfs/dbraw/zinc/35/24/11/721352411.db2.gz ALEZDMYMSAEIGZ-HSZRJFAPSA-N 1 1 424.549 3.299 20 0 HGADMO C[NH+]1CCN(C[C@H]2CCC[C@]3(CCN(C(F)(F)c4ccc(Cl)nc4)C3)O2)CC1 ZINC001164894119 721377727 /nfs/dbraw/zinc/37/77/27/721377727.db2.gz XTEGBPQQDUMJDL-IEBWSBKVSA-N 1 1 414.928 3.045 20 0 HGADMO C[NH+]1CCN(C[C@@H]2CCC[C@@]3(CCN(C(F)(F)c4ccc(Cl)nc4)C3)O2)CC1 ZINC001164894118 721378077 /nfs/dbraw/zinc/37/80/77/721378077.db2.gz XTEGBPQQDUMJDL-HKUYNNGSSA-N 1 1 414.928 3.045 20 0 HGADMO CC(C)(c1ccnc(Cl)c1)[N@H+]1C[C@@H](NC(=O)c2cccnc2)[C@@H]2OCCC[C@H]2C1 ZINC001164786947 721382420 /nfs/dbraw/zinc/38/24/20/721382420.db2.gz VMGMUBLKLPXSCI-ILZDJORESA-N 1 1 414.937 3.275 20 0 HGADMO CC(C)(c1ccnc(Cl)c1)[N@@H+]1C[C@@H](NC(=O)c2cccnc2)[C@@H]2OCCC[C@H]2C1 ZINC001164786947 721382423 /nfs/dbraw/zinc/38/24/23/721382423.db2.gz VMGMUBLKLPXSCI-ILZDJORESA-N 1 1 414.937 3.275 20 0 HGADMO C[NH+]1CCN(C[C@H]2CCC[C@@]3(CCN(c4nccc5c(Cl)ccnc54)C3)O2)CC1 ZINC001164888482 721390692 /nfs/dbraw/zinc/39/06/92/721390692.db2.gz JJHSVDBEJZGZFS-VGSWGCGISA-N 1 1 415.969 3.049 20 0 HGADMO C[NH+]1CCN(C[C@@H]2CCC[C@@]3(CCN(c4ncnc5ccc(Cl)cc54)C3)O2)CC1 ZINC001164892258 721392713 /nfs/dbraw/zinc/39/27/13/721392713.db2.gz SMSKQCDKAVEKKO-AVRDEDQJSA-N 1 1 415.969 3.049 20 0 HGADMO C[NH+]1CCN(C[C@H]2CCC[C@]3(CCN(c4ncnc5ccc(Cl)cc54)C3)O2)CC1 ZINC001164892264 721392840 /nfs/dbraw/zinc/39/28/40/721392840.db2.gz SMSKQCDKAVEKKO-XMSQKQJNSA-N 1 1 415.969 3.049 20 0 HGADMO C[NH+]1CCN(C[C@H]2CCC[C@@]3(CCN(c4ncnc5cc(Cl)ccc54)C3)O2)CC1 ZINC001164887675 721401187 /nfs/dbraw/zinc/40/11/87/721401187.db2.gz MDPMKZSLFIDZKW-GCJKJVERSA-N 1 1 415.969 3.049 20 0 HGADMO COc1ccc2nc(N3CC[C@]4(C3)CCC[C@@H](CN3CC[NH+](C)CC3)O4)ccc2c1 ZINC001164890963 721401190 /nfs/dbraw/zinc/40/11/90/721401190.db2.gz UUGYKAGAZRSWAH-URXFXBBRSA-N 1 1 410.562 3.009 20 0 HGADMO C[NH+]1CCN(C[C@H]2CCC[C@]3(CCN(c4nc5ccccc5nc4Cl)C3)O2)CC1 ZINC001164885696 721403175 /nfs/dbraw/zinc/40/31/75/721403175.db2.gz HAWCRWROMBMIKG-VGOFRKELSA-N 1 1 415.969 3.049 20 0 HGADMO CCc1cc2c(ncnc2N2CC[C@@]3(C2)CCC[C@H](CN2CC[NH+](C)CC2)O3)s1 ZINC001164883921 721409241 /nfs/dbraw/zinc/40/92/41/721409241.db2.gz CRDOKZNDEQMVCY-VGOFRKELSA-N 1 1 415.607 3.019 20 0 HGADMO O=C(Nc1ccccc1)c1ccnc(N2C[C@@H]3C[N@@H+](Cc4nccs4)C[C@@H]3C2)c1 ZINC001164789025 721411975 /nfs/dbraw/zinc/41/19/75/721411975.db2.gz UKFDOCIRIVRXJY-HDICACEKSA-N 1 1 405.527 3.359 20 0 HGADMO O=C(Nc1ccccc1)c1ccnc(N2C[C@@H]3C[N@H+](Cc4nccs4)C[C@@H]3C2)c1 ZINC001164789025 721411979 /nfs/dbraw/zinc/41/19/79/721411979.db2.gz UKFDOCIRIVRXJY-HDICACEKSA-N 1 1 405.527 3.359 20 0 HGADMO C[NH+]1CCN(C[C@@H]2CCC[C@]3(CCN(c4ncc5ccc(Cl)cc5n4)C3)O2)CC1 ZINC001164884549 721418922 /nfs/dbraw/zinc/41/89/22/721418922.db2.gz DUUYYIXZKGTTSW-SIKLNZKXSA-N 1 1 415.969 3.049 20 0 HGADMO COC(=O)c1cc2c(N3C[C@@H]4C[N@H+](Cc5nccs5)C[C@@H]4C3)[nH]c(Cl)cc-2n1 ZINC001164785519 721419725 /nfs/dbraw/zinc/41/97/25/721419725.db2.gz MZIJHWVWELGWPW-TXEJJXNPSA-N 1 1 417.922 3.028 20 0 HGADMO C[NH+]1CCN(C[C@H]2CCC[C@]3(CCN(c4cc5c(Cl)ccnc5cn4)C3)O2)CC1 ZINC001164892998 721421212 /nfs/dbraw/zinc/42/12/12/721421212.db2.gz ZUXCSUANCPIBOW-VGOFRKELSA-N 1 1 415.969 3.049 20 0 HGADMO C[NH+]1CCN(C[C@@H]2CCC[C@@]3(CCN(c4ccc5nccc(Cl)c5n4)C3)O2)CC1 ZINC001164894925 721429102 /nfs/dbraw/zinc/42/91/02/721429102.db2.gz NKVOIRPTHUHLRH-JTSKRJEESA-N 1 1 415.969 3.049 20 0 HGADMO Cc1c(Cl)cnc(Cl)c1N1CC[C@]2(C1)CCC[C@@H](CN1CC[NH+](C)CC1)O2 ZINC001164892238 721429118 /nfs/dbraw/zinc/42/91/18/721429118.db2.gz HUDWMBZRMNMKFN-JXFKEZNVSA-N 1 1 413.393 3.462 20 0 HGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1nc(C)cc(Cl)n1)CC2 ZINC001164783277 721450025 /nfs/dbraw/zinc/45/00/25/721450025.db2.gz BDRMMOSWJXPZDU-GOSISDBHSA-N 1 1 408.974 3.172 20 0 HGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1nc(C)nc3c1CCC3)CC2 ZINC001164788590 721463992 /nfs/dbraw/zinc/46/39/92/721463992.db2.gz ULOQPDNVGHDWDP-FQEVSTJZSA-N 1 1 414.594 3.008 20 0 HGADMO CCc1cc(CC)nc(N2CCC3(C[C@H](COCC4CC4)[N@@H+](CCOC)C3)CC2)n1 ZINC001164788790 721473132 /nfs/dbraw/zinc/47/31/32/721473132.db2.gz KXGCPRHYXIKMHO-JOCHJYFZSA-N 1 1 416.610 3.335 20 0 HGADMO Clc1ccc(C[NH+]2CCCC2)c(N2Cc3nccn3C[C@@H](Cn3cccn3)C2)n1 ZINC001164897166 721486715 /nfs/dbraw/zinc/48/67/15/721486715.db2.gz RTKBFLZVUIACLI-QGZVFWFLSA-N 1 1 411.941 3.060 20 0 HGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2nc(Cl)nc3[nH]cc(F)c32)[C@H]2CCCO[C@H]12 ZINC001164795896 721525835 /nfs/dbraw/zinc/52/58/35/721525835.db2.gz UOIFHFUYBMSJJN-UXLLHSPISA-N 1 1 416.888 3.014 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2nc(Cl)nc3[nH]cc(F)c32)[C@H]2CCCO[C@H]12 ZINC001164795896 721525840 /nfs/dbraw/zinc/52/58/40/721525840.db2.gz UOIFHFUYBMSJJN-UXLLHSPISA-N 1 1 416.888 3.014 20 0 HGADMO Nc1cc(Cl)ncc1C(F)(F)N1CC[N@H+]2C[C@@H](Oc3cccc(F)c3)C[C@@H]2C1 ZINC001164907715 721536337 /nfs/dbraw/zinc/53/63/37/721536337.db2.gz OCKVSSSIUJDIAW-HIFRSBDPSA-N 1 1 412.843 3.343 20 0 HGADMO Nc1cc(Cl)ncc1C(F)(F)N1CC[N@H+]2C[C@H](Oc3cccc(F)c3)C[C@H]2C1 ZINC001164907713 721536706 /nfs/dbraw/zinc/53/67/06/721536706.db2.gz OCKVSSSIUJDIAW-DZGCQCFKSA-N 1 1 412.843 3.343 20 0 HGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2nc(Cl)nc3c2CSC3)[C@@H]2CCCO[C@H]12 ZINC001164800842 721542910 /nfs/dbraw/zinc/54/29/10/721542910.db2.gz DSXDKKQBVICKLU-KURKYZTESA-N 1 1 417.966 3.140 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2nc(Cl)nc3c2CSC3)[C@@H]2CCCO[C@H]12 ZINC001164800842 721542915 /nfs/dbraw/zinc/54/29/15/721542915.db2.gz DSXDKKQBVICKLU-KURKYZTESA-N 1 1 417.966 3.140 20 0 HGADMO Cc1c[nH]c2nc(Cl)nc(N3C[C@H]([N@H+](C)Cc4cccnc4)[C@H]4OCCC[C@H]43)c12 ZINC001164801468 721543679 /nfs/dbraw/zinc/54/36/79/721543679.db2.gz FKZBGUZVDVKGNU-RYRKJORJSA-N 1 1 412.925 3.183 20 0 HGADMO Cc1c[nH]c2nc(Cl)nc(N3C[C@H]([N@@H+](C)Cc4cccnc4)[C@H]4OCCC[C@H]43)c12 ZINC001164801468 721543682 /nfs/dbraw/zinc/54/36/82/721543682.db2.gz FKZBGUZVDVKGNU-RYRKJORJSA-N 1 1 412.925 3.183 20 0 HGADMO CCOc1cc(Cl)nc(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@H]3OCCC[C@H]32)c1 ZINC001164799057 721550589 /nfs/dbraw/zinc/55/05/89/721550589.db2.gz ALIUVTURERXYMV-LQWHRVPQSA-N 1 1 402.926 3.397 20 0 HGADMO Cc1cc(N2CC[N@H+]3C[C@@H](Oc4cccc(F)c4)C[C@H]3C2)nc(-c2ccccn2)n1 ZINC001164906472 721552560 /nfs/dbraw/zinc/55/25/60/721552560.db2.gz JKGMXHZCICPKSG-ICSRJNTNSA-N 1 1 405.477 3.328 20 0 HGADMO Cc1cc(N2CC[N@H+]3C[C@@H](Oc4cccc(F)c4)C[C@@H]3C2)nc(-c2ccccn2)n1 ZINC001164906474 721552929 /nfs/dbraw/zinc/55/29/29/721552929.db2.gz JKGMXHZCICPKSG-QUCCMNQESA-N 1 1 405.477 3.328 20 0 HGADMO CCOC(=O)c1c(C)cc(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@@H]32)nc1C ZINC001164805407 721562768 /nfs/dbraw/zinc/56/27/68/721562768.db2.gz NRVPBORBNQNGEZ-SXWKCWPCSA-N 1 1 424.545 3.138 20 0 HGADMO Cc1cc(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@H]3OCCC[C@H]32)nc(-c2ccccn2)n1 ZINC001164809839 721576072 /nfs/dbraw/zinc/57/60/72/721576072.db2.gz XMGDGDJFAFACQW-GIWBLDEGSA-N 1 1 416.529 3.110 20 0 HGADMO Cc1cc(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@H]3OCCC[C@@H]32)nc(-c2ccco2)n1 ZINC001164810807 721583040 /nfs/dbraw/zinc/58/30/40/721583040.db2.gz WFPJQSUCLXTHOI-IPJJNNNSSA-N 1 1 405.502 3.308 20 0 HGADMO COC(=O)c1cccc(N2CCC(F)(F)[C@@]3(CC[N@@H+](Cc4ccccn4)C3)C2)n1 ZINC001164906188 721584798 /nfs/dbraw/zinc/58/47/98/721584798.db2.gz LXSYBBQAXTUTBT-HXUWFJFHSA-N 1 1 402.445 3.001 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2nc(C3CC3)nc3[nH]ccc32)[C@H]2CCCO[C@H]12 ZINC001164805663 721588741 /nfs/dbraw/zinc/58/87/41/721588741.db2.gz LKDPEGSNEXMNGU-ZCNNSNEGSA-N 1 1 404.518 3.099 20 0 HGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2cncc(OCC3CCCC3)n2)[C@@H]2CCCO[C@@H]12 ZINC001164802592 721589384 /nfs/dbraw/zinc/58/93/84/721589384.db2.gz GXUBRQUDCREVOX-PQNGQFLHSA-N 1 1 423.561 3.309 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2cncc(OCC3CCCC3)n2)[C@@H]2CCCO[C@@H]12 ZINC001164802592 721589386 /nfs/dbraw/zinc/58/93/86/721589386.db2.gz GXUBRQUDCREVOX-PQNGQFLHSA-N 1 1 423.561 3.309 20 0 HGADMO COc1cc(C)c2ncnc(N3C[C@H]([N@@H+](C)Cc4cccnc4)[C@@H]4OCCC[C@H]43)c2c1 ZINC001164804099 721592150 /nfs/dbraw/zinc/59/21/50/721592150.db2.gz INMVVMJMZHGDBI-FUPPJEDESA-N 1 1 419.529 3.210 20 0 HGADMO C[N@H+](Cc1ccco1)Cc1cncc2c1CCN(c1nc(Cl)ccc1C(N)=O)C2 ZINC001164909047 721755338 /nfs/dbraw/zinc/75/53/38/721755338.db2.gz DOGYYISAIDEXGR-UHFFFAOYSA-N 1 1 411.893 3.017 20 0 HGADMO C[N@@H+](Cc1ccco1)Cc1cncc2c1CCN(c1nc(Cl)ccc1C(N)=O)C2 ZINC001164909047 721755339 /nfs/dbraw/zinc/75/53/39/721755339.db2.gz DOGYYISAIDEXGR-UHFFFAOYSA-N 1 1 411.893 3.017 20 0 HGADMO C[N@H+](Cc1ccco1)Cc1cncc2c1CCN(c1cc(OCC3CC3)ncn1)C2 ZINC001164911735 721756667 /nfs/dbraw/zinc/75/66/67/721756667.db2.gz YEZAPFWECSSVHC-UHFFFAOYSA-N 1 1 405.502 3.448 20 0 HGADMO C[N@@H+](Cc1ccco1)Cc1cncc2c1CCN(c1cc(OCC3CC3)ncn1)C2 ZINC001164911735 721756673 /nfs/dbraw/zinc/75/66/73/721756673.db2.gz YEZAPFWECSSVHC-UHFFFAOYSA-N 1 1 405.502 3.448 20 0 HGADMO CCOC(=O)c1cnc(N2C[C@@H]3CCC[C@@H]([N@@H+](C)Cc4ccccn4)[C@@H]3C2)nc1C ZINC001165025471 721810273 /nfs/dbraw/zinc/81/02/73/721810273.db2.gz MWVDNYQTEMUXPH-IOMROCGXSA-N 1 1 409.534 3.094 20 0 HGADMO C[C@@H]1CC(=O)Nc2ncnc(N3C[C@@H]4CCC[C@@H]([N@@H+](C)Cc5ccccn5)[C@H]4C3)c21 ZINC001165026519 721813553 /nfs/dbraw/zinc/81/35/53/721813553.db2.gz QYQFXNDNSOYREK-KCITZHQASA-N 1 1 406.534 3.054 20 0 HGADMO CC(C)c1nc(N(C)C)nc(N2C[C@@H]3CCC[C@@H]([N@@H+](C)Cc4ccccn4)[C@@H]3C2)n1 ZINC001165024246 721816810 /nfs/dbraw/zinc/81/68/10/721816810.db2.gz KBUGMTBEPCBOIT-DFQSSKMNSA-N 1 1 409.582 3.193 20 0 HGADMO C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@H]2CN(c3nc(Cl)cc4c3CNC4=O)C[C@H]21 ZINC001165028988 721817211 /nfs/dbraw/zinc/81/72/11/721817211.db2.gz YLDNPMWITLWBQA-GDIGMMSISA-N 1 1 411.937 3.110 20 0 HGADMO Cc1cn(-c2ccc(N3C[C@@H]4CCC[C@@H]([N@@H+](C)Cc5ccccn5)[C@@H]4C3)nn2)cn1 ZINC001165027136 721818304 /nfs/dbraw/zinc/81/83/04/721818304.db2.gz SKJOLPHPLDKSLP-CEWLAPEOSA-N 1 1 403.534 3.103 20 0 HGADMO CN(C)CC[N@H+]1CC[C@@H]2[C@H]1CCN2c1nc(-c2ccccc2)nc(-c2ccccc2)n1 ZINC001164924075 721861293 /nfs/dbraw/zinc/86/12/93/721861293.db2.gz BSHYMQJXEVDRHB-FGZHOGPDSA-N 1 1 414.557 3.420 20 0 HGADMO C[NH+](C)CCN1CC[C@@H]2[C@H]1CCN2c1nc(-c2ccccc2)nc(-c2ccccc2)n1 ZINC001164924075 721861294 /nfs/dbraw/zinc/86/12/94/721861294.db2.gz BSHYMQJXEVDRHB-FGZHOGPDSA-N 1 1 414.557 3.420 20 0 HGADMO CN(C)CC[N@@H+]1CC[C@@H]2[C@@H]1CCN2[C@@H](F)Oc1cccc(-c2ccc(Cl)nn2)c1 ZINC001164935077 721883850 /nfs/dbraw/zinc/88/38/50/721883850.db2.gz VQOUEYJSAKYDIN-QKNQBKEWSA-N 1 1 419.932 3.139 20 0 HGADMO CN(C)CC[N@H+]1CC[C@@H]2[C@@H]1CCN2[C@@H](F)Oc1cccc(-c2ccc(Cl)nn2)c1 ZINC001164935077 721883851 /nfs/dbraw/zinc/88/38/51/721883851.db2.gz VQOUEYJSAKYDIN-QKNQBKEWSA-N 1 1 419.932 3.139 20 0 HGADMO CN(C)CC[N@H+]1CC[C@@H]2[C@H]1CCN2c1cc(-c2nc(-c3cccs3)no2)ccn1 ZINC001164934190 721884879 /nfs/dbraw/zinc/88/48/79/721884879.db2.gz QEOMQLWDJQDCBK-IAGOWNOFSA-N 1 1 410.547 3.075 20 0 HGADMO C[NH+](C)CCN1CC[C@@H]2[C@H]1CCN2c1cc(-c2nc(-c3cccs3)no2)ccn1 ZINC001164934190 721884881 /nfs/dbraw/zinc/88/48/81/721884881.db2.gz QEOMQLWDJQDCBK-IAGOWNOFSA-N 1 1 410.547 3.075 20 0 HGADMO CN(C)CC[N@@H+]1CC[C@H]2[C@H]1CCN2c1cnc(Cl)nc1Oc1cccc(F)c1 ZINC001164931850 721888235 /nfs/dbraw/zinc/88/82/35/721888235.db2.gz GGYIWJVSYKWUKJ-SJORKVTESA-N 1 1 405.905 3.276 20 0 HGADMO CN(C)CC[N@H+]1CC[C@H]2[C@H]1CCN2c1cnc(Cl)nc1Oc1cccc(F)c1 ZINC001164931850 721888236 /nfs/dbraw/zinc/88/82/36/721888236.db2.gz GGYIWJVSYKWUKJ-SJORKVTESA-N 1 1 405.905 3.276 20 0 HGADMO COc1ccccc1Oc1nc(Cl)ncc1N1CC[C@@H]2[C@@H]1CC[N@@H+]2CCN(C)C ZINC001164934413 721889246 /nfs/dbraw/zinc/88/92/46/721889246.db2.gz RLNUGAATSIFHJM-CVEARBPZSA-N 1 1 417.941 3.146 20 0 HGADMO COc1ccccc1Oc1nc(Cl)ncc1N1CC[C@@H]2[C@@H]1CC[N@H+]2CCN(C)C ZINC001164934413 721889248 /nfs/dbraw/zinc/88/92/48/721889248.db2.gz RLNUGAATSIFHJM-CVEARBPZSA-N 1 1 417.941 3.146 20 0 HGADMO Cc1sc2nc(C[NH+]3CCCCC3)nc(N3CC[C@@H]4[C@H]3CCC(=O)N4C)c2c1C ZINC001164930043 721893256 /nfs/dbraw/zinc/89/32/56/721893256.db2.gz BHINBPYVTBNCRP-IAGOWNOFSA-N 1 1 413.591 3.494 20 0 HGADMO Cc1nc2ccc(N3CCC4(CC3)C[N@@H+](Cc3ccc(C)cc3)CCO4)nc2n1C ZINC001164940493 721925888 /nfs/dbraw/zinc/92/58/88/721925888.db2.gz RSUBJORVNMBIQE-UHFFFAOYSA-N 1 1 405.546 3.457 20 0 HGADMO O=C1NCC[N@@H+](Cc2ccccc2)C12CCN(c1nccc3c(F)cccc31)CC2 ZINC001164948129 721975291 /nfs/dbraw/zinc/97/52/91/721975291.db2.gz TXPOKTPQWVRXGD-UHFFFAOYSA-N 1 1 404.489 3.345 20 0 HGADMO O=C1NCC[N@H+](Cc2ccccc2)C12CCN(c1nccc3c(F)cccc31)CC2 ZINC001164948129 721975295 /nfs/dbraw/zinc/97/52/95/721975295.db2.gz TXPOKTPQWVRXGD-UHFFFAOYSA-N 1 1 404.489 3.345 20 0 HGADMO CC(C)(C)Oc1cccc(N2CCC3(CC2)C(=O)NCC[N@H+]3Cc2ccccc2)n1 ZINC001164945136 721975822 /nfs/dbraw/zinc/97/58/22/721975822.db2.gz DMKHXIYWSKTTOB-UHFFFAOYSA-N 1 1 408.546 3.230 20 0 HGADMO CC(C)(C)Oc1cccc(N2CCC3(CC2)C(=O)NCC[N@@H+]3Cc2ccccc2)n1 ZINC001164945136 721975825 /nfs/dbraw/zinc/97/58/25/721975825.db2.gz DMKHXIYWSKTTOB-UHFFFAOYSA-N 1 1 408.546 3.230 20 0 HGADMO COC(=O)CSc1cccc(N2CCC3(CC[N@@H+](Cc4cccnc4)C3)CC2)n1 ZINC001164955231 722020587 /nfs/dbraw/zinc/02/05/87/722020587.db2.gz AZIOZPVOKDCZFU-UHFFFAOYSA-N 1 1 412.559 3.234 20 0 HGADMO Clc1cc(Cl)c(N2CCC3(CC2)COCC[N@@H+](Cc2ccncc2)C3)nn1 ZINC001164960525 722052652 /nfs/dbraw/zinc/05/26/52/722052652.db2.gz RHTAZFUSTZJXAV-UHFFFAOYSA-N 1 1 408.333 3.297 20 0 HGADMO Clc1cnc(Cl)nc1N1CCC2(CC1)COCC[N@@H+](Cc1ccncc1)C2 ZINC001164960452 722052781 /nfs/dbraw/zinc/05/27/81/722052781.db2.gz NUCXVEJQPWRQSP-UHFFFAOYSA-N 1 1 408.333 3.297 20 0 HGADMO FC(F)(c1cnc(Cl)nc1)N1CCC2(CC1)COCC[N@@H+](Cc1ccncc1)C2 ZINC001164958712 722053487 /nfs/dbraw/zinc/05/34/87/722053487.db2.gz FOYBEZBINSIDBF-UHFFFAOYSA-N 1 1 423.895 3.189 20 0 HGADMO Fc1cccc2ncnc(N3CCC4(CC3)COCC[N@@H+](Cc3ccncc3)C4)c12 ZINC001164963838 722056546 /nfs/dbraw/zinc/05/65/46/722056546.db2.gz NIAFKNGPUQPOQF-UHFFFAOYSA-N 1 1 407.493 3.283 20 0 HGADMO Clc1nnc(N2CCC3(CC2)COCC[N@@H+](Cc2ccncc2)C3)c2occc21 ZINC001164963316 722057666 /nfs/dbraw/zinc/05/76/66/722057666.db2.gz WPHRUCQKTFEHOP-UHFFFAOYSA-N 1 1 413.909 3.390 20 0 HGADMO CC(C)OC(=O)c1cccnc1N1CCC2(CC1)COCC[N@@H+](Cc1ccncc1)C2 ZINC001164966463 722061838 /nfs/dbraw/zinc/06/18/38/722061838.db2.gz UNJAJCUMLPSKNK-UHFFFAOYSA-N 1 1 424.545 3.161 20 0 HGADMO Cc1cc(Cl)nc(C(F)(F)N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)n1 ZINC001164977251 722101628 /nfs/dbraw/zinc/10/16/28/722101628.db2.gz FKEPTOAWBBMNOF-SJORKVTESA-N 1 1 423.895 3.106 20 0 HGADMO Cc1nc(Cl)cc(C(F)(F)N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)n1 ZINC001164985294 722105560 /nfs/dbraw/zinc/10/55/60/722105560.db2.gz WGTJXLIJJFZDAL-DLBZAZTESA-N 1 1 423.895 3.106 20 0 HGADMO COc1ccc2nc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)ccc2c1 ZINC001164971934 722109691 /nfs/dbraw/zinc/10/96/91/722109691.db2.gz DUHCXFKFPVORPT-NFBKMPQASA-N 1 1 404.514 3.366 20 0 HGADMO Clc1nc2ccccc2nc1N1CC[C@@H]2C[N@@H+](Cc3cccnc3)CCO[C@H]2C1 ZINC001164972576 722110854 /nfs/dbraw/zinc/11/08/54/722110854.db2.gz GBGDLZYDYDLCRI-XLIONFOSSA-N 1 1 409.921 3.406 20 0 HGADMO Clc1ncnc2scc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)c21 ZINC001164974087 722110868 /nfs/dbraw/zinc/11/08/68/722110868.db2.gz ILJLCQFZKBKCNA-NVXWUHKLSA-N 1 1 415.950 3.467 20 0 HGADMO CCOc1cc(Cl)nc(N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)c1 ZINC001164981523 722114527 /nfs/dbraw/zinc/11/45/27/722114527.db2.gz ULVPKFUMFIWVRM-HKUYNNGSSA-N 1 1 402.926 3.256 20 0 HGADMO CCc1c(Cl)nnc(N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)c1CC ZINC001164980410 722119804 /nfs/dbraw/zinc/11/98/04/722119804.db2.gz RDBQBYGFHZKXFF-FXAWDEMLSA-N 1 1 415.969 3.377 20 0 HGADMO CCCN(CCC)c1cc(N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)ncn1 ZINC001164975196 722131306 /nfs/dbraw/zinc/13/13/06/722131306.db2.gz FNBQVZQZRGRNNN-VXKWHMMOSA-N 1 1 424.593 3.225 20 0 HGADMO CCCN(CCC)c1cc(N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)ncn1 ZINC001164975195 722131484 /nfs/dbraw/zinc/13/14/84/722131484.db2.gz FNBQVZQZRGRNNN-FGZHOGPDSA-N 1 1 424.593 3.225 20 0 HGADMO Fc1ccc(-c2ccc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)nn2)cc1 ZINC001164976124 722145663 /nfs/dbraw/zinc/14/56/63/722145663.db2.gz HGYTXDWOHLMPFG-REWPJTCUSA-N 1 1 419.504 3.405 20 0 HGADMO COc1cccc2c1ccnc2N1CC[C@H]2C[N@@H+](Cc3cccnc3)CCO[C@H]2C1 ZINC001164972815 722146443 /nfs/dbraw/zinc/14/64/43/722146443.db2.gz ARYLSBFNYSQPFK-CVDCTZTESA-N 1 1 404.514 3.366 20 0 HGADMO CCc1nc2sccc2c(N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)n1 ZINC001164980957 722150453 /nfs/dbraw/zinc/15/04/53/722150453.db2.gz OFZWXTHKQZPEDM-MJGOQNOKSA-N 1 1 409.559 3.376 20 0 HGADMO Clc1nc2c(nc1N1CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C1)CCCC2 ZINC001164975280 722156757 /nfs/dbraw/zinc/15/67/57/722156757.db2.gz QUKISTNIOSXOIB-YLJYHZDGSA-N 1 1 413.953 3.131 20 0 HGADMO COC(OC)c1c(CO)ccnc1N1CCC[C@]2(CC[N@H+]2Cc2cccc(F)c2)C1 ZINC001164997253 722205636 /nfs/dbraw/zinc/20/56/36/722205636.db2.gz XQFQBZKFEBBYHV-QHCPKHFHSA-N 1 1 415.509 3.249 20 0 HGADMO COC(=O)c1cc2cnc(N3CCC[C@@]4(CC[N@H+]4Cc4cccc(F)c4)C3)nc2n1C ZINC001164997311 722207081 /nfs/dbraw/zinc/20/70/81/722207081.db2.gz ZBZWXFYZEIRPBM-HSZRJFAPSA-N 1 1 423.492 3.139 20 0 HGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2CCO[C@@H]3C[C@H](C(=O)NC(C)C)C[C@H]32)nc1 ZINC001164997856 722216754 /nfs/dbraw/zinc/21/67/54/722216754.db2.gz SMXIPZSKMWHYGF-XRXFAXGQSA-N 1 1 400.567 3.137 20 0 HGADMO CC(C)CN1c2ccccc2[C@@H]2CN(c3ccnc(N4CC[NH+](C)CC4)n3)CC[C@H]21 ZINC001165005693 722245557 /nfs/dbraw/zinc/24/55/57/722245557.db2.gz VQQMAPZVKSQTAQ-RBBKRZOGSA-N 1 1 406.578 3.067 20 0 HGADMO OC[C@H](Cc1ccccc1)[NH2+]Cc1c(Br)cncc1Br ZINC000394535313 1126080318 /nfs/dbraw/zinc/08/03/18/1126080318.db2.gz RHIUWIFDNASGCD-LBPRGKRZSA-N 1 1 400.114 3.300 20 0 HGADMO COc1ccc(C[C@@](C)(CO)[NH2+]Cc2nc3ccccn3c2Br)cc1 ZINC001474697695 1126205004 /nfs/dbraw/zinc/20/50/04/1126205004.db2.gz CDEQBNOGYUTYRH-IBGZPJMESA-N 1 1 404.308 3.189 20 0 HGADMO Cc1nn(-c2ccncc2)cc1C[N@@H+]1C[C@H]2CCC[C@@]2(c2nc(CC3CC3)no2)C1 ZINC000328603880 569294164 /nfs/dbraw/zinc/29/41/64/569294164.db2.gz HHWXWIGIGDRDCN-AUSIDOKSSA-N 1 1 404.518 3.465 20 0 HGADMO Cc1nn(-c2ccncc2)cc1C[N@H+]1C[C@H]2CCC[C@@]2(c2nc(CC3CC3)no2)C1 ZINC000328603880 569294165 /nfs/dbraw/zinc/29/41/65/569294165.db2.gz HHWXWIGIGDRDCN-AUSIDOKSSA-N 1 1 404.518 3.465 20 0 HGADMO CCOC(=O)Cc1nc(Cl)cc(N2CCC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)n1 ZINC001164626796 719073860 /nfs/dbraw/zinc/07/38/60/719073860.db2.gz PJHCZANCBITQRX-MSOLQXFVSA-N 1 1 414.937 3.336 20 0 HGADMO CCOC(=O)Cc1nc(Cl)cc(N2CCC[C@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)n1 ZINC001164626802 719074054 /nfs/dbraw/zinc/07/40/54/719074054.db2.gz PJHCZANCBITQRX-ROUUACIJSA-N 1 1 414.937 3.336 20 0 HGADMO CCOC(=O)[C@@H]1CCc2nnc(N3CCC[C@H]4C[N@@H+](Cc5ccccc5)C[C@@H]43)cc2C1 ZINC001164629041 719112448 /nfs/dbraw/zinc/11/24/48/719112448.db2.gz QOBFQRVLXYLVEY-QTEQDKRBSA-N 1 1 420.557 3.245 20 0 HGADMO CCOC(=O)[C@@H]1CCc2nnc(N3CCC[C@H]4C[N@@H+](Cc5ccccc5)C[C@H]43)cc2C1 ZINC001164629044 719113418 /nfs/dbraw/zinc/11/34/18/719113418.db2.gz QOBFQRVLXYLVEY-ZRCGQRJVSA-N 1 1 420.557 3.245 20 0 HGADMO COc1cc2ncc(N3CCc4c(C[NH+](C)C)nn(C(C)C)c4C3)nc2cc1OC ZINC001164650446 719310238 /nfs/dbraw/zinc/31/02/38/719310238.db2.gz YJBBGKGNUMVHJG-UHFFFAOYSA-N 1 1 410.522 3.049 20 0 HGADMO CNC(=O)C[N@H+]1CCCC12CCN(C(F)(F)c1ccc(Cl)nc1Cl)CC2 ZINC001164686108 719700934 /nfs/dbraw/zinc/70/09/34/719700934.db2.gz XASJXDFRUNFXGU-UHFFFAOYSA-N 1 1 407.292 3.114 20 0 HGADMO CNC(=O)C[N@H+]1CCCC12CCN(c1nc(Cl)cc3cc(OC)ccc31)CC2 ZINC001164687242 719732904 /nfs/dbraw/zinc/73/29/04/719732904.db2.gz VHVNXVZAMGYJCI-UHFFFAOYSA-N 1 1 402.926 3.078 20 0 HGADMO CNC(=O)C[N@H+]1CCCC12CCN(c1cncc(Sc3cccc(C)c3)n1)CC2 ZINC001164685987 719734405 /nfs/dbraw/zinc/73/44/05/719734405.db2.gz OBGDWQFXBULYMB-UHFFFAOYSA-N 1 1 411.575 3.117 20 0 HGADMO Cc1nc(C[N@@H+]2CCCC23CCN(c2ccc(C(=O)OC(C)C)nn2)CC3)cs1 ZINC001164691840 719805768 /nfs/dbraw/zinc/80/57/68/719805768.db2.gz KUCBSYNPOAQIBE-UHFFFAOYSA-N 1 1 415.563 3.442 20 0 HGADMO COC(=O)[C@@]1(C)C[C@H]([NH+]2CCOCC2)CCN1c1cc(F)cc2ccc(Cl)nc21 ZINC001164704713 719855151 /nfs/dbraw/zinc/85/51/51/719855151.db2.gz SLNIYNQBDRPONI-IIBYNOLFSA-N 1 1 421.900 3.260 20 0 HGADMO COC(=O)[C@]1(C)C[C@@H]([NH+]2CCOCC2)CCN1c1nccc2cccc(Cl)c21 ZINC001164700177 719856596 /nfs/dbraw/zinc/85/65/96/719856596.db2.gz HAZLPADUYGDIRG-KKSFZXQISA-N 1 1 403.910 3.121 20 0 HGADMO CCOC(=O)c1ccc(C)c(N2CCC3(CC2)C[N@@H+](Cc2cccs2)CCO3)n1 ZINC001164700867 719886133 /nfs/dbraw/zinc/88/61/33/719886133.db2.gz MLPAESPXXNVYKN-UHFFFAOYSA-N 1 1 415.559 3.500 20 0 HGADMO CCOC(=O)c1ccc(N2CCC3(CC2)C[N@@H+](Cc2cccs2)CCO3)nc1 ZINC001164705385 719886565 /nfs/dbraw/zinc/88/65/65/719886565.db2.gz YVRYKRMRJLVBLC-UHFFFAOYSA-N 1 1 401.532 3.191 20 0 HGADMO S=c1nc2[nH]cnc(N3CCC4(CC3)C[N@H+](Cc3cccs3)CCO4)c-2s1 ZINC001164696189 719897025 /nfs/dbraw/zinc/89/70/25/719897025.db2.gz BAFCUUDVNMYCRC-UHFFFAOYSA-N 1 1 419.601 3.308 20 0 HGADMO S=c1nc2[nH]cnc(N3CCC4(CC3)C[N@@H+](Cc3cccs3)CCO4)c-2s1 ZINC001164696189 719897026 /nfs/dbraw/zinc/89/70/26/719897026.db2.gz BAFCUUDVNMYCRC-UHFFFAOYSA-N 1 1 419.601 3.308 20 0 HGADMO F[C@H](Oc1cncc(Cl)n1)N1CCC2(CC1)C[N@@H+](Cc1cccs1)CCO2 ZINC001164707350 719904884 /nfs/dbraw/zinc/90/48/84/719904884.db2.gz QDPOEZVPUDQWOZ-KRWDZBQOSA-N 1 1 412.918 3.190 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(C(F)(F)c1cc(Cl)nc(OC)c1)C2 ZINC001164811402 720079743 /nfs/dbraw/zinc/07/97/43/720079743.db2.gz OGKGWXLTVCNLSA-LPHOPBHVSA-N 1 1 415.912 3.473 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1nc(Cl)nc3c1CSCC3)C2 ZINC001164811657 720082322 /nfs/dbraw/zinc/08/23/22/720082322.db2.gz OTHCTKPLMUWYMJ-FOIQADDNSA-N 1 1 408.999 3.104 20 0 HGADMO CCOC(=O)c1c(C)nc(Cl)cc1N1CC[C@]2(C1)C[N@@H+](CC1CC1)C[C@@H]2COC ZINC001164809755 720097611 /nfs/dbraw/zinc/09/76/11/720097611.db2.gz JXZIUWCJWLXVTA-VGOFRKELSA-N 1 1 421.969 3.405 20 0 HGADMO CCOC(=O)c1cc(Cl)nc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COC)c1C ZINC001164811583 720113301 /nfs/dbraw/zinc/11/33/01/720113301.db2.gz MOQTTZBEPWQGEY-VGOFRKELSA-N 1 1 421.969 3.405 20 0 HGADMO CCOC(=O)c1cnc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COC)c(Cl)c1 ZINC001164808507 720121908 /nfs/dbraw/zinc/12/19/08/720121908.db2.gz FKFOJGMULNEVJF-DYESRHJHSA-N 1 1 407.942 3.096 20 0 HGADMO COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1cc(OCC3CC3)ncn1)CC2 ZINC001164716952 720125387 /nfs/dbraw/zinc/12/53/87/720125387.db2.gz MDRNTMCESKHPAO-NRFANRHFSA-N 1 1 423.561 3.168 20 0 HGADMO CCCSc1ncnc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COC)c1OC ZINC001164812952 720200103 /nfs/dbraw/zinc/20/01/03/720200103.db2.gz NJWFQCURLJXEFK-UWJYYQICSA-N 1 1 406.596 3.172 20 0 HGADMO COc1cccc2ccc(N3CCCn4c(=O)cc(C[N@@H+](C)C(C)C)nc4C3)nc21 ZINC001164811354 720216247 /nfs/dbraw/zinc/21/62/47/720216247.db2.gz GKSOCISEEFEBNK-UHFFFAOYSA-N 1 1 407.518 3.051 20 0 HGADMO Cc1nc(C2CC2)nc(Cl)c1N1CCCn2c(=O)cc(C[N@H+](C)C(C)C)nc2C1 ZINC001164813893 720237991 /nfs/dbraw/zinc/23/79/91/720237991.db2.gz QYXYPDZNSSNSBZ-UHFFFAOYSA-N 1 1 416.957 3.123 20 0 HGADMO O=C(NC1CCCCC1)c1cccnc1N1CC[C@@H]2[C@@H]1CC[N@H+]2Cc1cccnc1 ZINC001164721720 720341468 /nfs/dbraw/zinc/34/14/68/720341468.db2.gz DBXPIXKMWKATFP-YADHBBJMSA-N 1 1 405.546 3.392 20 0 HGADMO O=C(NCc1ccccc1)c1cccnc1N1CC[C@H]2[C@H]1CC[N@H+]2Cc1cccnc1 ZINC001164729819 720342367 /nfs/dbraw/zinc/34/23/67/720342367.db2.gz YIRQRCWYTQYXOM-XZOQPEGZSA-N 1 1 413.525 3.260 20 0 HGADMO CCOC(=O)c1cc2cccnc2nc1N1CC[C@@H]2[C@@H]1CC[N@H+]2Cc1cccnc1 ZINC001164725399 720380543 /nfs/dbraw/zinc/38/05/43/720380543.db2.gz NFOLIKPSHNJBMZ-UXHICEINSA-N 1 1 403.486 3.055 20 0 HGADMO CN(C)c1ccc(-c2ccnc(N3CC[C@@H]4[C@H]3CC[N@H+]4Cc3cccnc3)n2)cc1 ZINC001164732819 720420698 /nfs/dbraw/zinc/42/06/98/720420698.db2.gz OINXKEGMBDRKQV-DHIUTWEWSA-N 1 1 400.530 3.458 20 0 HGADMO FC(F)(c1cnc2c(Cl)ncnc2c1)N1CC[C@@H]2[C@H]1CC[N@@H+]2Cc1cccnc1 ZINC001164735358 720422448 /nfs/dbraw/zinc/42/24/48/720422448.db2.gz WOFQFJYLLHVVCV-IAGOWNOFSA-N 1 1 416.863 3.471 20 0 HGADMO FC(F)(c1cnc2c(Cl)ncnc2c1)N1CC[C@@H]2[C@H]1CC[N@H+]2Cc1cccnc1 ZINC001164735358 720422456 /nfs/dbraw/zinc/42/24/56/720422456.db2.gz WOFQFJYLLHVVCV-IAGOWNOFSA-N 1 1 416.863 3.471 20 0 HGADMO COc1ccc(-c2ccc(N3CC[C@H]4[C@@H]3CC[N@H+]4Cc3cccnc3)nn2)c(OC)c1 ZINC001164735367 720458451 /nfs/dbraw/zinc/45/84/51/720458451.db2.gz WQXFFJDUPXAMDD-VXKWHMMOSA-N 1 1 417.513 3.409 20 0 HGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@H]2CN(c3ccc(N4CCCCC4)nn3)CC[C@@H]21 ZINC001164837843 720506660 /nfs/dbraw/zinc/50/66/60/720506660.db2.gz PVIKICNYKMPELW-ACRUOGEOSA-N 1 1 409.582 3.041 20 0 HGADMO CCOC(=O)/C=C\c1cccnc1N1CC[C@@H]2[C@H](C[C@H](Cn3cccn3)[N@H+]2C(C)C)C1 ZINC001164832352 720511853 /nfs/dbraw/zinc/51/18/53/720511853.db2.gz ACAZYTDGOPHQRA-YKSGUZFKSA-N 1 1 423.561 3.232 20 0 HGADMO COC(=O)c1cc(Cl)cc(N2CC[C@@H]3[C@@H](C[C@H](Cn4cccn4)[N@H+]3C(C)C)C2)n1 ZINC001164834017 720520396 /nfs/dbraw/zinc/52/03/96/720520396.db2.gz FDYGIGISHSOWSQ-KVSKMBFKSA-N 1 1 417.941 3.096 20 0 HGADMO COc1ccc2cnc(N3CC[C@@H]4[C@H](C[C@H](Cn5cccn5)[N@H+]4C(C)C)C3)nc2c1 ZINC001164839432 720526185 /nfs/dbraw/zinc/52/61/85/720526185.db2.gz UGRJUSKBFMNTQS-WOIUINJBSA-N 1 1 406.534 3.213 20 0 HGADMO COc1nc(Cl)nc(C)c1N1CC[C@@H]2[C@H](C[C@H](Cn3cccn3)[N@H+]2C(C)C)C1 ZINC001164841466 720545148 /nfs/dbraw/zinc/54/51/48/720545148.db2.gz WAMKGHAHTPPYQX-BRWVUGGUSA-N 1 1 404.946 3.021 20 0 HGADMO CC(C)[N@@H+]1[C@@H]2CCN(c3ccnc(N4CCCCC4)n3)C[C@@H]2C[C@H]1Cn1cccn1 ZINC001164844154 720598871 /nfs/dbraw/zinc/59/88/71/720598871.db2.gz ZHHFYLNMTOMTQA-PCCBWWKXSA-N 1 1 409.582 3.041 20 0 HGADMO Cc1noc(-c2cccnc2N2CC[C@@H]3[C@H](C[C@@H](Cn4cccn4)[N@@H+]3C(C)C)C2)n1 ZINC001164837286 720607556 /nfs/dbraw/zinc/60/75/56/720607556.db2.gz HWOHTTQLFNSUOX-WSTZPKSXSA-N 1 1 407.522 3.014 20 0 HGADMO FC(F)(c1cnc(Cl)c(Cl)c1)N1CC[N@@H+]2C[C@H](Oc3cncnc3)C[C@H]2C1 ZINC001164746987 720618730 /nfs/dbraw/zinc/61/87/30/720618730.db2.gz YUZOUNQHQREHBH-QWHCGFSZSA-N 1 1 416.259 3.065 20 0 HGADMO FC(F)(c1cnc(Cl)c(Cl)c1)N1CC[N@H+]2C[C@H](Oc3cncnc3)C[C@H]2C1 ZINC001164746987 720618742 /nfs/dbraw/zinc/61/87/42/720618742.db2.gz YUZOUNQHQREHBH-QWHCGFSZSA-N 1 1 416.259 3.065 20 0 HGADMO FC(F)(c1cc(Cl)nc(Cl)c1)N1CC[N@@H+]2C[C@H](Oc3cncnc3)C[C@H]2C1 ZINC001164746287 720621571 /nfs/dbraw/zinc/62/15/71/720621571.db2.gz WXYFQJZNAZLETI-QWHCGFSZSA-N 1 1 416.259 3.065 20 0 HGADMO FC(F)(c1cc(Cl)nc(Cl)c1)N1CC[N@H+]2C[C@H](Oc3cncnc3)C[C@H]2C1 ZINC001164746287 720621592 /nfs/dbraw/zinc/62/15/92/720621592.db2.gz WXYFQJZNAZLETI-QWHCGFSZSA-N 1 1 416.259 3.065 20 0 HGADMO FC(F)(c1cc(Cl)cnc1Cl)N1CC[N@@H+]2C[C@@H](Oc3cncnc3)C[C@@H]2C1 ZINC001164746895 720627898 /nfs/dbraw/zinc/62/78/98/720627898.db2.gz YOOWIBOTUQCTJH-OLZOCXBDSA-N 1 1 416.259 3.065 20 0 HGADMO FC(F)(c1cc(Cl)cnc1Cl)N1CC[N@H+]2C[C@@H](Oc3cncnc3)C[C@@H]2C1 ZINC001164746895 720627910 /nfs/dbraw/zinc/62/79/10/720627910.db2.gz YOOWIBOTUQCTJH-OLZOCXBDSA-N 1 1 416.259 3.065 20 0 HGADMO Clc1ccc2nc(N3CC[N@H+]4C[C@H](Oc5cncnc5)C[C@@H]4C3)c(Cl)nc2c1 ZINC001164737838 720671866 /nfs/dbraw/zinc/67/18/66/720671866.db2.gz HIDWSBLCINBWQK-ZIAGYGMSSA-N 1 1 417.300 3.069 20 0 HGADMO COC(=O)c1ccnc(N2CCC3(C[C@H]([N@@H+](C)Cc4ccccc4)CO3)CC2)c1C ZINC001164837058 720676418 /nfs/dbraw/zinc/67/64/18/720676418.db2.gz AZWDYUGHJBALAM-FQEVSTJZSA-N 1 1 409.530 3.437 20 0 HGADMO C[N@@H+](Cc1ccccc1)[C@H]1COC2(C1)CCN(c1nc(Cl)ccc1C(N)=O)CC2 ZINC001164841823 720692018 /nfs/dbraw/zinc/69/20/18/720692018.db2.gz JDRGNKBEXQNNBC-QGZVFWFLSA-N 1 1 414.937 3.094 20 0 HGADMO Clc1cccc2nc(Cl)nc(N3CC[N@H+]4C[C@@H](Oc5cncnc5)C[C@H]4C3)c12 ZINC001164737955 720695244 /nfs/dbraw/zinc/69/52/44/720695244.db2.gz HWMBHCURWKQZQC-STQMWFEESA-N 1 1 417.300 3.069 20 0 HGADMO CCCNC(=O)c1ccc(N2CCC3(C[C@@H]([N@@H+](C)Cc4ccccc4)CO3)CC2)nc1 ZINC001164841584 720713411 /nfs/dbraw/zinc/71/34/11/720713411.db2.gz USPPEXQUSYHHLL-JOCHJYFZSA-N 1 1 422.573 3.481 20 0 HGADMO Cc1cccc(Sc2cncc(N3CC[N@H+]4C[C@H](Oc5cncnc5)C[C@H]4C3)n2)c1 ZINC001164739901 720742193 /nfs/dbraw/zinc/74/21/93/720742193.db2.gz JLSZRIOXIDBJJG-ZWKOTPCHSA-N 1 1 420.542 3.068 20 0 HGADMO C[N@@H+](Cc1ccc(N2CC[C@@H]3O[C@H](COCc4ccccn4)CC[C@H]32)nc1)C1CC1 ZINC001164845175 720778877 /nfs/dbraw/zinc/77/88/77/720778877.db2.gz FIZPNCGBGJYNCC-ZRBLBEILSA-N 1 1 408.546 3.414 20 0 HGADMO Clc1cccc2nc(Cl)c(N3CC[N@H+]4C[C@@H](Oc5cncnc5)C[C@@H]4C3)nc12 ZINC001164742755 720800994 /nfs/dbraw/zinc/80/09/94/720800994.db2.gz DMYSRNGNJPMXAM-OLZOCXBDSA-N 1 1 417.300 3.069 20 0 HGADMO Clc1cccc2c1ncnc2N1CC[C@@H]2[C@@H](C[C@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164743333 720817549 /nfs/dbraw/zinc/81/75/49/720817549.db2.gz SGGIBFJQUAUQPY-SQGPQFPESA-N 1 1 423.952 3.254 20 0 HGADMO Clc1cccc2ncc(N3CC[C@@H]4[C@@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)nc12 ZINC001164738357 720817855 /nfs/dbraw/zinc/81/78/55/720817855.db2.gz DYXVBISEDQOITJ-SQGPQFPESA-N 1 1 423.952 3.254 20 0 HGADMO Cc1nc2cc(F)ccc2c(N2CC[C@@H]3[C@@H](C[C@H](Cn4cncn4)[N@H+]3CC3CC3)C2)n1 ZINC001164737655 720820392 /nfs/dbraw/zinc/82/03/92/720820392.db2.gz BHBAKFSPIQKXCJ-LRXVAGHRSA-N 1 1 421.524 3.048 20 0 HGADMO Clc1cccc2nc(N3CC[C@@H]4[C@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)cnc12 ZINC001164738839 720822900 /nfs/dbraw/zinc/82/29/00/720822900.db2.gz HCOWYEPWMTXXMS-FUHIMQAGSA-N 1 1 423.952 3.254 20 0 HGADMO Clc1cnc2nc(N3CC[C@@H]4[C@@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)ccc2c1 ZINC001164740307 720825626 /nfs/dbraw/zinc/82/56/26/720825626.db2.gz KDHLVHYENXDDPA-DFQSSKMNSA-N 1 1 423.952 3.254 20 0 HGADMO CCc1cc2c(ncnc2N2CC[C@@H]3[C@H](C[C@@H](Cn4cncn4)[N@H+]3CC3CC3)C2)s1 ZINC001164743806 720827140 /nfs/dbraw/zinc/82/71/40/720827140.db2.gz SKLUWRKWOTVOAH-FUHIMQAGSA-N 1 1 423.590 3.225 20 0 HGADMO Cc1nc(Cl)cc(N2CC[C@@H]3[C@H](C[C@H](Cn4cncn4)[N@H+]3CC3CC3)C2)c1C ZINC001164748805 720832053 /nfs/dbraw/zinc/83/20/53/720832053.db2.gz UYCDLQYMXYPZML-GUDVDZBRSA-N 1 1 400.958 3.323 20 0 HGADMO COCC[N@H+]1CCO[C@@H]2CN(c3nc(Cl)nc4ccc(Cl)cc43)CC[C@@H]2C1 ZINC001164847922 720832147 /nfs/dbraw/zinc/83/21/47/720832147.db2.gz KYKAGDUIVXLSIR-CXAGYDPISA-N 1 1 411.333 3.110 20 0 HGADMO CCOc1ccc(Cl)nc1N1CC[C@@H]2[C@@H](C[C@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164745793 720833338 /nfs/dbraw/zinc/83/33/38/720833338.db2.gz NKLZGJAAECJGIM-RCCFBDPRSA-N 1 1 416.957 3.105 20 0 HGADMO CC(C)(C)Oc1cccc(N2CC[C@@H]3[C@@H](C[C@@H](Cn4cncn4)[N@H+]3CC3CC3)C2)n1 ZINC001164740467 720834089 /nfs/dbraw/zinc/83/40/89/720834089.db2.gz BWRUSSPGIVIRKE-SLFFLAALSA-N 1 1 410.566 3.230 20 0 HGADMO COc1ccc2cnc(N3CC[C@@H]4[C@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)cc2c1 ZINC001164741896 720839710 /nfs/dbraw/zinc/83/97/10/720839710.db2.gz FVJMECHVQATDTJ-FUPPJEDESA-N 1 1 418.545 3.214 20 0 HGADMO COCC[N@H+]1CCO[C@@H]2CN(c3nc(Cl)cc4c(Cl)ccnc43)CC[C@@H]2C1 ZINC001164854008 720852769 /nfs/dbraw/zinc/85/27/69/720852769.db2.gz HYHFMNMQVVQMFH-CZUORRHYSA-N 1 1 411.333 3.110 20 0 HGADMO CCc1nc2sccc2c(N2CC[C@@H]3[C@@H](C[C@H](Cn4cncn4)[N@H+]3CC3CC3)C2)n1 ZINC001164745991 720854120 /nfs/dbraw/zinc/85/41/20/720854120.db2.gz FBSXUAJGPGUQKV-YQVWRLOYSA-N 1 1 423.590 3.225 20 0 HGADMO COCC[N@H+]1CCO[C@H]2CN(c3nc4cc(C)c(C)cc4nc3Cl)CC[C@H]2C1 ZINC001164853517 720864252 /nfs/dbraw/zinc/86/42/52/720864252.db2.gz GVVPICRSWYSWTF-LPHOPBHVSA-N 1 1 404.942 3.074 20 0 HGADMO COCC[N@H+]1CCO[C@H]2CN(c3cncc(Sc4cccc(C)c4)n3)CC[C@@H]2C1 ZINC001164860272 720868936 /nfs/dbraw/zinc/86/89/36/720868936.db2.gz WEFLGGXFHJEMCV-QUCCMNQESA-N 1 1 414.575 3.110 20 0 HGADMO c1cc2ncnc(N3CC[C@]4(C3)C[N@H+](CC3CC3)C[C@@H]4COCc3cccnc3)c2[nH]1 ZINC001164752943 720871024 /nfs/dbraw/zinc/87/10/24/720871024.db2.gz NPFNJOMPFNEXQT-HYBUGGRVSA-N 1 1 418.545 3.108 20 0 HGADMO COCC[N@H+]1CCO[C@@H]2CN(c3cc(F)ccc3-c3ccc(Cl)nn3)CC[C@H]2C1 ZINC001164854924 720881448 /nfs/dbraw/zinc/88/14/48/720881448.db2.gz GGKFDYZIRIBHQZ-MGPUTAFESA-N 1 1 420.916 3.110 20 0 HGADMO COC(=O)c1ccc2ncnc(N3CCn4c(C[N@@H+](C)C(C)C)cnc4[C@H]3C)c2c1 ZINC001164859116 720933840 /nfs/dbraw/zinc/93/38/40/720933840.db2.gz OWYDIDZWGWJNGB-OAHLLOKOSA-N 1 1 408.506 3.034 20 0 HGADMO COC(=O)c1cccc2nc(N3CCn4c(C[N@@H+](C)C(C)C)cnc4[C@H]3C)ncc21 ZINC001164861860 720945800 /nfs/dbraw/zinc/94/58/00/720945800.db2.gz UNNFXZUQHGHQSO-OAHLLOKOSA-N 1 1 408.506 3.034 20 0 HGADMO COc1nc(Cl)ncc1C(F)(F)N1CCn2c(C[N@@H+](C)C(C)C)cnc2[C@H]1C ZINC001164863573 720992219 /nfs/dbraw/zinc/99/22/19/720992219.db2.gz WQNDPLNAPZVVFO-GFCCVEGCSA-N 1 1 414.888 3.301 20 0 HGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2CCc3ncc(Cn4cccn4)n3CC2)nc1 ZINC001164862014 721033657 /nfs/dbraw/zinc/03/36/57/721033657.db2.gz JXOGISVSEKZXBF-OAQYLSRUSA-N 1 1 405.550 3.133 20 0 HGADMO Cc1cc(C(F)(F)N2CC[N@H+]3C[C@@H](OCc4cccnc4)C[C@H]3C2)cc(Cl)n1 ZINC001164867683 721049123 /nfs/dbraw/zinc/04/91/23/721049123.db2.gz JQYCFIBYZLDMJZ-ROUUACIJSA-N 1 1 408.880 3.463 20 0 HGADMO Fc1ccc(C(F)(F)N2CC[N@H+]3C[C@H](OCc4cccnc4)C[C@@H]3C2)nc1Cl ZINC001164868748 721056788 /nfs/dbraw/zinc/05/67/88/721056788.db2.gz QFSQQRSXMNYEQG-HUUCEWRRSA-N 1 1 412.843 3.294 20 0 HGADMO c1ccc(Oc2cc(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@@H]4C3)ncn2)cc1 ZINC001164868036 721061734 /nfs/dbraw/zinc/06/17/34/721061734.db2.gz MHLZAHIMDDBYOI-TZIWHRDSSA-N 1 1 403.486 3.144 20 0 HGADMO Clc1ncnc2scc(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@H]4C3)c21 ZINC001164868927 721075725 /nfs/dbraw/zinc/07/57/25/721075725.db2.gz RFSMMRSLNQZIFH-LSDHHAIUSA-N 1 1 401.923 3.219 20 0 HGADMO CSc1nc2sccc2c(N2C[C@H]3CC[N@@H+](Cc4cnn(C)c4)C[C@@H]3C2)n1 ZINC001164765636 721083117 /nfs/dbraw/zinc/08/31/17/721083117.db2.gz JFEIPAWHINZPLE-HUUCEWRRSA-N 1 1 400.577 3.105 20 0 HGADMO Cc1sc2nc(C)nc(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@H]4C3)c2c1C ZINC001164865416 721084230 /nfs/dbraw/zinc/08/42/30/721084230.db2.gz LEWUPMXRFNNXDP-RBUKOAKNSA-N 1 1 409.559 3.491 20 0 HGADMO Cc1sc2nc(C)nc(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@@H]4C3)c2c1C ZINC001164865414 721085204 /nfs/dbraw/zinc/08/52/04/721085204.db2.gz LEWUPMXRFNNXDP-MOPGFXCFSA-N 1 1 409.559 3.491 20 0 HGADMO COc1ccc2nc(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@H]4C3)cc(C)c2c1 ZINC001164867655 721089494 /nfs/dbraw/zinc/08/94/94/721089494.db2.gz ZGMBZBGDLXGTNT-FPOVZHCZSA-N 1 1 404.514 3.427 20 0 HGADMO COc1cc2ccnc(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@H]4C3)c2cc1OC ZINC001164866628 721095508 /nfs/dbraw/zinc/09/55/08/721095508.db2.gz UHOMIZXHWWWKDJ-VQTJNVASSA-N 1 1 420.513 3.127 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(C(F)(F)c4nc(Cl)ncc4Cl)C[C@H]3C2)cn1 ZINC001164765628 721095952 /nfs/dbraw/zinc/09/59/52/721095952.db2.gz JEZLCKWXRHWKAS-QWHCGFSZSA-N 1 1 417.291 3.020 20 0 HGADMO COc1cc2ccnc(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@H]4C3)c2cc1OC ZINC001164866626 721096106 /nfs/dbraw/zinc/09/61/06/721096106.db2.gz UHOMIZXHWWWKDJ-PMACEKPBSA-N 1 1 420.513 3.127 20 0 HGADMO c1cn(C2CCCC2)c2ncnc(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@@H]4C3)c12 ZINC001164866335 721097774 /nfs/dbraw/zinc/09/77/74/721097774.db2.gz SGPIRBJAQUSIMN-NHCUHLMSSA-N 1 1 418.545 3.421 20 0 HGADMO CSc1nc2ccccc2c(N2CC[N@H+]3C[C@H](OCc4cccnc4)C[C@@H]3C2)n1 ZINC001164867331 721097952 /nfs/dbraw/zinc/09/79/52/721097952.db2.gz XXWBRTXRZYZZIP-QZTJIDSGSA-N 1 1 407.543 3.226 20 0 HGADMO Cc1cc(Cl)nc(C(F)(F)N2CC[N@H+]3C[C@@H](OCc4cccnc4)C[C@@H]3C2)c1 ZINC001164865465 721102148 /nfs/dbraw/zinc/10/21/48/721102148.db2.gz LNCIFLSDHBVEQT-SJORKVTESA-N 1 1 408.880 3.463 20 0 HGADMO Cc1ccc(Cl)nc1C(F)(F)N1CC[N@H+]2C[C@H](OCc3cccnc3)C[C@H]2C1 ZINC001164864554 721108419 /nfs/dbraw/zinc/10/84/19/721108419.db2.gz GGSVBLCBVINJRS-DLBZAZTESA-N 1 1 408.880 3.463 20 0 HGADMO Cc1nc2sc3c(c2c(N2CC[N@H+]4C[C@H](OCc5cccnc5)C[C@@H]4C2)n1)CCC3 ZINC001164874568 721139594 /nfs/dbraw/zinc/13/95/94/721139594.db2.gz KRRGRCFRGKRRHB-QZTJIDSGSA-N 1 1 421.570 3.363 20 0 HGADMO COc1cccc(-c2ccc(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@@H]4C3)nn2)c1 ZINC001164874451 721146416 /nfs/dbraw/zinc/14/64/16/721146416.db2.gz KAVLYCLGXKQUAQ-IFMALSPDSA-N 1 1 417.513 3.027 20 0 HGADMO COc1ccccc1-c1ccnc(N2CC[N@H+]3C[C@H](OCc4cccnc4)C[C@@H]3C2)n1 ZINC001164881083 721154432 /nfs/dbraw/zinc/15/44/32/721154432.db2.gz YXFYNYPYFZPIMK-WOJBJXKFSA-N 1 1 417.513 3.027 20 0 HGADMO Fc1cc2ncc(Cl)nc2cc1N1CC[N@H+]2C[C@H](OCc3cccnc3)C[C@H]2C1 ZINC001164877064 721159709 /nfs/dbraw/zinc/15/97/09/721159709.db2.gz OQTCUZQDXLRMBP-JKSUJKDBSA-N 1 1 413.884 3.297 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4cncc(Oc5cccc(F)c5)n4)C[C@H]3C2)cn1 ZINC001164768304 721170074 /nfs/dbraw/zinc/17/00/74/721170074.db2.gz KTYMVLFZTLIHOQ-ZWKOTPCHSA-N 1 1 408.481 3.100 20 0 HGADMO Cc1c(Cl)nc(C(C)C)nc1N1CC[N@H+]2C[C@H](OCc3cccnc3)C[C@@H]2C1 ZINC001164871548 721178708 /nfs/dbraw/zinc/17/87/08/721178708.db2.gz FGOJKLLZSYCADL-QZTJIDSGSA-N 1 1 401.942 3.437 20 0 HGADMO Fc1cnc(N2CC[N@H+]3C[C@@H](OCc4cccnc4)C[C@@H]3C2)nc1-c1ccsc1 ZINC001164870285 721184243 /nfs/dbraw/zinc/18/42/43/721184243.db2.gz CJBNUGFBCGWHPA-MSOLQXFVSA-N 1 1 411.506 3.219 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4ncccc4OCc4ccccc4)C[C@@H]3C2)cn1 ZINC001164768646 721192463 /nfs/dbraw/zinc/19/24/63/721192463.db2.gz LKHNUVCAWNMHHO-YADHBBJMSA-N 1 1 403.530 3.352 20 0 HGADMO CCc1nc2sc3c(c2c(N2C[C@H]4CC[N@@H+](Cc5cnn(C)c5)C[C@@H]4C2)n1)CCC3 ZINC001164771827 721195085 /nfs/dbraw/zinc/19/50/85/721195085.db2.gz RBLDZVNIWIFQHO-IAGOWNOFSA-N 1 1 422.602 3.434 20 0 HGADMO Cc1ccc(C)c(-c2ccc(N3C[C@@H]4CC[N@H+](Cc5cnn(C)c5)C[C@@H]4C3)nn2)c1 ZINC001164772866 721211345 /nfs/dbraw/zinc/21/13/45/721211345.db2.gz VQDPRUIITUKMMP-LEWJYISDSA-N 1 1 402.546 3.452 20 0 HGADMO CCN(c1ccccc1)c1cc(N2C[C@@H]3C[N@H+](Cc4cnn(C)c4)CC[C@@H]3C2)ncn1 ZINC001164772423 721225976 /nfs/dbraw/zinc/22/59/76/721225976.db2.gz UQENTQXFFXXRGY-RTWAWAEBSA-N 1 1 417.561 3.326 20 0 HGADMO Cc1c(Cl)nc(CC(C)C)nc1N1C[C@@H]2CC[N@@H+](Cc3cnn(C)c3)C[C@H]2C1 ZINC001164763940 721235393 /nfs/dbraw/zinc/23/53/93/721235393.db2.gz OHBMFIUUECDXRR-ROUUACIJSA-N 1 1 402.974 3.329 20 0 HGADMO COc1cc(Cl)nc(N2CCC[C@]3(C2)COCC[N@H+](Cc2c(C)noc2C)C3)c1 ZINC001164776799 721347468 /nfs/dbraw/zinc/34/74/68/721347468.db2.gz CXARGXFCLPMKJT-NRFANRHFSA-N 1 1 420.941 3.467 20 0 HGADMO COc1cc(Cl)nc(N2CCC[C@]3(C2)COCC[N@@H+](Cc2c(C)noc2C)C3)c1 ZINC001164776799 721347470 /nfs/dbraw/zinc/34/74/70/721347470.db2.gz CXARGXFCLPMKJT-NRFANRHFSA-N 1 1 420.941 3.467 20 0 HGADMO CC(C)(c1ccnc(Cl)c1)[N@@H+]1C[C@@H]2CCCO[C@@H]2[C@@H](NC(=O)c2cccnc2)C1 ZINC001164786948 721382181 /nfs/dbraw/zinc/38/21/81/721382181.db2.gz VMGMUBLKLPXSCI-QRFRQXIXSA-N 1 1 414.937 3.275 20 0 HGADMO CC(C)(c1ccnc(Cl)c1)[N@H+]1C[C@@H]2CCCO[C@@H]2[C@@H](NC(=O)c2cccnc2)C1 ZINC001164786948 721382182 /nfs/dbraw/zinc/38/21/82/721382182.db2.gz VMGMUBLKLPXSCI-QRFRQXIXSA-N 1 1 414.937 3.275 20 0 HGADMO C[NH+]1CCN(C[C@H]2CCC[C@@]3(CCN(c4cc(Oc5ccccc5)ncn4)C3)O2)CC1 ZINC001164886703 721392597 /nfs/dbraw/zinc/39/25/97/721392597.db2.gz FOFLYFVHZQVWKL-QPPBQGQZSA-N 1 1 423.561 3.034 20 0 HGADMO C[NH+]1CCN(C[C@H]2CCC[C@@]3(CCN(c4nc5ccccc5nc4Cl)C3)O2)CC1 ZINC001164885699 721402955 /nfs/dbraw/zinc/40/29/55/721402955.db2.gz HAWCRWROMBMIKG-VGSWGCGISA-N 1 1 415.969 3.049 20 0 HGADMO C[NH+]1CCN(C[C@@H]2CCC[C@@]3(CCN(c4nc5ccccc5nc4Cl)C3)O2)CC1 ZINC001164885693 721402965 /nfs/dbraw/zinc/40/29/65/721402965.db2.gz HAWCRWROMBMIKG-JTSKRJEESA-N 1 1 415.969 3.049 20 0 HGADMO C[NH+]1CCN(C[C@H]2CCC[C@]3(CCN(c4cnc5ccc(Cl)cc5n4)C3)O2)CC1 ZINC001164885647 721405990 /nfs/dbraw/zinc/40/59/90/721405990.db2.gz GWSPDCUGJQTDJB-XMSQKQJNSA-N 1 1 415.969 3.049 20 0 HGADMO COc1cccc2nc(Cl)nc(N3C[C@@H]4C[NH+](Cc5nccs5)C[C@H]4C3)c21 ZINC001164780574 721413498 /nfs/dbraw/zinc/41/34/98/721413498.db2.gz BFPBGLVIKWYIRQ-STQMWFEESA-N 1 1 401.923 3.317 20 0 HGADMO c1csc(C[NH+]2C[C@H]3CN(c4nc5ccccc5nc4N4CCCC4)C[C@@H]3C2)n1 ZINC001164782068 721424437 /nfs/dbraw/zinc/42/44/37/721424437.db2.gz FPABSWXUWDBJSL-IRXDYDNUSA-N 1 1 406.559 3.255 20 0 HGADMO C[NH+]1CCN(C[C@H]2CCC[C@]3(CCN(c4nc(Cl)cc(C(C)(C)C)n4)C3)O2)CC1 ZINC001164891477 721428694 /nfs/dbraw/zinc/42/86/94/721428694.db2.gz GOFXMQANDFLIIK-VGOFRKELSA-N 1 1 422.017 3.193 20 0 HGADMO Cc1c[nH]c2nc(Cl)cc(N3CC[C@@]4(C3)CCC[C@H](CN3CC[NH+](C)CC3)O4)c12 ZINC001164896753 721431805 /nfs/dbraw/zinc/43/18/05/721431805.db2.gz RXABZOJGSYYLLE-VGOFRKELSA-N 1 1 417.985 3.290 20 0 HGADMO COC(=O)c1nc(N2C[C@@H]3C[NH+](Cc4nccs4)C[C@H]3C2)c2ccccc2c1OC ZINC001164781972 721432159 /nfs/dbraw/zinc/43/21/59/721432159.db2.gz DXUPQCCMECXUQF-GJZGRUSLSA-N 1 1 424.526 3.055 20 0 HGADMO Cc1cc2ncnc(N3CC[C@@]4(C3)CCC[C@@H](CN3CC[NH+](C)CC3)O4)c2cc1C ZINC001164890732 721445697 /nfs/dbraw/zinc/44/56/97/721445697.db2.gz DRFITGMZHOVLET-GBXCKJPGSA-N 1 1 409.578 3.012 20 0 HGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1ncnc3[nH]c(C)cc31)CC2 ZINC001164787692 721455651 /nfs/dbraw/zinc/45/56/51/721455651.db2.gz PLTANMFXNUGDIF-IBGZPJMESA-N 1 1 413.566 3.000 20 0 HGADMO CCOc1ccc(N2CCC3(C[C@@H](COCC4CC4)[N@@H+](CCOC)C3)CC2)nc1 ZINC001164789334 721456588 /nfs/dbraw/zinc/45/65/88/721456588.db2.gz UUKIHAPGJXKFKO-FQEVSTJZSA-N 1 1 403.567 3.214 20 0 HGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1cc(C)cc(OC)n1)CC2 ZINC001164788654 721459019 /nfs/dbraw/zinc/45/90/19/721459019.db2.gz VDWHIBIFWAKSGD-HXUWFJFHSA-N 1 1 403.567 3.133 20 0 HGADMO CCCc1ccnc(N2CCC3(C[C@@H](COCC4CC4)[N@@H+](CCOC)C3)CC2)n1 ZINC001164784492 721462995 /nfs/dbraw/zinc/46/29/95/721462995.db2.gz ILJGWKLEFAONOG-NRFANRHFSA-N 1 1 402.583 3.163 20 0 HGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1ncc(F)c3cc[nH]c31)CC2 ZINC001164789844 721463958 /nfs/dbraw/zinc/46/39/58/721463958.db2.gz XRHZJQCYTXOQSX-SFHVURJKSA-N 1 1 416.541 3.436 20 0 HGADMO CCc1c(Cl)ncnc1N1CCC2(C[C@H](COCC3CC3)[N@@H+](CCOC)C2)CC1 ZINC001164788310 721468667 /nfs/dbraw/zinc/46/86/67/721468667.db2.gz IXPLZWFDJZSRDE-GOSISDBHSA-N 1 1 423.001 3.426 20 0 HGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1ccc(Cl)c(N)n1)CC2 ZINC001164788759 721473362 /nfs/dbraw/zinc/47/33/62/721473362.db2.gz JSGBDKLNZDAOOS-KRWDZBQOSA-N 1 1 408.974 3.051 20 0 HGADMO CCCc1nccnc1N1CCC2(C[C@@H](COCC3CC3)[N@@H+](CCOC)C2)CC1 ZINC001164786564 721473466 /nfs/dbraw/zinc/47/34/66/721473466.db2.gz BPZRRHNGCOPBBK-FQEVSTJZSA-N 1 1 402.583 3.163 20 0 HGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2Cc3nccn3C[C@@H](Cn3cccn3)C2)nc1 ZINC001164897694 721487622 /nfs/dbraw/zinc/48/76/22/721487622.db2.gz UACBSNVKUHXKBG-TZIWHRDSSA-N 1 1 405.550 3.358 20 0 HGADMO Fc1c[nH]c2nc(Cl)nc(N3CC[N@H+]4C[C@H](Oc5cccc(F)c5)C[C@H]4C3)c12 ZINC001164896894 721510508 /nfs/dbraw/zinc/51/05/08/721510508.db2.gz CAXBLMZKZXVFDN-GXTWGEPZSA-N 1 1 405.836 3.231 20 0 HGADMO Cc1nc(Cl)cc(C(F)(F)N2CC[N@H+]3C[C@H](Oc4cccc(F)c4)C[C@H]3C2)n1 ZINC001164900720 721519809 /nfs/dbraw/zinc/51/98/09/721519809.db2.gz UIIBTKRANSXKAN-GOEBONIOSA-N 1 1 412.843 3.464 20 0 HGADMO Fc1cccc(O[C@H]2C[C@@H]3CN(c4nc(Cl)nc5c4CSC5)CC[N@H+]3C2)c1 ZINC001164901623 721524832 /nfs/dbraw/zinc/52/48/32/721524832.db2.gz XTMLLXBEJAVHFX-HIFRSBDPSA-N 1 1 406.914 3.358 20 0 HGADMO Cc1cc(Cl)nc(C(F)(F)N2C[C@H]([N@H+](C)Cc3cccnc3)[C@H]3OCCC[C@H]32)n1 ZINC001164803649 721529201 /nfs/dbraw/zinc/52/92/01/721529201.db2.gz IMWOBSZQRCWLFC-RYRKJORJSA-N 1 1 423.895 3.247 20 0 HGADMO Cc1cc(Cl)nc(C(F)(F)N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@H]3OCCC[C@H]32)n1 ZINC001164803649 721529205 /nfs/dbraw/zinc/52/92/05/721529205.db2.gz IMWOBSZQRCWLFC-RYRKJORJSA-N 1 1 423.895 3.247 20 0 HGADMO Fc1cccc(O[C@@H]2C[C@@H]3CN(c4nnc(Cl)c5c4CCCC5)CC[N@H+]3C2)c1 ZINC001164903484 721530519 /nfs/dbraw/zinc/53/05/19/721530519.db2.gz CZPYLHOLKLCNHH-NVXWUHKLSA-N 1 1 402.901 3.490 20 0 HGADMO COC(=O)c1nc(N2CC[N@H+]3C[C@@H](Oc4cccc(F)c4)C[C@H]3C2)ccc1Cl ZINC001164906363 721531817 /nfs/dbraw/zinc/53/18/17/721531817.db2.gz KDDJYQZDBFGJLH-HOCLYGCPSA-N 1 1 405.857 3.003 20 0 HGADMO COC(=O)c1ccc(Cl)c(N2CC[N@H+]3C[C@@H](Oc4cccc(F)c4)C[C@@H]3C2)n1 ZINC001164911999 721538493 /nfs/dbraw/zinc/53/84/93/721538493.db2.gz YAHCNUJIPHWLSA-ZBFHGGJFSA-N 1 1 405.857 3.003 20 0 HGADMO Nc1cc(Cl)nc(C(F)(F)N2CC[N@H+]3C[C@@H](Oc4cccc(F)c4)C[C@H]3C2)c1 ZINC001164906391 721540123 /nfs/dbraw/zinc/54/01/23/721540123.db2.gz KJKXONDGZZDMOP-HOCLYGCPSA-N 1 1 412.843 3.343 20 0 HGADMO COC(OC)c1cc(C)cnc1N1CC[N@H+]2C[C@H](Oc3cccc(F)c3)C[C@H]2C1 ZINC001164909727 721548005 /nfs/dbraw/zinc/54/80/05/721548005.db2.gz RRSGMUHIOBEANX-PKOBYXMFSA-N 1 1 401.482 3.162 20 0 HGADMO CCOc1cc(Cl)nc(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@H]32)c1 ZINC001164799060 721551119 /nfs/dbraw/zinc/55/11/19/721551119.db2.gz ALIUVTURERXYMV-LVCYWYKZSA-N 1 1 402.926 3.397 20 0 HGADMO Cc1cc(N2CC[N@H+]3C[C@@H](Oc4cccc(F)c4)C[C@@H]3C2)nc(-c2ccncc2)n1 ZINC001164903175 721551525 /nfs/dbraw/zinc/55/15/25/721551525.db2.gz BHXZKYHBLIYUKN-CTNGQTDRSA-N 1 1 405.477 3.328 20 0 HGADMO Cc1cc(N2CC[N@H+]3C[C@H](Oc4cccc(F)c4)C[C@H]3C2)nc(-c2ccncc2)n1 ZINC001164903177 721552109 /nfs/dbraw/zinc/55/21/09/721552109.db2.gz BHXZKYHBLIYUKN-PZJWPPBQSA-N 1 1 405.477 3.328 20 0 HGADMO Fc1cccc(O[C@H]2C[C@H]3CN(c4ncnc(-c5cccc(F)c5)n4)CC[N@H+]3C2)c1 ZINC001164903523 721557391 /nfs/dbraw/zinc/55/73/91/721557391.db2.gz BZMQVKNGENSJJA-ICSRJNTNSA-N 1 1 409.440 3.159 20 0 HGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2cnc(-c3ccccc3)cn2)[C@H]2CCCO[C@H]12 ZINC001164809896 721577374 /nfs/dbraw/zinc/57/73/74/721577374.db2.gz XYJCHHWHKDHWGK-ZDXQCDESSA-N 1 1 401.514 3.407 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2cnc(-c3ccccc3)cn2)[C@H]2CCCO[C@H]12 ZINC001164809896 721577377 /nfs/dbraw/zinc/57/73/77/721577377.db2.gz XYJCHHWHKDHWGK-ZDXQCDESSA-N 1 1 401.514 3.407 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2ccnc(Cc3ccccc3)n2)[C@H]2CCCO[C@H]12 ZINC001164799268 721583798 /nfs/dbraw/zinc/58/37/98/721583798.db2.gz AFYPBURHOFHZEQ-FBLLAGFSSA-N 1 1 415.541 3.331 20 0 HGADMO CN(C)c1nc(Cl)cc(N2CCC(F)(F)[C@@]3(CC[N@@H+](Cc4ccccn4)C3)C2)n1 ZINC001164905776 721583965 /nfs/dbraw/zinc/58/39/65/721583965.db2.gz WYWIVUKLVMITLB-LJQANCHMSA-N 1 1 422.911 3.329 20 0 HGADMO COc1cc(OC)nc(N2CCC(F)(F)[C@@]3(CC[N@@H+](Cc4ccccn4)C3)C2)c1 ZINC001164904381 721704332 /nfs/dbraw/zinc/70/43/32/721704332.db2.gz CYQJCZCDGDYFAY-HXUWFJFHSA-N 1 1 404.461 3.232 20 0 HGADMO FC1(F)CCN(c2cc(OCC3CC3)ncn2)C[C@]12CC[N@@H+](Cc1ccccn1)C2 ZINC001164904826 721711609 /nfs/dbraw/zinc/71/16/09/721711609.db2.gz DGJZLAUGXCGDBT-OAQYLSRUSA-N 1 1 415.488 3.398 20 0 HGADMO CCN(CC)c1cc(N2CCC(F)(F)[C@@]3(CC[N@@H+](Cc4ccccn4)C3)C2)ncn1 ZINC001164906796 721715932 /nfs/dbraw/zinc/71/59/32/721715932.db2.gz OJICIGFZRDLAAH-OAQYLSRUSA-N 1 1 416.520 3.456 20 0 HGADMO Cc1nc2nc(Cl)nc(N3CCc4c(C[N@H+](C)Cc5ccco5)cncc4C3)c2[nH]1 ZINC001164908857 721751233 /nfs/dbraw/zinc/75/12/33/721751233.db2.gz MHFRAPDZPUTBJK-UHFFFAOYSA-N 1 1 423.908 3.497 20 0 HGADMO Cc1nc2nc(Cl)nc(N3CCc4c(C[N@@H+](C)Cc5ccco5)cncc4C3)c2[nH]1 ZINC001164908857 721751242 /nfs/dbraw/zinc/75/12/42/721751242.db2.gz MHFRAPDZPUTBJK-UHFFFAOYSA-N 1 1 423.908 3.497 20 0 HGADMO COC(=O)c1ccc(N2CCc3c(C[N@H+](C)Cc4ccco4)cncc3C2)nc1C ZINC001164908458 721752256 /nfs/dbraw/zinc/75/22/56/721752256.db2.gz JPYVGJIHRCUMPZ-UHFFFAOYSA-N 1 1 406.486 3.359 20 0 HGADMO COC(=O)c1ccc(N2CCc3c(C[N@@H+](C)Cc4ccco4)cncc3C2)nc1C ZINC001164908458 721752266 /nfs/dbraw/zinc/75/22/66/721752266.db2.gz JPYVGJIHRCUMPZ-UHFFFAOYSA-N 1 1 406.486 3.359 20 0 HGADMO CCOC(=O)c1ncnc(N2CCc3c(C[N@H+](C)Cc4ccco4)cncc3C2)c1C ZINC001164911361 721756689 /nfs/dbraw/zinc/75/66/89/721756689.db2.gz VAQHNZUXAHGADV-UHFFFAOYSA-N 1 1 421.501 3.144 20 0 HGADMO CCOC(=O)c1ncnc(N2CCc3c(C[N@@H+](C)Cc4ccco4)cncc3C2)c1C ZINC001164911361 721756695 /nfs/dbraw/zinc/75/66/95/721756695.db2.gz VAQHNZUXAHGADV-UHFFFAOYSA-N 1 1 421.501 3.144 20 0 HGADMO c1ccc(C[N@H+]2CCc3nc(N4C[C@H](OCC5CC5)[C@@H]5COC[C@H]54)ccc3C2)cc1 ZINC001165016474 721761593 /nfs/dbraw/zinc/76/15/93/721761593.db2.gz WVPQAZWBLZHWRH-JRFVFWCSSA-N 1 1 405.542 3.270 20 0 HGADMO C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@@H]2CN(c3ccc(CN4CCOCC4)cn3)C[C@@H]21 ZINC001165017746 721802035 /nfs/dbraw/zinc/80/20/35/721802035.db2.gz AINWXMRYDYSLKV-YFNKSVMNSA-N 1 1 421.589 3.046 20 0 HGADMO COC(=O)c1ccc(N2C[C@@H]3CCC[C@H]([N@@H+](C)Cc4ccccn4)[C@H]3C2)nc1OC ZINC001165022090 721803529 /nfs/dbraw/zinc/80/35/29/721803529.db2.gz HUYOPGBURRFSKU-VDGAXYAQSA-N 1 1 410.518 3.009 20 0 HGADMO Cc1nc2nc(Cl)nc(N3C[C@@H]4CCC[C@H]([N@@H+](C)Cc5ccccn5)[C@@H]4C3)c2[nH]1 ZINC001165021339 721807868 /nfs/dbraw/zinc/80/78/68/721807868.db2.gz GKOVXZRBGDLQJO-UAGQMJEPSA-N 1 1 411.941 3.447 20 0 HGADMO Cc1nc2c(nc(Cl)nc2N2C[C@@H]3CCC[C@H]([N@H+](C)Cc4ccccn4)[C@@H]3C2)[nH]1 ZINC001165021339 721807869 /nfs/dbraw/zinc/80/78/69/721807869.db2.gz GKOVXZRBGDLQJO-UAGQMJEPSA-N 1 1 411.941 3.447 20 0 HGADMO Cc1nc2c(nc(Cl)nc2N2C[C@@H]3CCC[C@H]([N@@H+](C)Cc4ccccn4)[C@@H]3C2)[nH]1 ZINC001165021339 721807870 /nfs/dbraw/zinc/80/78/70/721807870.db2.gz GKOVXZRBGDLQJO-UAGQMJEPSA-N 1 1 411.941 3.447 20 0 HGADMO CCOc1ccc(C(=O)OC)c(N2C[C@@H]3CCC[C@H]([N@@H+](C)Cc4ccccn4)[C@H]3C2)n1 ZINC001165026423 721815802 /nfs/dbraw/zinc/81/58/02/721815802.db2.gz PZSITEOITBUDHG-YYWHXJBOSA-N 1 1 424.545 3.399 20 0 HGADMO Cc1cnc2n1CCN(C)C21CCN(c2nc(Cl)ccc2C[NH+]2CCCC2)CC1 ZINC001164917587 721816666 /nfs/dbraw/zinc/81/66/66/721816666.db2.gz GJZYTNCXEZFZMS-UHFFFAOYSA-N 1 1 414.985 3.277 20 0 HGADMO CC(C)c1nc(N(C)C)nc(N2C[C@@H]3CCC[C@H]([N@@H+](C)Cc4ccccn4)[C@H]3C2)n1 ZINC001165024248 721816708 /nfs/dbraw/zinc/81/67/08/721816708.db2.gz KBUGMTBEPCBOIT-IHPCNDPISA-N 1 1 409.582 3.193 20 0 HGADMO Cc1cn(-c2ccc(N3C[C@@H]4CCC[C@H]([N@@H+](C)Cc5ccccn5)[C@H]4C3)nn2)cn1 ZINC001165027137 721818595 /nfs/dbraw/zinc/81/85/95/721818595.db2.gz SKJOLPHPLDKSLP-JBACZVJFSA-N 1 1 403.534 3.103 20 0 HGADMO C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@H]2CN(c3ncnc4c3ncn4C3CC3)C[C@@H]21 ZINC001165024435 721825105 /nfs/dbraw/zinc/82/51/05/721825105.db2.gz JVRSQVFZMPNRPB-FFZOFVMBSA-N 1 1 403.534 3.293 20 0 HGADMO CN(C)CC[N@H+]1CC[C@H]2[C@@H]1CCN2c1ccc(-c2ccc(C3OCCCO3)cc2)cn1 ZINC001164923632 721874313 /nfs/dbraw/zinc/87/43/13/721874313.db2.gz JEVAMZGMYJGOPJ-GOTSBHOMSA-N 1 1 422.573 3.399 20 0 HGADMO C[NH+](C)CCN1CC[C@H]2[C@@H]1CCN2c1ccc(-c2ccc(C3OCCCO3)cc2)cn1 ZINC001164923632 721874315 /nfs/dbraw/zinc/87/43/15/721874315.db2.gz JEVAMZGMYJGOPJ-GOTSBHOMSA-N 1 1 422.573 3.399 20 0 HGADMO CN(C)CC[N@@H+]1CC[C@H]2[C@@H]1CCN2c1cnc(Cl)nc1Oc1cccc(F)c1 ZINC001164931847 721888271 /nfs/dbraw/zinc/88/82/71/721888271.db2.gz GGYIWJVSYKWUKJ-IRXDYDNUSA-N 1 1 405.905 3.276 20 0 HGADMO CN(C)CC[N@H+]1CC[C@H]2[C@@H]1CCN2c1cnc(Cl)nc1Oc1cccc(F)c1 ZINC001164931847 721888272 /nfs/dbraw/zinc/88/82/72/721888272.db2.gz GGYIWJVSYKWUKJ-IRXDYDNUSA-N 1 1 405.905 3.276 20 0 HGADMO Cc1ccccc1Oc1nc(Cl)ncc1N1CC[C@H]2[C@H]1CC[N@H+]2CCN(C)C ZINC001164934091 721888285 /nfs/dbraw/zinc/88/82/85/721888285.db2.gz PMFMTMDNKIYGFN-DLBZAZTESA-N 1 1 401.942 3.445 20 0 HGADMO Cc1ccccc1Oc1nc(Cl)ncc1N1CC[C@H]2[C@H]1CC[N@@H+]2CCN(C)C ZINC001164934091 721888286 /nfs/dbraw/zinc/88/82/86/721888286.db2.gz PMFMTMDNKIYGFN-DLBZAZTESA-N 1 1 401.942 3.445 20 0 HGADMO CCOC(=O)c1c(Cl)c2ccccc2nc1N1CC[NH+](C[C@H]2CCCO2)CC1 ZINC001165037064 721917058 /nfs/dbraw/zinc/91/70/58/721917058.db2.gz GDCAHLMSIMEJNL-OAHLLOKOSA-N 1 1 403.910 3.366 20 0 HGADMO COC(=O)c1ccc(C)nc1N1CCC2(CC1)C[N@@H+](Cc1ccc(C)cc1)CCO2 ZINC001164938134 721921754 /nfs/dbraw/zinc/92/17/54/721921754.db2.gz IKYFHTXUDNRFJC-UHFFFAOYSA-N 1 1 409.530 3.356 20 0 HGADMO CCOC(=O)c1cccc(N2CCC3(CC2)C[N@@H+](Cc2ccc(C)cc2)CCO3)n1 ZINC001164939809 721924257 /nfs/dbraw/zinc/92/42/57/721924257.db2.gz NMPFFJQJGHALQU-UHFFFAOYSA-N 1 1 409.530 3.438 20 0 HGADMO COc1cccc(Oc2nc(Cl)ncc2N2CC[NH+](C[C@@H]3CCCO3)CC2)c1 ZINC001165042427 721925158 /nfs/dbraw/zinc/92/51/58/721925158.db2.gz DTBWQVYNWBATCM-KRWDZBQOSA-N 1 1 404.898 3.232 20 0 HGADMO Cc1nc2cc(F)ccc2c(N2CCC3(CC2)C(=O)NCC[N@H+]3Cc2ccccc2)n1 ZINC001164946790 721971835 /nfs/dbraw/zinc/97/18/35/721971835.db2.gz WIVQNXUICFSQBD-UHFFFAOYSA-N 1 1 419.504 3.048 20 0 HGADMO Cc1nc2cc(F)ccc2c(N2CCC3(CC2)C(=O)NCC[N@@H+]3Cc2ccccc2)n1 ZINC001164946790 721971837 /nfs/dbraw/zinc/97/18/37/721971837.db2.gz WIVQNXUICFSQBD-UHFFFAOYSA-N 1 1 419.504 3.048 20 0 HGADMO O=C1NCC[N@@H+](Cc2ccccc2)C12CCN(c1cc(Cl)nc3ncccc13)CC2 ZINC001164943694 721973124 /nfs/dbraw/zinc/97/31/24/721973124.db2.gz BTCWMOYDZFPFCT-UHFFFAOYSA-N 1 1 421.932 3.254 20 0 HGADMO O=C1NCC[N@H+](Cc2ccccc2)C12CCN(c1cc(Cl)nc3ncccc13)CC2 ZINC001164943694 721973126 /nfs/dbraw/zinc/97/31/26/721973126.db2.gz BTCWMOYDZFPFCT-UHFFFAOYSA-N 1 1 421.932 3.254 20 0 HGADMO Cc1csc2nc(C)nc(N3CCC4(CC3)C(=O)NCC[N@H+]4Cc3ccccc3)c12 ZINC001164951147 721979436 /nfs/dbraw/zinc/97/94/36/721979436.db2.gz YCRFPUCLHHYENC-UHFFFAOYSA-N 1 1 421.570 3.279 20 0 HGADMO Cc1csc2nc(C)nc(N3CCC4(CC3)C(=O)NCC[N@@H+]4Cc3ccccc3)c12 ZINC001164951147 721979438 /nfs/dbraw/zinc/97/94/38/721979438.db2.gz YCRFPUCLHHYENC-UHFFFAOYSA-N 1 1 421.570 3.279 20 0 HGADMO Fc1ccc2c(c1)ncnc2N1CCC2(CC1)COCC[N@@H+](Cc1ccncc1)C2 ZINC001164958093 722053047 /nfs/dbraw/zinc/05/30/47/722053047.db2.gz CAYMRBZMKBZPJB-UHFFFAOYSA-N 1 1 407.493 3.283 20 0 HGADMO CC(C)COc1nccnc1N1CCC2(CC1)COCC[N@@H+](Cc1ccncc1)C2 ZINC001164960027 722061354 /nfs/dbraw/zinc/06/13/54/722061354.db2.gz DEMAONBAFWZHDE-UHFFFAOYSA-N 1 1 411.550 3.025 20 0 HGADMO C[C@H]1CCCCN1c1nc2ccccc2nc1N1C[C@@H]2C[N@H+](CC3CC3)C[C@H](C1)O2 ZINC001164967754 722075141 /nfs/dbraw/zinc/07/51/41/722075141.db2.gz UZQWCMBUHNWDOE-YSIASYRMSA-N 1 1 407.562 3.308 20 0 HGADMO COc1ccc(Oc2nc(Cl)ncc2N2C[C@@H]3C[N@H+](CC4CC4)C[C@H](C2)O3)cc1 ZINC001164967340 722077938 /nfs/dbraw/zinc/07/79/38/722077938.db2.gz BCSWQQFNVGCRRQ-HDICACEKSA-N 1 1 416.909 3.230 20 0 HGADMO Cc1cc(Cl)nc(C(F)(F)N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)n1 ZINC001164977249 722101746 /nfs/dbraw/zinc/10/17/46/722101746.db2.gz FKEPTOAWBBMNOF-IAGOWNOFSA-N 1 1 423.895 3.106 20 0 HGADMO FC(F)(Oc1cccc(Cl)n1)N1CC[C@@H]2C[N@@H+](Cc3cccnc3)CCO[C@H]2C1 ZINC001164982077 722108729 /nfs/dbraw/zinc/10/87/29/722108729.db2.gz VVPZVEQZUOYGIM-SJORKVTESA-N 1 1 424.879 3.282 20 0 HGADMO Cc1cc(C(F)(F)N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)nc(Cl)n1 ZINC001164974954 722109685 /nfs/dbraw/zinc/10/96/85/722109685.db2.gz JEDBUHGQVQZAGQ-DLBZAZTESA-N 1 1 423.895 3.106 20 0 HGADMO CCc1cc2c(ncnc2N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)s1 ZINC001164977400 722115298 /nfs/dbraw/zinc/11/52/98/722115298.db2.gz NASISJQHKTZNKT-PXNSSMCTSA-N 1 1 409.559 3.376 20 0 HGADMO CC(C)(C)OC(=O)c1ccc(N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)nc1 ZINC001164980511 722117794 /nfs/dbraw/zinc/11/77/94/722117794.db2.gz RNENCRWYTDYVPZ-SFTDATJTSA-N 1 1 424.545 3.159 20 0 HGADMO c1ccc(-c2cc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)ncn2)cc1 ZINC001164975159 722138142 /nfs/dbraw/zinc/13/81/42/722138142.db2.gz DXOMFUUHWKYPQT-GGAORHGYSA-N 1 1 401.514 3.266 20 0 HGADMO Cc1cc(C(F)(F)N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)c(Cl)nn1 ZINC001164979696 722142870 /nfs/dbraw/zinc/14/28/70/722142870.db2.gz LTJUJBGYAWGQLX-AEFFLSMTSA-N 1 1 423.895 3.106 20 0 HGADMO COc1cccc2c1ccnc2N1CC[C@@H]2C[N@@H+](Cc3cccnc3)CCO[C@H]2C1 ZINC001164972819 722146782 /nfs/dbraw/zinc/14/67/82/722146782.db2.gz ARYLSBFNYSQPFK-XXBNENTESA-N 1 1 404.514 3.366 20 0 HGADMO Cc1ccc(-c2ccc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)nn2)o1 ZINC001164974399 722147776 /nfs/dbraw/zinc/14/77/76/722147776.db2.gz DRMFDXAFNSDCAI-DENIHFKCSA-N 1 1 405.502 3.167 20 0 HGADMO c1cncc(C[N@H+]2CCO[C@@H]3CN(c4ccc(COC5CCC5)cn4)CC[C@H]3C2)c1 ZINC001164975269 722151593 /nfs/dbraw/zinc/15/15/93/722151593.db2.gz QRLIEBRMWFLKFT-JTHBVZDNSA-N 1 1 408.546 3.273 20 0 HGADMO COC(=O)c1cnc(Cl)nc1N1CCC[C@@]2(CC[N@H+]2Cc2cccc(F)c2)C1 ZINC001164995126 722192482 /nfs/dbraw/zinc/19/24/82/722192482.db2.gz RVMJWIYVVNXCAX-HXUWFJFHSA-N 1 1 404.873 3.301 20 0 HGADMO COC(=O)c1cc2cnc(N3CCC[C@]4(CC[N@H+]4Cc4cccc(F)c4)C3)nc2n1C ZINC001164997312 722206986 /nfs/dbraw/zinc/20/69/86/722206986.db2.gz ZBZWXFYZEIRPBM-QHCPKHFHSA-N 1 1 423.492 3.139 20 0 HGADMO COC(=O)c1nc(Cl)cc(N2CCC[C@@]3(CC[N@H+]3Cc3cccc(F)c3)C2)n1 ZINC001164996551 722210782 /nfs/dbraw/zinc/21/07/82/722210782.db2.gz NVVWLYBSICRXFX-HXUWFJFHSA-N 1 1 404.873 3.301 20 0 HGADMO CC(C)CN1c2ccccc2[C@@H]2CN(c3ccnc(N4CC[NH+](C)CC4)n3)CC[C@@H]21 ZINC001165005895 722245587 /nfs/dbraw/zinc/24/55/87/722245587.db2.gz VQQMAPZVKSQTAQ-UNMCSNQZSA-N 1 1 406.578 3.067 20 0 HGADMO COc1ccccc1C[C@@](C)(CO)[NH2+]Cc1nc2sc3c(c2c(N)n1)CCCC3 ZINC001308034946 1126162219 /nfs/dbraw/zinc/16/22/19/1126162219.db2.gz GFHMNGZKCNPIIL-QFIPXVFZSA-N 1 1 412.559 3.244 20 0 HGADMO CCOC(=O)N1CCN(c2nc(C[NH+]3CCCC3)nc3sc(C)c(C)c32)CC1 ZINC000008328611 132329616 /nfs/dbraw/zinc/32/96/16/132329616.db2.gz XKHIIHJVIVSOSG-UHFFFAOYSA-N 1 1 403.552 3.182 20 0 HGADMO COc1ccc(-c2noc(CCC(=O)NCCC[N@H+]3CCc4ccccc4C3)n2)cc1 ZINC000004933289 559210939 /nfs/dbraw/zinc/21/09/39/559210939.db2.gz DVBJIPXNBFTKDM-UHFFFAOYSA-N 1 1 420.513 3.242 20 0 HGADMO Clc1ncc(N2CCOCC2)c(N2CCC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)n1 ZINC001164624965 719079616 /nfs/dbraw/zinc/07/96/16/719079616.db2.gz MHQMUFYRGKQFFI-QUCCMNQESA-N 1 1 413.953 3.067 20 0 HGADMO CC(C)n1nc(C[NH+](C)C)c2c1CN(c1nc(-c3ccncc3)nc3c1CCC3)CC2 ZINC001164650131 719316420 /nfs/dbraw/zinc/31/64/20/719316420.db2.gz AMQGIZDOCFVAJC-UHFFFAOYSA-N 1 1 417.561 3.429 20 0 HGADMO Cc1nc(C[N@H+]2CCCC23CCN(c2ccc(C(=O)NC4CC4)cn2)CC3)cs1 ZINC001164693038 719809643 /nfs/dbraw/zinc/80/96/43/719809643.db2.gz PDIZMEFOYFWNJS-UHFFFAOYSA-N 1 1 411.575 3.374 20 0 HGADMO COC(=O)[C@]1(C)C[C@@H]([NH+]2CCOCC2)CCN1c1cc(F)cc2ccc(Cl)nc21 ZINC001164704714 719855189 /nfs/dbraw/zinc/85/51/89/719855189.db2.gz SLNIYNQBDRPONI-KKSFZXQISA-N 1 1 421.900 3.260 20 0 HGADMO COC(=O)[C@@]1(C)C[C@H]([NH+]2CCOCC2)CCN1c1nc(Cl)cc2cc(C)ccc21 ZINC001164705082 719862409 /nfs/dbraw/zinc/86/24/09/719862409.db2.gz SQWKRROJFXJNMM-VGOFRKELSA-N 1 1 417.937 3.429 20 0 HGADMO COC(=O)[C@@]1(C)C[C@H]([NH+]2CCOCC2)CCN1c1cc(Cl)nc2c(C)csc21 ZINC001164701580 719862508 /nfs/dbraw/zinc/86/25/08/719862508.db2.gz LFUYFFDOVHTCBX-JLTOFOAXSA-N 1 1 423.966 3.491 20 0 HGADMO CCN(CC)c1cncc(N2CCC3(CC2)C[N@@H+](Cc2cccs2)CCO3)n1 ZINC001164699155 719895221 /nfs/dbraw/zinc/89/52/21/719895221.db2.gz XUKZRJISCHAHGG-UHFFFAOYSA-N 1 1 401.580 3.256 20 0 HGADMO CCOC(=O)c1cc(Cl)nc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COC)c1 ZINC001164815745 720068134 /nfs/dbraw/zinc/06/81/34/720068134.db2.gz ZJNIZJNLZDQCRP-LAUBAEHRSA-N 1 1 407.942 3.096 20 0 HGADMO COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1cc(C)nc(SC)n1)CC2 ZINC001164710070 720093849 /nfs/dbraw/zinc/09/38/49/720093849.db2.gz GQBDHJGEUBMKKV-IBGZPJMESA-N 1 1 413.591 3.409 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(C(F)(F)c1cc(C)nc(Cl)n1)C2 ZINC001164812353 720098698 /nfs/dbraw/zinc/09/86/98/720098698.db2.gz QTKNGDNURCGOKO-QAPCUYQASA-N 1 1 400.901 3.168 20 0 HGADMO COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1ncc(Cl)c(C)n1)CC2 ZINC001164710026 720104159 /nfs/dbraw/zinc/10/41/59/720104159.db2.gz FRWGWFCDIIWGDB-SFHVURJKSA-N 1 1 401.942 3.341 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1ccc3cc(C(=O)OC)ccc3n1)C2 ZINC001164813283 720106442 /nfs/dbraw/zinc/10/64/42/720106442.db2.gz QAIKOXWVALCBNM-RDPSFJRHSA-N 1 1 409.530 3.206 20 0 HGADMO COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1ncc(C(=O)OC)cc1C)CC2 ZINC001164718057 720107401 /nfs/dbraw/zinc/10/74/01/720107401.db2.gz RDBYMYYORRGGPE-OAQYLSRUSA-N 1 1 424.545 3.079 20 0 HGADMO CCOC(=O)c1cnc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COC)c(Cl)c1 ZINC001164808511 720121650 /nfs/dbraw/zinc/12/16/50/720121650.db2.gz FKFOJGMULNEVJF-UTKZUKDTSA-N 1 1 407.942 3.096 20 0 HGADMO COC[C@@H]1C[N@H+](CC2CC2)C[C@@]12CCN(c1nccc3cc(OC)c(OC)cc31)C2 ZINC001164807069 720123546 /nfs/dbraw/zinc/12/35/46/720123546.db2.gz BHCUYVAMZVLHNF-YADARESESA-N 1 1 411.546 3.437 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1nccc3cc(OC)c(OC)cc31)C2 ZINC001164807069 720123552 /nfs/dbraw/zinc/12/35/52/720123552.db2.gz BHCUYVAMZVLHNF-YADARESESA-N 1 1 411.546 3.437 20 0 HGADMO COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1cc(-c3ncc[nH]3)ccn1)CC2 ZINC001164713861 720132031 /nfs/dbraw/zinc/13/20/31/720132031.db2.gz TWCJEYUTDNQUDZ-NRFANRHFSA-N 1 1 418.545 3.374 20 0 HGADMO COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1cc(-c3nnco3)ccn1)CC2 ZINC001164714015 720147730 /nfs/dbraw/zinc/14/77/30/720147730.db2.gz VGHBIRTZWZCQRJ-HXUWFJFHSA-N 1 1 420.517 3.034 20 0 HGADMO CCOC(=O)c1nc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COC)ccc1Cl ZINC001164815076 720150346 /nfs/dbraw/zinc/15/03/46/720150346.db2.gz HWCQOWSZGLJGGP-KKSFZXQISA-N 1 1 407.942 3.096 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1cc(-c3nc(C4CC4)no3)ccn1)C2 ZINC001164817551 720190548 /nfs/dbraw/zinc/19/05/48/720190548.db2.gz PUXZSBWBHZITLM-XXBNENTESA-N 1 1 409.534 3.194 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1ncnc3c1ncn3-c1ccccc1)C2 ZINC001164819739 720190770 /nfs/dbraw/zinc/19/07/70/720190770.db2.gz XYIWFTNVHZWBST-YADARESESA-N 1 1 418.545 3.000 20 0 HGADMO CCOC(=O)c1c(C)nc(Cl)cc1N1CC[C@H]2[C@H]1CC[N@H+]2Cc1cccnc1 ZINC001164730325 720364359 /nfs/dbraw/zinc/36/43/59/720364359.db2.gz WSAJSNJLEXCPET-DLBZAZTESA-N 1 1 400.910 3.468 20 0 HGADMO CCOC(=O)c1ccc2ncnc(N3CC[C@H]4[C@@H]3CC[N@H+]4Cc3cccnc3)c2c1 ZINC001164725353 720384905 /nfs/dbraw/zinc/38/49/05/720384905.db2.gz MTGQAMCJLNXUQJ-SFTDATJTSA-N 1 1 403.486 3.055 20 0 HGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2C[C@@H]3COC[C@H](CC(=O)NC(C)C)[C@H]3C2)nc1 ZINC001164827194 720424090 /nfs/dbraw/zinc/42/40/90/720424090.db2.gz RSKNOZVCWKERNL-DXBBTUNJSA-N 1 1 414.594 3.242 20 0 HGADMO COC(=O)C[C@H](c1ccnc(N2CC[C@@H]3[C@@H]2CC[N@H+]3Cc2cccnc2)c1)C1CC1 ZINC001164731535 720429514 /nfs/dbraw/zinc/42/95/14/720429514.db2.gz LQDXAKXIKMEAKY-BDTNDASRSA-N 1 1 406.530 3.387 20 0 HGADMO COC(=O)C[C@H](c1ccnc(N2CC[C@H]3[C@H]2CC[N@H+]3Cc2cccnc2)c1)C1CC1 ZINC001164731537 720430377 /nfs/dbraw/zinc/43/03/77/720430377.db2.gz LQDXAKXIKMEAKY-FDFHNCONSA-N 1 1 406.530 3.387 20 0 HGADMO Cc1cc(N2CC[C@H]3[C@@H]2CC[N@H+]3Cc2cccnc2)nc(NC(=O)c2ccccc2)n1 ZINC001164731658 720467120 /nfs/dbraw/zinc/46/71/20/720467120.db2.gz XGFJKJOPVVWBRA-SFTDATJTSA-N 1 1 414.513 3.286 20 0 HGADMO O[C@@H]1CCN(c2ncnc3c2CC[N@H+](Cc2ccccc2)C3)[C@@H]1Cc1ccccc1 ZINC001164835428 720487682 /nfs/dbraw/zinc/48/76/82/720487682.db2.gz XYJQKEXYGSOOGR-DNQXCXABSA-N 1 1 400.526 3.217 20 0 HGADMO O[C@@H]1CCN(c2ncnc3c2CC[N@@H+](Cc2ccccc2)C3)[C@@H]1Cc1ccccc1 ZINC001164835428 720487685 /nfs/dbraw/zinc/48/76/85/720487685.db2.gz XYJQKEXYGSOOGR-DNQXCXABSA-N 1 1 400.526 3.217 20 0 HGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@H]2CN(C(F)(F)c3ccc(Cl)nn3)CC[C@@H]21 ZINC001164835277 720519690 /nfs/dbraw/zinc/51/96/90/720519690.db2.gz JNBHGXSXFYJDNV-JYJNAYRXSA-N 1 1 410.900 3.249 20 0 HGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@@H]2CN(c3nc(Cl)nc4cccnc43)CC[C@@H]21 ZINC001164840059 720521544 /nfs/dbraw/zinc/52/15/44/720521544.db2.gz WFIIDIQKALAFKX-RYRKJORJSA-N 1 1 411.941 3.253 20 0 HGADMO COc1nc2ccccc2nc1N1CC[C@@H]2[C@H](C[C@@H](Cn3cccn3)[N@H+]2C(C)C)C1 ZINC001164838524 720522381 /nfs/dbraw/zinc/52/23/81/720522381.db2.gz RNUFFZYDPSVOAM-LVCYWYKZSA-N 1 1 406.534 3.213 20 0 HGADMO Cc1c[nH]c2nc(Cl)nc(N3CC[C@@H]4[C@H](C[C@@H](Cn5cccn5)[N@@H+]4C(C)C)C3)c12 ZINC001164834925 720526516 /nfs/dbraw/zinc/52/65/16/720526516.db2.gz IGCKLHJXBRHXMO-IXDOHACOSA-N 1 1 413.957 3.494 20 0 HGADMO COc1ccc2ncc(N3CC[C@@H]4[C@@H](C[C@@H](Cn5cccn5)[N@H+]4C(C)C)C3)nc2c1 ZINC001164838089 720546076 /nfs/dbraw/zinc/54/60/76/720546076.db2.gz NUULEVMRVRDWOT-NPPFBWRTSA-N 1 1 406.534 3.213 20 0 HGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@H]2CN(c3nnc(Cl)c4cccnc43)CC[C@@H]21 ZINC001164841446 720546261 /nfs/dbraw/zinc/54/62/61/720546261.db2.gz VXRKUHMPJAEGQP-BQFCYCMXSA-N 1 1 411.941 3.253 20 0 HGADMO COc1ccc2nc(N3CC[C@@H]4[C@H](C[C@@H](Cn5cccn5)[N@H+]4C(C)C)C3)ncc2c1 ZINC001164836406 720551444 /nfs/dbraw/zinc/55/14/44/720551444.db2.gz JYYXVOAQRPWTIF-XQBPLPMBSA-N 1 1 406.534 3.213 20 0 HGADMO CCOC(=O)c1c(C)ccnc1N1CC[C@@H]2[C@@H](C[C@H](Cn3cccn3)[N@H+]2C(C)C)C1 ZINC001164839832 720576880 /nfs/dbraw/zinc/57/68/80/720576880.db2.gz OVUQBVVYQPAMRT-XUVXKRRUSA-N 1 1 411.550 3.141 20 0 HGADMO Cc1cc(N2CC[C@@H]3[C@@H](C[C@H](Cn4cccn4)[N@@H+]3C(C)C)C2)nc(-c2ccncc2)n1 ZINC001164839490 720597648 /nfs/dbraw/zinc/59/76/48/720597648.db2.gz NLHWPRQZAPLZJY-BHDDXSALSA-N 1 1 417.561 3.421 20 0 HGADMO Cc1noc(-c2cccnc2N2CC[C@@H]3[C@@H](C[C@@H](Cn4cccn4)[N@@H+]3C(C)C)C2)n1 ZINC001164837277 720606532 /nfs/dbraw/zinc/60/65/32/720606532.db2.gz HWOHTTQLFNSUOX-CMKODMSKSA-N 1 1 407.522 3.014 20 0 HGADMO CC(C)[N@@H+]1[C@@H]2CCN(c3ncnc(-c4cccc(F)c4)n3)C[C@@H]2C[C@H]1Cn1cccn1 ZINC001164841358 720615424 /nfs/dbraw/zinc/61/54/24/720615424.db2.gz RZFXVDWHUVEQBY-SESVDKBCSA-N 1 1 421.524 3.252 20 0 HGADMO C[N@@H+](Cc1ccccc1)[C@H]1COC2(C1)CCN(c1nc(Cl)nc3c1COC3)CC2 ZINC001164843835 720679337 /nfs/dbraw/zinc/67/93/37/720679337.db2.gz RHHBVRMDTVOYPC-QGZVFWFLSA-N 1 1 414.937 3.420 20 0 HGADMO COC(=O)c1cc(N2CCC3(C[C@H]([N@@H+](C)Cc4ccccc4)CO3)CC2)ncc1F ZINC001164844496 720679423 /nfs/dbraw/zinc/67/94/23/720679423.db2.gz SPBHDUFCPQQAQD-SFHVURJKSA-N 1 1 413.493 3.267 20 0 HGADMO CCNC(=O)c1ccc(N2CCC3(C[C@H]([N@@H+](C)Cc4ccccc4)CO3)CC2)nc1 ZINC001164840344 720709815 /nfs/dbraw/zinc/70/98/15/720709815.db2.gz PPFMBMPXRWSTGX-NRFANRHFSA-N 1 1 408.546 3.091 20 0 HGADMO C[N@@H+](Cc1ccc(N2CC[C@@H]3O[C@@H](COCc4ccccn4)CC[C@H]32)nc1)C1CC1 ZINC001164845174 720778032 /nfs/dbraw/zinc/77/80/32/720778032.db2.gz FIZPNCGBGJYNCC-ZLNRFVROSA-N 1 1 408.546 3.414 20 0 HGADMO Clc1nnc(N2CC[C@@H]3[C@@H](C[C@@H](Cn4cncn4)[N@H+]3CC3CC3)C2)c2ccccc12 ZINC001164740750 720814987 /nfs/dbraw/zinc/81/49/87/720814987.db2.gz AIXVYZSOQRPTJW-ABSDTBQOSA-N 1 1 423.952 3.254 20 0 HGADMO Cc1nc2cc(F)ccc2c(N2CC[C@@H]3[C@H](C[C@@H](Cn4cncn4)[N@H+]3CC3CC3)C2)n1 ZINC001164737657 720820107 /nfs/dbraw/zinc/82/01/07/720820107.db2.gz BHBAKFSPIQKXCJ-ZWCUEREDSA-N 1 1 421.524 3.048 20 0 HGADMO Clc1cccc2nc(N3CC[C@@H]4[C@@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)cnc12 ZINC001164738841 720822554 /nfs/dbraw/zinc/82/25/54/720822554.db2.gz HCOWYEPWMTXXMS-SQGPQFPESA-N 1 1 423.952 3.254 20 0 HGADMO CSc1cc(Cl)ncc1N1CC[C@@H]2[C@H](C[C@@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164738360 720824147 /nfs/dbraw/zinc/82/41/47/720824147.db2.gz FBECGFCZGHICCU-IXDOHACOSA-N 1 1 418.998 3.428 20 0 HGADMO Clc1cc(N2CC[C@@H]3[C@@H](C[C@H](Cn4cncn4)[N@H+]3CC3CC3)C2)c2cccnc2n1 ZINC001164737723 720825005 /nfs/dbraw/zinc/82/50/05/720825005.db2.gz CGXNJWBZJHUPRB-YQVWRLOYSA-N 1 1 423.952 3.254 20 0 HGADMO Clc1ccc2ncc(N3CC[C@@H]4[C@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)nc2c1 ZINC001164741395 720825098 /nfs/dbraw/zinc/82/50/98/720825098.db2.gz NTBVMPBLDHSJFO-HGHGUNKESA-N 1 1 423.952 3.254 20 0 HGADMO Clc1ccnc2cc(N3CC[C@@H]4[C@@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)ncc12 ZINC001164742114 720826008 /nfs/dbraw/zinc/82/60/08/720826008.db2.gz PWMYTJAHZKZCJG-XGHQBKJUSA-N 1 1 423.952 3.254 20 0 HGADMO CCOc1cc(Cl)nc(N2CC[C@@H]3[C@H](C[C@@H](Cn4cncn4)[N@H+]3CC3CC3)C2)c1 ZINC001164746111 720826912 /nfs/dbraw/zinc/82/69/12/720826912.db2.gz XYLVJYKYMNNOJR-ZIFCJYIRSA-N 1 1 416.957 3.105 20 0 HGADMO Fc1ccc2ccnc(N3CC[C@@H]4[C@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)c2c1 ZINC001164737369 720830513 /nfs/dbraw/zinc/83/05/13/720830513.db2.gz AKGXXJMTXDBSJY-SYYKKAFVSA-N 1 1 406.509 3.345 20 0 HGADMO Cc1nc(Cl)cc(N2CC[C@@H]3[C@@H](C[C@@H](Cn4cncn4)[N@H+]3CC3CC3)C2)c1C ZINC001164748799 720832044 /nfs/dbraw/zinc/83/20/44/720832044.db2.gz UYCDLQYMXYPZML-GBESFXJTSA-N 1 1 400.958 3.323 20 0 HGADMO Clc1ccc2nc(N3CC[C@@H]4[C@@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)ncc2c1 ZINC001164741171 720832264 /nfs/dbraw/zinc/83/22/64/720832264.db2.gz DNVHENNWRAJVKT-HFSMHLIXSA-N 1 1 423.952 3.254 20 0 HGADMO Cc1cc(Cl)c(C)nc1N1CC[C@@H]2[C@@H](C[C@@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164744503 720837326 /nfs/dbraw/zinc/83/73/26/720837326.db2.gz KJRAUTGZENXLSR-CMKODMSKSA-N 1 1 400.958 3.323 20 0 HGADMO Cc1cc(Cl)c(C)nc1N1CC[C@@H]2[C@H](C[C@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164744508 720837466 /nfs/dbraw/zinc/83/74/66/720837466.db2.gz KJRAUTGZENXLSR-QWFCFKBJSA-N 1 1 400.958 3.323 20 0 HGADMO Clc1ccnc2ccc(N3CC[C@@H]4[C@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)nc12 ZINC001164751082 720843327 /nfs/dbraw/zinc/84/33/27/720843327.db2.gz YKJZVVGTTTVZQO-FUHIMQAGSA-N 1 1 423.952 3.254 20 0 HGADMO c1ncn(C[C@@H]2C[C@@H]3CN(c4ccc(-c5ccncc5)cn4)CC[C@H]3[N@H+]2CC2CC2)n1 ZINC001164747723 720845210 /nfs/dbraw/zinc/84/52/10/720845210.db2.gz RMQGYGBRMZPDEL-XPWALMASSA-N 1 1 415.545 3.115 20 0 HGADMO Cc1cc(N2CC[C@@H]3[C@H](C[C@H](Cn4cncn4)[N@H+]3CC3CC3)C2)nc(C(C)(C)C)n1 ZINC001164744580 720851149 /nfs/dbraw/zinc/85/11/49/720851149.db2.gz KSJJDSIOIPMSOR-VAMGGRTRSA-N 1 1 409.582 3.053 20 0 HGADMO c1cc2ncc(N3CC[C@]4(C3)C[N@H+](CC3CC3)C[C@H]4COCc3cccnc3)nc2[nH]1 ZINC001164754875 720869909 /nfs/dbraw/zinc/86/99/09/720869909.db2.gz UILQXEOIOCGGIR-GBXCKJPGSA-N 1 1 418.545 3.108 20 0 HGADMO COc1ccnc(N2CC[C@@]3(C2)C[N@H+](CC2CC2)C[C@H]3COCc2cccnc2)c1 ZINC001164749057 720871822 /nfs/dbraw/zinc/87/18/22/720871822.db2.gz GPFQZWNBRLGFGJ-URXFXBBRSA-N 1 1 408.546 3.240 20 0 HGADMO COc1ccnc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COCc2cccnc2)c1 ZINC001164749057 720871824 /nfs/dbraw/zinc/87/18/24/720871824.db2.gz GPFQZWNBRLGFGJ-URXFXBBRSA-N 1 1 408.546 3.240 20 0 HGADMO CCOc1cnc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COCc2cccnc2)nc1 ZINC001164751580 720882136 /nfs/dbraw/zinc/88/21/36/720882136.db2.gz CNWQRHGLRXAQGY-URXFXBBRSA-N 1 1 423.561 3.025 20 0 HGADMO COCc1ccnc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COCc2cccnc2)c1 ZINC001164757183 720882577 /nfs/dbraw/zinc/88/25/77/720882577.db2.gz UEVPINJZCKAJIR-ILBGXUMGSA-N 1 1 422.573 3.378 20 0 HGADMO Cc1nc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COCc2cccnc2)ncc1F ZINC001164755059 720887122 /nfs/dbraw/zinc/88/71/22/720887122.db2.gz KMRNXVYJBRGGFU-NZQKXSOJSA-N 1 1 411.525 3.074 20 0 HGADMO CCc1nccc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COCc2cccnc2)n1 ZINC001164751663 720895922 /nfs/dbraw/zinc/89/59/22/720895922.db2.gz DBKUZRZVTQZXOV-URXFXBBRSA-N 1 1 407.562 3.189 20 0 HGADMO CCc1nccc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COCc2cccnc2)n1 ZINC001164751667 720896053 /nfs/dbraw/zinc/89/60/53/720896053.db2.gz DBKUZRZVTQZXOV-XUZZJYLKSA-N 1 1 407.562 3.189 20 0 HGADMO CCOc1cc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COCc2cccnc2)ncn1 ZINC001164748465 720909900 /nfs/dbraw/zinc/90/99/00/720909900.db2.gz GESKFSQEZZKDJW-URXFXBBRSA-N 1 1 423.561 3.025 20 0 HGADMO CCOC(=O)c1nc2ccccc2c(N2CCn3c(C[N@@H+](C)C(C)C)cnc3[C@H]2C)n1 ZINC001164855547 720930153 /nfs/dbraw/zinc/93/01/53/720930153.db2.gz IJFFNNPQAGKYEU-MRXNPFEDSA-N 1 1 422.533 3.424 20 0 HGADMO CCOC(=O)c1cc2ccc(N3CCn4c(C[N@@H+](C)C(C)C)cnc4[C@H]3C)[nH]c-2n1 ZINC001164862794 720984509 /nfs/dbraw/zinc/98/45/09/720984509.db2.gz UQPASAWZQCRPFX-OAHLLOKOSA-N 1 1 410.522 3.358 20 0 HGADMO CCOC(=O)c1cc2ccc(N3CCn4c(C[N@H+](C)C(C)C)cnc4[C@H]3C)nc2[nH]1 ZINC001164862794 720984522 /nfs/dbraw/zinc/98/45/22/720984522.db2.gz UQPASAWZQCRPFX-OAHLLOKOSA-N 1 1 410.522 3.358 20 0 HGADMO CCOC(=O)c1cc2ccc(N3CCn4c(C[N@@H+](C)C(C)C)cnc4[C@H]3C)nc2[nH]1 ZINC001164862794 720984540 /nfs/dbraw/zinc/98/45/40/720984540.db2.gz UQPASAWZQCRPFX-OAHLLOKOSA-N 1 1 410.522 3.358 20 0 HGADMO COc1cc(OC)c2ncnc(N3CCn4c(C[N@@H+](C)C(C)C)cnc4[C@@H]3C)c2c1 ZINC001164863969 721019947 /nfs/dbraw/zinc/01/99/47/721019947.db2.gz WCIKDOQWRVDCPX-HNNXBMFYSA-N 1 1 410.522 3.265 20 0 HGADMO COC(=O)[C@@H](C)c1c(Cl)ncnc1N1CCn2c(C[N@@H+](C)C(C)C)cnc2[C@H]1C ZINC001164858856 721022553 /nfs/dbraw/zinc/02/25/53/721022553.db2.gz IABAUWMZOJVHRO-UONOGXRCSA-N 1 1 420.945 3.024 20 0 HGADMO Clc1cc(-c2ccncc2)c(N2CC[N@H+]3C[C@@H](OCc4cccnc4)C[C@@H]3C2)nn1 ZINC001164869561 721057230 /nfs/dbraw/zinc/05/72/30/721057230.db2.gz UHWCUCKUBBDTHD-MOPGFXCFSA-N 1 1 422.920 3.067 20 0 HGADMO Fc1cccc2c1nc(Cl)nc2N1CC[N@H+]2C[C@H](OCc3cccnc3)C[C@@H]2C1 ZINC001164865752 721078895 /nfs/dbraw/zinc/07/88/95/721078895.db2.gz PGTZQVGAKSXWRZ-HZPDHXFCSA-N 1 1 413.884 3.297 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(C(F)(F)c4cc(Cl)nc(Cl)n4)C[C@@H]3C2)cn1 ZINC001164773732 721079320 /nfs/dbraw/zinc/07/93/20/721079320.db2.gz YDXFAAFOAZAINO-STQMWFEESA-N 1 1 417.291 3.020 20 0 HGADMO Cc1ccc2nc(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@@H]4C3)c(Cl)nc2c1 ZINC001164863944 721080108 /nfs/dbraw/zinc/08/01/08/721080108.db2.gz DKYPTTNWOIOMTF-MSOLQXFVSA-N 1 1 409.921 3.466 20 0 HGADMO Cc1cc(Cl)ncc1C(F)(F)N1CC[N@H+]2C[C@@H](OCc3cccnc3)C[C@@H]2C1 ZINC001164865569 721090230 /nfs/dbraw/zinc/09/02/30/721090230.db2.gz NBWPYCJUCBIDNA-SJORKVTESA-N 1 1 408.880 3.463 20 0 HGADMO Cc1cccc2nc(Cl)nc(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@@H]4C3)c12 ZINC001164866631 721118850 /nfs/dbraw/zinc/11/88/50/721118850.db2.gz UHQLXNZVJXZOKX-QZTJIDSGSA-N 1 1 409.921 3.466 20 0 HGADMO Cc1ccc(-c2ccc(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@H]4C3)nn2)cc1 ZINC001164880442 721137838 /nfs/dbraw/zinc/13/78/38/721137838.db2.gz WRVPPKWPIFZYTK-FCHUYYIVSA-N 1 1 401.514 3.327 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4nc(Cl)ccc4CN4CCCC4)C[C@H]3C2)cn1 ZINC001164774137 721149302 /nfs/dbraw/zinc/14/93/02/721149302.db2.gz ZVHCAJQUQYXCQS-AZUAARDMSA-N 1 1 414.985 3.023 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4nc(Cl)nc5c(Cl)nccc54)C[C@@H]3C2)cn1 ZINC001164762039 721190505 /nfs/dbraw/zinc/19/05/05/721190505.db2.gz CCTAQZYGCRCHOB-KGLIPLIRSA-N 1 1 418.332 3.023 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4cc5nc(Cl)cnc5cc4F)C[C@@H]3C2)cn1 ZINC001164768505 721214073 /nfs/dbraw/zinc/21/40/73/721214073.db2.gz LFCDNGSEJVJQBN-GJZGRUSLSA-N 1 1 400.889 3.114 20 0 HGADMO CCOc1ccc(-c2ccc(N3C[C@@H]4C[N@H+](Cc5cnn(C)c5)CC[C@@H]4C3)nn2)cc1 ZINC001164770102 721216822 /nfs/dbraw/zinc/21/68/22/721216822.db2.gz NBCPWSSIWJCMJX-RTWAWAEBSA-N 1 1 418.545 3.234 20 0 HGADMO CC(C)(c1ccnc(Cl)c1)[N@H+]1C[C@@H]2OCC[C@@H]2[C@@H](C(=O)NCc2cccnc2)C1 ZINC001164877443 721305650 /nfs/dbraw/zinc/30/56/50/721305650.db2.gz ITUKUPMWOJJDOR-QYZOEREBSA-N 1 1 414.937 3.018 20 0 HGADMO CC(C)(c1ccnc(Cl)c1)[NH+]1C[C@H]2CN(S(=O)(=O)c3ccccc3)C[C@@H]2C1 ZINC001164876898 721310365 /nfs/dbraw/zinc/31/03/65/721310365.db2.gz GZHMIKLHOKFRFX-HOTGVXAUSA-N 1 1 405.951 3.223 20 0 HGADMO CCC[N@H+]1CCCC[C@@H]1c1ccc(N2C[C@H]3OCCN(c4ccc(C)nn4)[C@H]3C2)nc1 ZINC001164777548 721313663 /nfs/dbraw/zinc/31/36/63/721313663.db2.gz SRGWVCGODSYLFG-BHIFYINESA-N 1 1 422.577 3.211 20 0 HGADMO C[NH+]1CCC(Oc2ccnc(N3CCO[C@@H]4C[C@@H](COc5ccccn5)C[C@@H]43)c2)CC1 ZINC001164880065 721315474 /nfs/dbraw/zinc/31/54/74/721315474.db2.gz PAJRMBSLQPYMBF-YUXAGFNASA-N 1 1 424.545 3.012 20 0 HGADMO CN(C)C1=[NH+]OC2(C1)CCN(C(F)(F)COC(=O)Nc1ccc(Cl)nc1)CC2 ZINC001164874001 721327762 /nfs/dbraw/zinc/32/77/62/721327762.db2.gz FNVARGZIXABVDM-UHFFFAOYSA-N 1 1 417.844 3.006 20 0 HGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@@]2(CCCN(c3ncnc4c3CCCC4)C2)C1 ZINC001164778203 721347308 /nfs/dbraw/zinc/34/73/08/721347308.db2.gz KWEURQKTPLVFFW-QHCPKHFHSA-N 1 1 411.550 3.079 20 0 HGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@@]2(CCCN(c3ncnc4c3CCCC4)C2)C1 ZINC001164778203 721347311 /nfs/dbraw/zinc/34/73/11/721347311.db2.gz KWEURQKTPLVFFW-QHCPKHFHSA-N 1 1 411.550 3.079 20 0 HGADMO COc1cnc(N2CCC[C@]3(C2)COCC[N@@H+](Cc2c(C)noc2C)C3)c(C)c1 ZINC001164779033 721348562 /nfs/dbraw/zinc/34/85/62/721348562.db2.gz PCELVPLBTSWXNG-QFIPXVFZSA-N 1 1 400.523 3.122 20 0 HGADMO COc1cc(Cl)cc(N2CCC[C@@]3(C2)COCC[N@H+](Cc2c(C)noc2C)C3)n1 ZINC001164779113 721348896 /nfs/dbraw/zinc/34/88/96/721348896.db2.gz RCYUUEVOQSIJBG-OAQYLSRUSA-N 1 1 420.941 3.467 20 0 HGADMO COc1cc(Cl)cc(N2CCC[C@@]3(C2)COCC[N@@H+](Cc2c(C)noc2C)C3)n1 ZINC001164779113 721348899 /nfs/dbraw/zinc/34/88/99/721348899.db2.gz RCYUUEVOQSIJBG-OAQYLSRUSA-N 1 1 420.941 3.467 20 0 HGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@]2(CCCN(c3cc(C(C)(C)C)ncn3)C2)C1 ZINC001164787113 721366820 /nfs/dbraw/zinc/36/68/20/721366820.db2.gz ZGFZKQWYQUWCAP-HSZRJFAPSA-N 1 1 413.566 3.498 20 0 HGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@]2(CCCN(c3cc(C(C)(C)C)ncn3)C2)C1 ZINC001164787113 721366824 /nfs/dbraw/zinc/36/68/24/721366824.db2.gz ZGFZKQWYQUWCAP-HSZRJFAPSA-N 1 1 413.566 3.498 20 0 HGADMO C[NH+]1CCN(C[C@@H]2CCC[C@@]3(CCN(C(F)(F)c4cccnc4Cl)C3)O2)CC1 ZINC001164892141 721381678 /nfs/dbraw/zinc/38/16/78/721381678.db2.gz RVSDXRGNBHZTAN-LPHOPBHVSA-N 1 1 414.928 3.045 20 0 HGADMO CCOC(=O)c1c(Cl)cc(C)nc1N1C[C@H]2C[NH+](Cc3nccs3)C[C@@H]2C1 ZINC001164785057 721392294 /nfs/dbraw/zinc/39/22/94/721392294.db2.gz KTYYXFDEOPLBQU-ZIAGYGMSSA-N 1 1 406.939 3.245 20 0 HGADMO COCc1cc(N2C[C@@H]3C[NH+](Cc4nccs4)C[C@H]3C2)nc(-c2ccccc2)n1 ZINC001164790715 721393110 /nfs/dbraw/zinc/39/31/10/721393110.db2.gz XMDJCLUJYVJHNU-ROUUACIJSA-N 1 1 407.543 3.315 20 0 HGADMO O=C(NCc1ccccc1)c1cccnc1N1C[C@@H]2C[N@@H+](Cc3nccs3)C[C@@H]2C1 ZINC001164783423 721394408 /nfs/dbraw/zinc/39/44/08/721394408.db2.gz HZWCTFPOHGWABN-KDURUIRLSA-N 1 1 419.554 3.036 20 0 HGADMO O=C(NCc1ccccc1)c1cccnc1N1C[C@@H]2C[N@H+](Cc3nccs3)C[C@@H]2C1 ZINC001164783423 721394411 /nfs/dbraw/zinc/39/44/11/721394411.db2.gz HZWCTFPOHGWABN-KDURUIRLSA-N 1 1 419.554 3.036 20 0 HGADMO COc1cccc2ccc(N3CC[C@]4(C3)CCC[C@@H](CN3CC[NH+](C)CC3)O4)nc21 ZINC001164893618 721395752 /nfs/dbraw/zinc/39/57/52/721395752.db2.gz WEKQOOQWPCDCCW-RDPSFJRHSA-N 1 1 410.562 3.009 20 0 HGADMO C[NH+]1CCN(C[C@@H]2CCC[C@@]3(CCN(c4nccc(Oc5ccccc5)n4)C3)O2)CC1 ZINC001164884309 721396674 /nfs/dbraw/zinc/39/66/74/721396674.db2.gz AAKPIFLSEWYCTQ-URXFXBBRSA-N 1 1 423.561 3.034 20 0 HGADMO C[NH+]1CCN(C[C@@H]2CCC[C@]3(CCN(c4ncnc5cc(Cl)ccc54)C3)O2)CC1 ZINC001164887676 721401148 /nfs/dbraw/zinc/40/11/48/721401148.db2.gz MDPMKZSLFIDZKW-PGRDOPGGSA-N 1 1 415.969 3.049 20 0 HGADMO COc1cccc2c1nc(Cl)nc2N1C[C@@H]2C[N@@H+](Cc3nccs3)C[C@@H]2C1 ZINC001164783567 721409540 /nfs/dbraw/zinc/40/95/40/721409540.db2.gz IZVQFURTVOFMBR-BETUJISGSA-N 1 1 401.923 3.317 20 0 HGADMO COc1cccc2c1nc(Cl)nc2N1C[C@@H]2C[N@H+](Cc3nccs3)C[C@@H]2C1 ZINC001164783567 721409543 /nfs/dbraw/zinc/40/95/43/721409543.db2.gz IZVQFURTVOFMBR-BETUJISGSA-N 1 1 401.923 3.317 20 0 HGADMO C[NH+]1CCN(C[C@H]2CCC[C@@]3(CCN(c4cc5c(Cl)ccnc5cn4)C3)O2)CC1 ZINC001164893002 721421259 /nfs/dbraw/zinc/42/12/59/721421259.db2.gz ZUXCSUANCPIBOW-VGSWGCGISA-N 1 1 415.969 3.049 20 0 HGADMO COC(=O)C[C@@H](c1ccnc(N2C[C@@H]3C[N@@H+](Cc4nccs4)C[C@@H]3C2)c1)C1CC1 ZINC001164787348 721423818 /nfs/dbraw/zinc/42/38/18/721423818.db2.gz QGPODZSMJDHFFR-CEXWTWQISA-N 1 1 412.559 3.163 20 0 HGADMO COC(=O)C[C@@H](c1ccnc(N2C[C@@H]3C[N@H+](Cc4nccs4)C[C@@H]3C2)c1)C1CC1 ZINC001164787348 721423821 /nfs/dbraw/zinc/42/38/21/721423821.db2.gz QGPODZSMJDHFFR-CEXWTWQISA-N 1 1 412.559 3.163 20 0 HGADMO C[NH+]1CCN(C[C@H]2CCC[C@]3(CCN(c4ccc5nccc(Cl)c5n4)C3)O2)CC1 ZINC001164894926 721429001 /nfs/dbraw/zinc/42/90/01/721429001.db2.gz NKVOIRPTHUHLRH-VGOFRKELSA-N 1 1 415.969 3.049 20 0 HGADMO Cc1c(Cl)cnc(Cl)c1N1CC[C@@]2(C1)CCC[C@H](CN1CC[NH+](C)CC1)O2 ZINC001164892248 721429246 /nfs/dbraw/zinc/42/92/46/721429246.db2.gz HUDWMBZRMNMKFN-OXQOHEQNSA-N 1 1 413.393 3.462 20 0 HGADMO C[NH+]1CCN(C[C@H]2CCC[C@@]3(CCN(c4ccc5nccc(Cl)c5n4)C3)O2)CC1 ZINC001164894927 721429496 /nfs/dbraw/zinc/42/94/96/721429496.db2.gz NKVOIRPTHUHLRH-VGSWGCGISA-N 1 1 415.969 3.049 20 0 HGADMO Cc1c[nH]c2nc(Cl)cc(N3CC[C@]4(C3)CCC[C@@H](CN3CC[NH+](C)CC3)O4)c12 ZINC001164896750 721431933 /nfs/dbraw/zinc/43/19/33/721431933.db2.gz RXABZOJGSYYLLE-JTSKRJEESA-N 1 1 417.985 3.290 20 0 HGADMO Cc1nc(C2CC2)nc(Cl)c1N1CC[C@@]2(C1)CCC[C@@H](CN1CC[NH+](C)CC1)O2 ZINC001164895374 721438333 /nfs/dbraw/zinc/43/83/33/721438333.db2.gz OCJCIDIORRNUHZ-PGRDOPGGSA-N 1 1 420.001 3.081 20 0 HGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1cnc3ccccc3n1)CC2 ZINC001164787783 721451470 /nfs/dbraw/zinc/45/14/70/721451470.db2.gz QMHZCOQJUNNGEL-FQEVSTJZSA-N 1 1 410.562 3.364 20 0 HGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1cc(Cl)nnc1C)CC2 ZINC001164790388 721454840 /nfs/dbraw/zinc/45/48/40/721454840.db2.gz YRUGDRBAJLBOEZ-GOSISDBHSA-N 1 1 408.974 3.172 20 0 HGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1ncnc3c1CCCC3)CC2 ZINC001164782740 721457660 /nfs/dbraw/zinc/45/76/60/721457660.db2.gz BHUGEVIJPUEZJE-HXUWFJFHSA-N 1 1 414.594 3.089 20 0 HGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1ccnc(C3CC3)n1)CC2 ZINC001164784254 721462291 /nfs/dbraw/zinc/46/22/91/721462291.db2.gz HFTIFHRMPRHCIX-HXUWFJFHSA-N 1 1 400.567 3.088 20 0 HGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1nccc(C(C)C)n1)CC2 ZINC001164789360 721462951 /nfs/dbraw/zinc/46/29/51/721462951.db2.gz XJALUXFZWYJIOD-FQEVSTJZSA-N 1 1 402.583 3.334 20 0 HGADMO CCc1nc(C)cc(N2CCC3(C[C@@H](COCC4CC4)[N@@H+](CCOC)C3)CC2)n1 ZINC001164791332 721467475 /nfs/dbraw/zinc/46/74/75/721467475.db2.gz XDANIAGEGBEWDS-FQEVSTJZSA-N 1 1 402.583 3.081 20 0 HGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1c(Cl)nccc1OC)CC2 ZINC001164788028 721470177 /nfs/dbraw/zinc/47/01/77/721470177.db2.gz HPPUPGKBRKUNLZ-SFHVURJKSA-N 1 1 423.985 3.478 20 0 HGADMO COCCOC(=O)c1ccnc(N2CCC3(CC([N@@H+](C)Cc4ccncc4)C3)CC2)c1 ZINC001164797025 721502997 /nfs/dbraw/zinc/50/29/97/721502997.db2.gz XKBXMILCCLMYNR-UHFFFAOYSA-N 1 1 424.545 3.161 20 0 HGADMO COC(=O)c1cnc(N2CC[N@H+]3C[C@@H](Oc4cccc(F)c4)C[C@@H]3C2)c(Cl)c1 ZINC001164900465 721508478 /nfs/dbraw/zinc/50/84/78/721508478.db2.gz RCQMGVOYLYJVAZ-WBVHZDCISA-N 1 1 405.857 3.003 20 0 HGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2ccc(-c3ccccc3)nn2)[C@H]2CCCO[C@@H]12 ZINC001164805554 721536334 /nfs/dbraw/zinc/53/63/34/721536334.db2.gz MHFCOCOUYDGTGS-WMTXJRDZSA-N 1 1 401.514 3.407 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2ccc(-c3ccccc3)nn2)[C@H]2CCCO[C@@H]12 ZINC001164805554 721536336 /nfs/dbraw/zinc/53/63/36/721536336.db2.gz MHFCOCOUYDGTGS-WMTXJRDZSA-N 1 1 401.514 3.407 20 0 HGADMO CSc1nc2ncnc(N3CC[N@H+]4C[C@H](Oc5cccc(F)c5)C[C@@H]4C3)c2s1 ZINC001164909327 721545055 /nfs/dbraw/zinc/54/50/55/721545055.db2.gz RLAYZLUSALVLOV-UKRRQHHQSA-N 1 1 417.535 3.289 20 0 HGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2ccc(C(=O)OC(C)(C)C)cn2)[C@@H]2CCCO[C@@H]12 ZINC001164805704 721553314 /nfs/dbraw/zinc/55/33/14/721553314.db2.gz MYEGBJYVLXJDSX-KCZVDYSFSA-N 1 1 424.545 3.300 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2ccc(C(=O)OC(C)(C)C)cn2)[C@@H]2CCCO[C@@H]12 ZINC001164805704 721553317 /nfs/dbraw/zinc/55/33/17/721553317.db2.gz MYEGBJYVLXJDSX-KCZVDYSFSA-N 1 1 424.545 3.300 20 0 HGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN([C@H](F)Oc2ccc(Cl)nc2)[C@@H]2CCCO[C@@H]12 ZINC001164805368 721554025 /nfs/dbraw/zinc/55/40/25/721554025.db2.gz MZIQSOZAMVBKKU-LFGUQSLTSA-N 1 1 406.889 3.126 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN([C@H](F)Oc2ccc(Cl)nc2)[C@@H]2CCCO[C@@H]12 ZINC001164805368 721554028 /nfs/dbraw/zinc/55/40/28/721554028.db2.gz MZIQSOZAMVBKKU-LFGUQSLTSA-N 1 1 406.889 3.126 20 0 HGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN([C@H](F)Oc2ccc(Cl)nc2)[C@H]2CCCO[C@@H]12 ZINC001164805365 721554125 /nfs/dbraw/zinc/55/41/25/721554125.db2.gz MZIQSOZAMVBKKU-CUDHKJQZSA-N 1 1 406.889 3.126 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN([C@H](F)Oc2ccc(Cl)nc2)[C@H]2CCCO[C@@H]12 ZINC001164805365 721554132 /nfs/dbraw/zinc/55/41/32/721554132.db2.gz MZIQSOZAMVBKKU-CUDHKJQZSA-N 1 1 406.889 3.126 20 0 HGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2ncnc3[nH]c4ccccc4c32)[C@@H]2CCCO[C@H]12 ZINC001164800392 721560160 /nfs/dbraw/zinc/56/01/60/721560160.db2.gz FJYLHKCUUCKVCY-SJBKTWHCSA-N 1 1 414.513 3.374 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2ncnc3[nH]c4ccccc4c32)[C@@H]2CCCO[C@H]12 ZINC001164800392 721560163 /nfs/dbraw/zinc/56/01/63/721560163.db2.gz FJYLHKCUUCKVCY-SJBKTWHCSA-N 1 1 414.513 3.374 20 0 HGADMO CCOc1ccc(Cl)nc1N1C[C@H]([N@H+](C)Cc2cccnc2)[C@@H]2OCCC[C@H]21 ZINC001164799725 721560709 /nfs/dbraw/zinc/56/07/09/721560709.db2.gz DIJDQERWRDMLLS-FUHIMQAGSA-N 1 1 402.926 3.397 20 0 HGADMO CCOc1ccc(Cl)nc1N1C[C@H]([N@@H+](C)Cc2cccnc2)[C@@H]2OCCC[C@H]21 ZINC001164799725 721560712 /nfs/dbraw/zinc/56/07/12/721560712.db2.gz DIJDQERWRDMLLS-FUHIMQAGSA-N 1 1 402.926 3.397 20 0 HGADMO Fc1cccc(O[C@H]2C[C@@H]3CN(c4cc(-c5nc(C6CC6)no5)ccn4)CC[N@H+]3C2)c1 ZINC001164910449 721562933 /nfs/dbraw/zinc/56/29/33/721562933.db2.gz WZIMIDPETLMIQL-QUCCMNQESA-N 1 1 421.476 3.490 20 0 HGADMO COc1cc(C)c2ncnc(N3CC[N@H+]4C[C@@H](Oc5cccc(F)c5)C[C@H]4C3)c2c1 ZINC001164903498 721568581 /nfs/dbraw/zinc/56/85/81/721568581.db2.gz BODFJROYDKXBPS-PXNSSMCTSA-N 1 1 408.477 3.428 20 0 HGADMO CCOC(=O)c1cccnc1N1CCC(F)(F)[C@]2(CC[N@@H+](Cc3ccccn3)C2)C1 ZINC001164906182 721584803 /nfs/dbraw/zinc/58/48/03/721584803.db2.gz LXROPWUNEIZORS-NRFANRHFSA-N 1 1 416.472 3.391 20 0 HGADMO CSc1cc(N2C[C@H]([N@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@H]32)nc(SC)n1 ZINC001164800691 721590168 /nfs/dbraw/zinc/59/01/68/721590168.db2.gz CLWFQNKUEABXRM-JTDSTZFVSA-N 1 1 417.604 3.184 20 0 HGADMO CSc1cc(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@H]32)nc(SC)n1 ZINC001164800691 721590169 /nfs/dbraw/zinc/59/01/69/721590169.db2.gz CLWFQNKUEABXRM-JTDSTZFVSA-N 1 1 417.604 3.184 20 0 HGADMO COC(=O)c1cc(N2CCC(F)(F)[C@@]3(CC[N@@H+](Cc4ccccn4)C3)C2)ncc1F ZINC001164906655 721696680 /nfs/dbraw/zinc/69/66/80/721696680.db2.gz NZYWWCWKFFUHNS-HXUWFJFHSA-N 1 1 420.435 3.140 20 0 HGADMO COC(=O)c1cnc(N2CCc3c(C[N@H+](C)Cc4ccco4)cncc3C2)c(F)c1 ZINC001164908461 721752693 /nfs/dbraw/zinc/75/26/93/721752693.db2.gz JSTKQSXAULTGAK-UHFFFAOYSA-N 1 1 410.449 3.190 20 0 HGADMO COC(=O)c1cnc(N2CCc3c(C[N@@H+](C)Cc4ccco4)cncc3C2)c(F)c1 ZINC001164908461 721752696 /nfs/dbraw/zinc/75/26/96/721752696.db2.gz JSTKQSXAULTGAK-UHFFFAOYSA-N 1 1 410.449 3.190 20 0 HGADMO CCOC(=O)Cc1ccnc(N2CCc3c(C[N@H+](C)Cc4ccco4)cncc3C2)c1 ZINC001164909627 721765231 /nfs/dbraw/zinc/76/52/31/721765231.db2.gz DJVYXCGJNOGFRU-UHFFFAOYSA-N 1 1 420.513 3.370 20 0 HGADMO CCOC(=O)Cc1ccnc(N2CCc3c(C[N@@H+](C)Cc4ccco4)cncc3C2)c1 ZINC001164909627 721765235 /nfs/dbraw/zinc/76/52/35/721765235.db2.gz DJVYXCGJNOGFRU-UHFFFAOYSA-N 1 1 420.513 3.370 20 0 HGADMO Clc1ccc2c(ccnc2N2CCO[C@]3(C2)COCC[N@H+](Cc2cccnc2)C3)c1 ZINC001164910456 721778392 /nfs/dbraw/zinc/77/83/92/721778392.db2.gz BTYPLQYYEPNRGL-HSZRJFAPSA-N 1 1 424.932 3.391 20 0 HGADMO Clc1ccc2c(ccnc2N2CCO[C@]3(C2)COCC[N@@H+](Cc2cccnc2)C3)c1 ZINC001164910456 721778395 /nfs/dbraw/zinc/77/83/95/721778395.db2.gz BTYPLQYYEPNRGL-HSZRJFAPSA-N 1 1 424.932 3.391 20 0 HGADMO COC(=O)c1cc(F)c(C)nc1N1C[C@@H]2CCC[C@@H]([N@@H+](C)Cc3ccccn3)[C@H]2C1 ZINC001165023585 721812258 /nfs/dbraw/zinc/81/22/58/721812258.db2.gz HYLJCIMQTFGXQR-NBHGPNQESA-N 1 1 412.509 3.448 20 0 HGADMO C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@@H]2CN(c3nc(Cl)cc4c3CNC4=O)C[C@@H]21 ZINC001165028990 721816984 /nfs/dbraw/zinc/81/69/84/721816984.db2.gz YLDNPMWITLWBQA-MDASCCDHSA-N 1 1 411.937 3.110 20 0 HGADMO C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@@H]2CN(c3cc(C(=O)N4CCCC4)ccn3)C[C@@H]21 ZINC001165026128 721819135 /nfs/dbraw/zinc/81/91/35/721819135.db2.gz PHSGHJNCGZXCHK-AKIFATBCSA-N 1 1 419.573 3.450 20 0 HGADMO COc1cnc2c(c1)ncnc2N1C[C@@H]2CCC[C@H]([N@@H+](C)Cc3ccccn3)[C@H]2C1 ZINC001165025920 721820870 /nfs/dbraw/zinc/82/08/70/721820870.db2.gz OESPJYOWAFULLV-LRQRDZAKSA-N 1 1 404.518 3.165 20 0 HGADMO COC(=O)c1ccc(-c2ccc(N3CC[C@@H]4[C@@H]3CC[N@H+]4CCN(C)C)nc2C)cc1 ZINC001164922387 721876399 /nfs/dbraw/zinc/87/63/99/721876399.db2.gz GKFZZNBRNCROKP-YADHBBJMSA-N 1 1 408.546 3.058 20 0 HGADMO COC(=O)c1ccc(-c2ccc(N3CC[C@@H]4[C@@H]3CCN4CC[NH+](C)C)nc2C)cc1 ZINC001164922387 721876402 /nfs/dbraw/zinc/87/64/02/721876402.db2.gz GKFZZNBRNCROKP-YADHBBJMSA-N 1 1 408.546 3.058 20 0 HGADMO CN(C)CC[N@@H+]1CC[C@H]2[C@@H]1CCN2c1cnc(Cl)nc1Oc1ccc(F)cc1 ZINC001164935515 721880546 /nfs/dbraw/zinc/88/05/46/721880546.db2.gz XEZONICYRXHDGP-IRXDYDNUSA-N 1 1 405.905 3.276 20 0 HGADMO CN(C)CC[N@H+]1CC[C@H]2[C@@H]1CCN2c1cnc(Cl)nc1Oc1ccc(F)cc1 ZINC001164935515 721880548 /nfs/dbraw/zinc/88/05/48/721880548.db2.gz XEZONICYRXHDGP-IRXDYDNUSA-N 1 1 405.905 3.276 20 0 HGADMO Cc1ccc(Oc2nc(Cl)ncc2N2CC[C@@H]3[C@@H]2CC[N@H+]3CCN(C)C)cc1 ZINC001164933626 721888289 /nfs/dbraw/zinc/88/82/89/721888289.db2.gz NMCWHDFLNQKVGG-MSOLQXFVSA-N 1 1 401.942 3.445 20 0 HGADMO Cc1ccc(Oc2nc(Cl)ncc2N2CC[C@@H]3[C@@H]2CC[N@@H+]3CCN(C)C)cc1 ZINC001164933626 721888290 /nfs/dbraw/zinc/88/82/90/721888290.db2.gz NMCWHDFLNQKVGG-MSOLQXFVSA-N 1 1 401.942 3.445 20 0 HGADMO O=C(Nc1ccc(Cl)nc1)c1ccc(F)c(N2CC[NH+](C[C@@H]3CCCO3)CC2)c1 ZINC001165038511 721909475 /nfs/dbraw/zinc/90/94/75/721909475.db2.gz LUJHDKHWRWGUKE-KRWDZBQOSA-N 1 1 418.900 3.427 20 0 HGADMO Clc1ccc(C[NH+]2CCCC2)c(N2CCCn3cnc(Cn4cccn4)c3C2)n1 ZINC001164940068 721915278 /nfs/dbraw/zinc/91/52/78/721915278.db2.gz YLEFBYRWNHJUJA-UHFFFAOYSA-N 1 1 411.941 3.182 20 0 HGADMO COC(=O)c1cnc(N2CCC3(CC2)C[N@@H+](Cc2ccc(C)cc2)CCO3)c(C)c1 ZINC001164940414 721923963 /nfs/dbraw/zinc/92/39/63/721923963.db2.gz PXYQSFIQXKQPHE-UHFFFAOYSA-N 1 1 409.530 3.356 20 0 HGADMO Cc1ccc(C[N@H+]2CCOC3(CCN(c4ncc(OC(F)F)cn4)CC3)C2)cc1 ZINC001164940217 721928075 /nfs/dbraw/zinc/92/80/75/721928075.db2.gz SLLKASKFJSYTCC-UHFFFAOYSA-N 1 1 404.461 3.258 20 0 HGADMO CC(=O)N1CC[C@]2(c3ccccc3)CCN(c3ccc(C[N@H+](C)C4CC4)cn3)C[C@@H]12 ZINC001164947817 721967630 /nfs/dbraw/zinc/96/76/30/721967630.db2.gz RNIUQHIOUGNEQR-NOZRDPDXSA-N 1 1 404.558 3.445 20 0 HGADMO O=C1NCC[N@@H+](Cc2ccccc2)C12CCN(c1cc(Cl)nc3c1CCC3)CC2 ZINC001164943775 721972180 /nfs/dbraw/zinc/97/21/80/721972180.db2.gz DVYCNVKMDDYVCY-UHFFFAOYSA-N 1 1 410.949 3.195 20 0 HGADMO O=C1NCC[N@H+](Cc2ccccc2)C12CCN(c1cc(Cl)nc3c1CCC3)CC2 ZINC001164943775 721972181 /nfs/dbraw/zinc/97/21/81/721972181.db2.gz DVYCNVKMDDYVCY-UHFFFAOYSA-N 1 1 410.949 3.195 20 0 HGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2CC[C@@]3(C2)C[C@@H](NC(=O)N(C)C)CCO3)nc1 ZINC001164954099 722010896 /nfs/dbraw/zinc/01/08/96/722010896.db2.gz IFKISUYRFHJCKC-MZKRTTBSSA-N 1 1 415.582 3.028 20 0 HGADMO Clc1ncc(OCc2ccccc2)c(N2CC[NH+](CCc3ccccn3)CC2)n1 ZINC001165056320 722013502 /nfs/dbraw/zinc/01/35/02/722013502.db2.gz SOGCIUGJEZPWEJ-UHFFFAOYSA-N 1 1 409.921 3.469 20 0 HGADMO Fc1ccc2nc(N3CCC4(CC3)COCC[N@@H+](Cc3ccncc3)C4)ncc2c1 ZINC001164962196 722058507 /nfs/dbraw/zinc/05/85/07/722058507.db2.gz POJJIHFGQGZBAV-UHFFFAOYSA-N 1 1 407.493 3.283 20 0 HGADMO c1cc(C[N@H+]2CCOCC3(CCN(c4ccc(-c5ccncc5)nn4)CC3)C2)ccn1 ZINC001164963383 722060772 /nfs/dbraw/zinc/06/07/72/722060772.db2.gz XXJAJJXTGHIBDR-UHFFFAOYSA-N 1 1 416.529 3.053 20 0 HGADMO CCc1cc(Cl)nc(N2CCC3(CC2)COCC[N@@H+](Cc2ccncc2)C3)n1 ZINC001164966342 722061578 /nfs/dbraw/zinc/06/15/78/722061578.db2.gz REGAXQYIULCXNE-UHFFFAOYSA-N 1 1 401.942 3.206 20 0 HGADMO Fc1cccc2c(Cl)nc(C(F)(F)N3C[C@@H]4C[N@@H+](CC5CC5)C[C@H](C3)O4)nc12 ZINC001164965782 722069718 /nfs/dbraw/zinc/06/97/18/722069718.db2.gz MSSQTPBXUPJKTA-BETUJISGSA-N 1 1 412.843 3.267 20 0 HGADMO Fc1cccc2c(Cl)nc(C(F)(F)N3C[C@@H]4C[N@H+](CC5CC5)C[C@H](C3)O4)nc12 ZINC001164965782 722069720 /nfs/dbraw/zinc/06/97/20/722069720.db2.gz MSSQTPBXUPJKTA-BETUJISGSA-N 1 1 412.843 3.267 20 0 HGADMO O=C(Nc1cccc(Cl)c1)c1ccc(N2C[C@@H]3C[N@H+](CC4CC4)C[C@H](C2)O3)nc1 ZINC001164966571 722075864 /nfs/dbraw/zinc/07/58/64/722075864.db2.gz BRFRTPLJKBGQEI-BGYRXZFFSA-N 1 1 412.921 3.287 20 0 HGADMO Cc1nc2ccc(F)cc2c(N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)n1 ZINC001164984671 722107990 /nfs/dbraw/zinc/10/79/90/722107990.db2.gz TWXHELHCSBGPOQ-GCJKJVERSA-N 1 1 407.493 3.200 20 0 HGADMO FC(F)(Oc1cccc(Cl)n1)N1CC[C@H]2C[N@@H+](Cc3cccnc3)CCO[C@@H]2C1 ZINC001164982065 722108596 /nfs/dbraw/zinc/10/85/96/722108596.db2.gz VVPZVEQZUOYGIM-DLBZAZTESA-N 1 1 424.879 3.282 20 0 HGADMO Clc1cccc2nc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)cnc12 ZINC001164982020 722110163 /nfs/dbraw/zinc/11/01/63/722110163.db2.gz VSWBZNYTRFFBLZ-YLJYHZDGSA-N 1 1 409.921 3.406 20 0 HGADMO Clc1ccc2nc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)cnc2c1 ZINC001164975663 722110726 /nfs/dbraw/zinc/11/07/26/722110726.db2.gz KEQIMXURVIJJDY-UTKZUKDTSA-N 1 1 409.921 3.406 20 0 HGADMO CCc1cc2c(ncnc2N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)s1 ZINC001164977398 722115285 /nfs/dbraw/zinc/11/52/85/722115285.db2.gz NASISJQHKTZNKT-FXAWDEMLSA-N 1 1 409.559 3.376 20 0 HGADMO Clc1ccc2c(cnnc2N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)c1 ZINC001164981165 722121627 /nfs/dbraw/zinc/12/16/27/722121627.db2.gz TZMGALLBHGFTCJ-LAUBAEHRSA-N 1 1 409.921 3.406 20 0 HGADMO c1ccc2c(c1)[nH]c1ncnc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)c21 ZINC001164976398 722123904 /nfs/dbraw/zinc/12/39/04/722123904.db2.gz LNTWVRFKXNLGLE-GHTZIAJQSA-N 1 1 414.513 3.233 20 0 HGADMO Fc1ccc(-c2ccc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)nn2)cc1 ZINC001164976120 722145574 /nfs/dbraw/zinc/14/55/74/722145574.db2.gz HGYTXDWOHLMPFG-NFBKMPQASA-N 1 1 419.504 3.405 20 0 HGADMO c1ccc(Cc2nccc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)n2)cc1 ZINC001164985053 722147368 /nfs/dbraw/zinc/14/73/68/722147368.db2.gz ZATCDMUFLIUBBL-DHIUTWEWSA-N 1 1 415.541 3.190 20 0 HGADMO c1cc(-c2ccc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)nn2)cs1 ZINC001164976198 722152271 /nfs/dbraw/zinc/15/22/71/722152271.db2.gz UWJGXGLYAVDELH-WIYYLYMNSA-N 1 1 407.543 3.327 20 0 HGADMO CCOC(=O)c1cnc(OC)nc1N1CCC[C@@]2(CC[N@H+]2Cc2cccc(F)c2)C1 ZINC001164995116 722198204 /nfs/dbraw/zinc/19/82/04/722198204.db2.gz RSYWPKAHBJCSMD-JOCHJYFZSA-N 1 1 414.481 3.046 20 0 HGADMO C[N@@H+](Cc1ccc(N2CC[C@]3(CC(=O)N(c4ccc5c(c4)OCO5)C3)C2)nc1)C1CC1 ZINC001164996873 722220275 /nfs/dbraw/zinc/22/02/75/722220275.db2.gz BFRVDTUTVFGLKN-DEOSSOPVSA-N 1 1 420.513 3.038 20 0 HGADMO Cc1ccc2cc(Cl)nc(N3CCc4ncnc(N5CC[NH+](C)CC5)c4CC3)c2c1 ZINC001164996726 722235335 /nfs/dbraw/zinc/23/53/35/722235335.db2.gz INFVSTCZMMFJBY-UHFFFAOYSA-N 1 1 422.964 3.344 20 0 HGADMO Cc1cc(N2CCc3ncnc(N4CC[NH+](C)CC4)c3CC2)nc2c(Cl)cccc12 ZINC001164996623 722236037 /nfs/dbraw/zinc/23/60/37/722236037.db2.gz HGNZGTCYJYXONG-UHFFFAOYSA-N 1 1 422.964 3.344 20 0 HGADMO OCC1([NH2+]Cc2nc(-c3cccc(Br)c3)no2)Cc2ccccc2C1 ZINC000512327744 1126095488 /nfs/dbraw/zinc/09/54/88/1126095488.db2.gz FMRRLZHPDGZXLU-UHFFFAOYSA-N 1 1 400.276 3.119 20 0 HGADMO O[C@@H](C(F)F)[C@@H](Cc1ccccc1)[NH2+]Cc1ncc(I)s1 ZINC000511996451 1126095646 /nfs/dbraw/zinc/09/56/46/1126095646.db2.gz HQRMVBDZNVFWPM-ZWNOBZJWSA-N 1 1 424.254 3.075 20 0 HGADMO C[C@](CO)(Cc1ccc(Br)cc1)[NH2+]Cc1nc(CC(F)(F)F)no1 ZINC001473839303 1126199652 /nfs/dbraw/zinc/19/96/52/1126199652.db2.gz XKYADOAZMNEIGV-CQSZACIVSA-N 1 1 408.218 3.020 20 0 HGADMO CC(C)(C)C(=O)Nc1ccnc(N2CCC23CCCC3)c1C[N@@H+]1CC[C@H](CO)C1 ZINC001164400010 718845157 /nfs/dbraw/zinc/84/51/57/718845157.db2.gz NEJVDSVPTACFHO-KRWDZBQOSA-N 1 1 400.567 3.403 20 0 HGADMO CC(C)(C)C(=O)Nc1ccnc(N2CCC23CCCC3)c1C[N@H+]1CC[C@H](CO)C1 ZINC001164400010 718845159 /nfs/dbraw/zinc/84/51/59/718845159.db2.gz NEJVDSVPTACFHO-KRWDZBQOSA-N 1 1 400.567 3.403 20 0 HGADMO O=C1Nc2ccccc2[C@@H]2CN(c3ncnc4c3CC[N@H+](Cc3ccccc3)C4)C[C@H]12 ZINC001164403211 718856640 /nfs/dbraw/zinc/85/66/40/718856640.db2.gz ICJILAXKQTZMQO-SFTDATJTSA-N 1 1 411.509 3.207 20 0 HGADMO O=C1Nc2ccccc2[C@@H]2CN(c3ncnc4c3CC[N@@H+](Cc3ccccc3)C4)C[C@H]12 ZINC001164403211 718856641 /nfs/dbraw/zinc/85/66/41/718856641.db2.gz ICJILAXKQTZMQO-SFTDATJTSA-N 1 1 411.509 3.207 20 0 HGADMO CCOC(=O)[C@@]12C[C@@H]1CCN2c1nc(C[NH+]2CCCC2)nc2sc(C)c(C)c21 ZINC001164624116 719041446 /nfs/dbraw/zinc/04/14/46/719041446.db2.gz NZDMASFBNWILNO-YCRPNKLZSA-N 1 1 400.548 3.436 20 0 HGADMO O=C(NC1CCCC1)c1ccc(N2CCC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)nn1 ZINC001164629597 719103877 /nfs/dbraw/zinc/10/38/77/719103877.db2.gz SUAZLCYBIQCOMB-DENIHFKCSA-N 1 1 405.546 3.250 20 0 HGADMO C[C@@H]1C[N@H+](C)[C@@H](C)CN1c1cc(NS(=O)(=O)c2ccc(Cl)nc2)ccc1F ZINC001164638429 719245153 /nfs/dbraw/zinc/24/51/53/719245153.db2.gz YVRRNYXBJPLHHK-QWHCGFSZSA-N 1 1 412.918 3.204 20 0 HGADMO C[C@@H]1C[N@@H+](C)[C@@H](C)CN1c1cc(NS(=O)(=O)c2ccc(Cl)nc2)ccc1F ZINC001164638429 719245156 /nfs/dbraw/zinc/24/51/56/719245156.db2.gz YVRRNYXBJPLHHK-QWHCGFSZSA-N 1 1 412.918 3.204 20 0 HGADMO COc1cc2ncnc(N3CCc4c(C[NH+](C)C)nn(C(C)C)c4C3)c2c(OC)c1 ZINC001164647504 719311777 /nfs/dbraw/zinc/31/17/77/719311777.db2.gz BVTJTIOJQUMWHW-UHFFFAOYSA-N 1 1 410.522 3.049 20 0 HGADMO COC(=O)c1cc2ccccc2nc1N1CCc2c(C[NH+](C)C)nn(C(C)C)c2C1 ZINC001164647545 719312828 /nfs/dbraw/zinc/31/28/28/719312828.db2.gz CRTHJZMXSTYNES-UHFFFAOYSA-N 1 1 407.518 3.423 20 0 HGADMO CC(C)n1nc(C[NH+](C)C)c2c1CN(c1ccc(C(=O)N3CCC[C@@H](C)C3)cn1)CC2 ZINC001164650439 719315233 /nfs/dbraw/zinc/31/52/33/719315233.db2.gz DLQCWNXBSRLLNY-GOSISDBHSA-N 1 1 424.593 3.355 20 0 HGADMO CNC(=O)C[N@H+]1CCCC12CCN(c1ncc(OC)c3ccc(Cl)cc31)CC2 ZINC001164687614 719720113 /nfs/dbraw/zinc/72/01/13/719720113.db2.gz ZSYFXGICFIPYFS-UHFFFAOYSA-N 1 1 402.926 3.078 20 0 HGADMO COC(=O)c1cnc(N2CCC3(CCC[N@H+]3Cc3csc(C)n3)CC2)cc1OC ZINC001164691237 719804536 /nfs/dbraw/zinc/80/45/36/719804536.db2.gz GHVRKAMKTLPALD-UHFFFAOYSA-N 1 1 416.547 3.277 20 0 HGADMO Cc1cc(Cl)nc(N2CCC3(CC2)C[N@@H+](Cc2cccs2)CCO3)c1C(N)=O ZINC001164694879 719886972 /nfs/dbraw/zinc/88/69/72/719886972.db2.gz GPRNLPSEZKVRBQ-UHFFFAOYSA-N 1 1 420.966 3.075 20 0 HGADMO COC(=O)c1ccc(C)nc1N1CCC2(CC1)C[N@@H+](Cc1cccs1)CCO2 ZINC001164695656 719887262 /nfs/dbraw/zinc/88/72/62/719887262.db2.gz PKJIXWLBEBATFA-UHFFFAOYSA-N 1 1 401.532 3.110 20 0 HGADMO COC(=O)c1cc(Cl)nc(N2CCC3(CC2)C[N@@H+](Cc2cccs2)CCO3)c1 ZINC001164695684 719887436 /nfs/dbraw/zinc/88/74/36/719887436.db2.gz QTICBDCREDIJLZ-UHFFFAOYSA-N 1 1 421.950 3.455 20 0 HGADMO CNC(=O)c1nc(N2CCC3(CC2)C[N@@H+](Cc2cccs2)CCO3)ccc1Cl ZINC001164697644 719894369 /nfs/dbraw/zinc/89/43/69/719894369.db2.gz MLHKRDLEYTWXTG-UHFFFAOYSA-N 1 1 420.966 3.028 20 0 HGADMO c1csc(C[N@H+]2CCOC3(CCN(c4ncnc5c4ncn5C4CC4)CC3)C2)c1 ZINC001164705486 719898341 /nfs/dbraw/zinc/89/83/41/719898341.db2.gz CHRMALTXWLUQSF-UHFFFAOYSA-N 1 1 410.547 3.094 20 0 HGADMO CCOC(=O)c1cnc(Cl)cc1N1CC[C@@]2(C1)C[N@@H+](CC1CC1)C[C@@H]2COC ZINC001164809742 720069100 /nfs/dbraw/zinc/06/91/00/720069100.db2.gz JTEUMGUEMNZPKX-IERDGZPVSA-N 1 1 407.942 3.096 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1nc(Cl)nc3[nH]cc(Cl)c31)C2 ZINC001164812714 720070154 /nfs/dbraw/zinc/07/01/54/720070154.db2.gz RHNNGVGZWAEJQS-YJYMSZOUSA-N 1 1 410.349 3.449 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(C(F)(F)c1cc(Cl)nc(OC)c1)C2 ZINC001164811408 720079781 /nfs/dbraw/zinc/07/97/81/720079781.db2.gz OGKGWXLTVCNLSA-VQIMIIECSA-N 1 1 415.912 3.473 20 0 HGADMO COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1nc(C)nc3ccoc31)CC2 ZINC001164710368 720094669 /nfs/dbraw/zinc/09/46/69/720094669.db2.gz JHNQNSJPCCOSOG-IBGZPJMESA-N 1 1 407.518 3.434 20 0 HGADMO COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1nc(Cl)ncc1F)CC2 ZINC001164709945 720095320 /nfs/dbraw/zinc/09/53/20/720095320.db2.gz DCCHSMPUHRNDHS-INIZCTEOSA-N 1 1 405.905 3.172 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(C(F)(F)c1cc(C)nc(Cl)n1)C2 ZINC001164812351 720097685 /nfs/dbraw/zinc/09/76/85/720097685.db2.gz QTKNGDNURCGOKO-CRAIPNDOSA-N 1 1 400.901 3.168 20 0 HGADMO COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1ncc(C(=O)OC)cc1C)CC2 ZINC001164718056 720107929 /nfs/dbraw/zinc/10/79/29/720107929.db2.gz RDBYMYYORRGGPE-NRFANRHFSA-N 1 1 424.545 3.079 20 0 HGADMO COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1ncnc3[nH]c(C)c(C)c31)CC2 ZINC001164718051 720120882 /nfs/dbraw/zinc/12/08/82/720120882.db2.gz RBGOQGLGDCQQRS-HXUWFJFHSA-N 1 1 420.561 3.477 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1nc(Cl)nc3sc(C)nc31)C2 ZINC001164813127 720124854 /nfs/dbraw/zinc/12/48/54/720124854.db2.gz PPJBPLAGXSPWEI-IFXJQAMLSA-N 1 1 407.971 3.233 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1nc(Cl)nc3cccc(OC)c31)C2 ZINC001164814372 720125137 /nfs/dbraw/zinc/12/51/37/720125137.db2.gz SDIDVPXIZIUKQK-AOMKIAJQSA-N 1 1 416.953 3.477 20 0 HGADMO CCCN(CCC)c1cc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COC)ncn1 ZINC001164807412 720144776 /nfs/dbraw/zinc/14/47/76/720144776.db2.gz CGMYRGZZWIBCLB-NZQKXSOJSA-N 1 1 401.599 3.288 20 0 HGADMO CCCN(CCC)c1cc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COC)ncn1 ZINC001164807415 720144969 /nfs/dbraw/zinc/14/49/69/720144969.db2.gz CGMYRGZZWIBCLB-OFNKIYASSA-N 1 1 401.599 3.288 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1cncc(Oc3cccc(OC)c3)n1)C2 ZINC001164813322 720145834 /nfs/dbraw/zinc/14/58/34/720145834.db2.gz QFDVVPCEEDQKBV-YADARESESA-N 1 1 424.545 3.462 20 0 HGADMO COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1nccnc1OC(C)C)CC2 ZINC001164710830 720149750 /nfs/dbraw/zinc/14/97/50/720149750.db2.gz DKFAOGOAKZXDOR-FQEVSTJZSA-N 1 1 411.550 3.166 20 0 HGADMO COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1cnc3c(n1)CCCC3)CC2 ZINC001164713952 720151298 /nfs/dbraw/zinc/15/12/98/720151298.db2.gz UIAPJFKYHZPHQA-FQEVSTJZSA-N 1 1 407.562 3.258 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1nc(-c3ccncc3)nc3c1CCC3)C2 ZINC001164816669 720186027 /nfs/dbraw/zinc/18/60/27/720186027.db2.gz MAXMQSMYMWRVPH-CJFMBICVSA-N 1 1 419.573 3.212 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1ncnc3c1ncn3-c1ccccc1)C2 ZINC001164819737 720190645 /nfs/dbraw/zinc/19/06/45/720190645.db2.gz XYIWFTNVHZWBST-NTKDMRAZSA-N 1 1 418.545 3.000 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1nc(Cl)cc(-c3ccncc3)n1)C2 ZINC001164812687 720196009 /nfs/dbraw/zinc/19/60/09/720196009.db2.gz LXEFSTKLUWXGKG-GCJKJVERSA-N 1 1 413.953 3.377 20 0 HGADMO CC(C)[N@@H+](C)Cc1cc(=O)n2c(n1)CN(c1nc3ccccc3nc1Cl)CCC2 ZINC001164814086 720218845 /nfs/dbraw/zinc/21/88/45/720218845.db2.gz SOXRSFMCBOJWIA-UHFFFAOYSA-N 1 1 412.925 3.090 20 0 HGADMO CC(C)[N@@H+](C)Cc1cc(=O)n2c(n1)CN(c1cc3c(Cl)ccnc3cn1)CCC2 ZINC001164813452 720229677 /nfs/dbraw/zinc/22/96/77/720229677.db2.gz MNGPWWKCCJDMMV-UHFFFAOYSA-N 1 1 412.925 3.090 20 0 HGADMO CC(C)[N@@H+](C)Cc1cc(=O)n2c(n1)CN(c1ccc3nccc(Cl)c3n1)CCC2 ZINC001164814511 720232089 /nfs/dbraw/zinc/23/20/89/720232089.db2.gz WKSPOMFPJZGUDK-UHFFFAOYSA-N 1 1 412.925 3.090 20 0 HGADMO CCOC(=O)c1sc2ncnc(N3CC[C@H]4[C@@H]3CC[N@H+]4Cc3cccnc3)c2c1C ZINC001164728392 720329956 /nfs/dbraw/zinc/32/99/56/720329956.db2.gz VLLHWSNPOQLXGW-IRXDYDNUSA-N 1 1 423.542 3.425 20 0 HGADMO O=C(NCc1ccccc1)c1cccnc1N1CC[C@H]2[C@@H]1CC[N@H+]2Cc1cccnc1 ZINC001164729817 720341757 /nfs/dbraw/zinc/34/17/57/720341757.db2.gz YIRQRCWYTQYXOM-GOTSBHOMSA-N 1 1 413.525 3.260 20 0 HGADMO C[NH+]1CCC(CN2C(=O)CC[C@@H]3[C@@H]2CCN3C(C)(C)c2ccnc(Cl)c2)CC1 ZINC001164831099 720355494 /nfs/dbraw/zinc/35/54/94/720355494.db2.gz XNTGKCDVZGEKDM-RBUKOAKNSA-N 1 1 404.986 3.377 20 0 HGADMO C[C@@H]1CCCN(C(=O)c2ccc(N3CC[C@H]4[C@H]3CC[N@H+]4Cc3cccnc3)nc2)C1 ZINC001164731479 720435781 /nfs/dbraw/zinc/43/57/81/720435781.db2.gz KWNMNGMOPYWHMW-BVYCBKJFSA-N 1 1 405.546 3.202 20 0 HGADMO c1cncc(C[N@H+]2CC[C@H]3[C@H]2CCN3c2ccc(-c3ccc4c(c3)OCCO4)nn2)c1 ZINC001164734743 720441971 /nfs/dbraw/zinc/44/19/71/720441971.db2.gz TZXBXDOVVJNCPI-RTWAWAEBSA-N 1 1 415.497 3.163 20 0 HGADMO O[C@@H]1CCN(c2ncnc3c2CC[N@H+](Cc2ccccc2)C3)[C@H]1Cc1ccccc1 ZINC001164835426 720487689 /nfs/dbraw/zinc/48/76/89/720487689.db2.gz XYJQKEXYGSOOGR-BJKOFHAPSA-N 1 1 400.526 3.217 20 0 HGADMO O[C@@H]1CCN(c2ncnc3c2CC[N@@H+](Cc2ccccc2)C3)[C@H]1Cc1ccccc1 ZINC001164835426 720487691 /nfs/dbraw/zinc/48/76/91/720487691.db2.gz XYJQKEXYGSOOGR-BJKOFHAPSA-N 1 1 400.526 3.217 20 0 HGADMO CC(C)[N@@H+]1[C@@H]2CCN(C(F)(F)c3cnc(Cl)cn3)C[C@@H]2C[C@H]1Cn1cccn1 ZINC001164832973 720514048 /nfs/dbraw/zinc/51/40/48/720514048.db2.gz CEWQGSAJTCUYOG-HRCADAONSA-N 1 1 410.900 3.249 20 0 HGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@H]2CN(c3nc(Cl)nc4ncccc43)CC[C@@H]21 ZINC001164839434 720518055 /nfs/dbraw/zinc/51/80/55/720518055.db2.gz UJIUINWAKBQVLD-BQFCYCMXSA-N 1 1 411.941 3.253 20 0 HGADMO Cc1c[nH]c2nc(Cl)nc(N3CC[C@@H]4[C@H](C[C@H](Cn5cccn5)[N@@H+]4C(C)C)C3)c12 ZINC001164834923 720525797 /nfs/dbraw/zinc/52/57/97/720525797.db2.gz IGCKLHJXBRHXMO-BRWVUGGUSA-N 1 1 413.957 3.494 20 0 HGADMO CCOc1nc(Cl)cc(N2CC[C@@H]3[C@@H](C[C@@H](Cn4cccn4)[N@H+]3C(C)C)C2)n1 ZINC001164836570 720528008 /nfs/dbraw/zinc/52/80/08/720528008.db2.gz NGFAEHJFVORBAU-YESZJQIVSA-N 1 1 404.946 3.103 20 0 HGADMO COc1cc2c(cc1F)ncnc2N1CC[C@@H]2[C@H](C[C@H](Cn3cccn3)[N@H+]2C(C)C)C1 ZINC001164840203 720569867 /nfs/dbraw/zinc/56/98/67/720569867.db2.gz SDPWJIQEJODWKN-CBGDNZLLSA-N 1 1 424.524 3.352 20 0 HGADMO COc1cc2c(cc1F)ncnc2N1CC[C@@H]2[C@@H](C[C@@H](Cn3cccn3)[N@H+]2C(C)C)C1 ZINC001164840206 720571383 /nfs/dbraw/zinc/57/13/83/720571383.db2.gz SDPWJIQEJODWKN-XGHQBKJUSA-N 1 1 424.524 3.352 20 0 HGADMO COC(=O)/C=C/c1cc(C)cnc1N1CC[C@@H]2[C@H](C[C@@H](Cn3cccn3)[N@H+]2C(C)C)C1 ZINC001164842213 720579737 /nfs/dbraw/zinc/57/97/37/720579737.db2.gz UMDXKJOVRYTKOS-YDITYBEASA-N 1 1 423.561 3.151 20 0 HGADMO COc1cccc2ncnc(N3CC[C@@H]4[C@H](C[C@H](Cn5cccn5)[N@H+]4C(C)C)C3)c21 ZINC001164837171 720610545 /nfs/dbraw/zinc/61/05/45/720610545.db2.gz HJEHKXSDWPPBRU-QWFCFKBJSA-N 1 1 406.534 3.213 20 0 HGADMO Cc1noc(-c2ccc(N3CC[C@@H]4[C@@H](C[C@@H](Cn5cccn5)[N@@H+]4C(C)C)C3)nc2)n1 ZINC001164838379 720613301 /nfs/dbraw/zinc/61/33/01/720613301.db2.gz KVRSXOOETXUVJT-SLFFLAALSA-N 1 1 407.522 3.014 20 0 HGADMO COc1nc(Cl)cc(N2CCC3(C[C@H]([N@@H+](C)Cc4ccccc4)CO3)CC2)n1 ZINC001164841905 720661487 /nfs/dbraw/zinc/66/14/87/720661487.db2.gz QXMJBJKMWHGUKS-KRWDZBQOSA-N 1 1 402.926 3.399 20 0 HGADMO CCOC(=O)c1cnc(C)nc1N1CCC2(C[C@H]([N@@H+](C)Cc3ccccc3)CO2)CC1 ZINC001164842693 720678720 /nfs/dbraw/zinc/67/87/20/720678720.db2.gz MRZWLXPIRBKLRP-FQEVSTJZSA-N 1 1 424.545 3.222 20 0 HGADMO COC(=O)c1cc(N2CCC3(C[C@@H]([N@@H+](C)Cc4ccccc4)CO3)CC2)ncc1F ZINC001164844495 720679849 /nfs/dbraw/zinc/67/98/49/720679849.db2.gz SPBHDUFCPQQAQD-GOSISDBHSA-N 1 1 413.493 3.267 20 0 HGADMO Clc1cccc2c1nc(Cl)nc2N1CC[N@H+]2C[C@@H](Oc3cncnc3)C[C@@H]2C1 ZINC001164742031 720680978 /nfs/dbraw/zinc/68/09/78/720680978.db2.gz VLTQBIZZYKXHFY-OLZOCXBDSA-N 1 1 417.300 3.069 20 0 HGADMO COc1nc(N2CCC3(C[C@@H]([N@@H+](C)Cc4ccccc4)CO3)CC2)nc2c1ccn2C ZINC001164842277 720726553 /nfs/dbraw/zinc/72/65/53/720726553.db2.gz XKQSABDCBXQUDZ-LJQANCHMSA-N 1 1 421.545 3.237 20 0 HGADMO c1cc(N(c2nc(N3CCCC3)nc3c2CNCC3)C2CC2)ncc1C[NH+]1CCCC1 ZINC001164843416 720743910 /nfs/dbraw/zinc/74/39/10/720743910.db2.gz JJLZEPKTXPYXPQ-UHFFFAOYSA-N 1 1 419.577 3.014 20 0 HGADMO Cc1nc2sc3c(c2c(N2CC[N@H+]4C[C@H](Oc5cncnc5)C[C@H]4C2)n1)CCCC3 ZINC001164738504 720757033 /nfs/dbraw/zinc/75/70/33/720757033.db2.gz FVDMPTPZSDMJMA-JKSUJKDBSA-N 1 1 422.558 3.010 20 0 HGADMO Clc1cccc2c1ncnc2N1CC[C@@H]2[C@H](C[C@@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164743331 720817175 /nfs/dbraw/zinc/81/71/75/720817175.db2.gz SGGIBFJQUAUQPY-FUHIMQAGSA-N 1 1 423.952 3.254 20 0 HGADMO Clc1cccc2nc(N3CC[C@@H]4[C@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)ncc12 ZINC001164743586 720833054 /nfs/dbraw/zinc/83/30/54/720833054.db2.gz JJZMOQFAIJGHLF-LLGFUMIMSA-N 1 1 423.952 3.254 20 0 HGADMO Cc1cc(Cl)c(C)c(N2CC[C@@H]3[C@@H](C[C@@H](Cn4cncn4)[N@H+]3CC3CC3)C2)n1 ZINC001164739369 720833437 /nfs/dbraw/zinc/83/34/37/720833437.db2.gz ACXVYWJEGRGXKU-CMKODMSKSA-N 1 1 400.958 3.323 20 0 HGADMO Clc1ccc2cnc(N3CC[C@@H]4[C@@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)nc2c1 ZINC001164748750 720833949 /nfs/dbraw/zinc/83/39/49/720833949.db2.gz UVMFJQWIOLVYCN-FBBABVLZSA-N 1 1 423.952 3.254 20 0 HGADMO CC(C)(C)Oc1cccc(N2CC[C@@H]3[C@H](C[C@H](Cn4cncn4)[N@H+]3CC3CC3)C2)n1 ZINC001164740469 720834020 /nfs/dbraw/zinc/83/40/20/720834020.db2.gz BWRUSSPGIVIRKE-VAMGGRTRSA-N 1 1 410.566 3.230 20 0 HGADMO COCC[N@H+]1CCO[C@@H]2CN(C(F)(F)c3cc(Cl)cnc3Cl)CC[C@@H]2C1 ZINC001164856520 720837042 /nfs/dbraw/zinc/83/70/42/720837042.db2.gz WSDOOMZNMKRDRA-IUODEOHRSA-N 1 1 410.292 3.107 20 0 HGADMO Cc1cc(Cl)c(C)nc1N1CC[C@@H]2[C@H](C[C@@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164744510 720837291 /nfs/dbraw/zinc/83/72/91/720837291.db2.gz KJRAUTGZENXLSR-WSTZPKSXSA-N 1 1 400.958 3.323 20 0 HGADMO COc1cc(N2CC[C@@H]3[C@@H](C[C@H](Cn4cncn4)[N@H+]3CC3CC3)C2)nc2ccccc21 ZINC001164744686 720839833 /nfs/dbraw/zinc/83/98/33/720839833.db2.gz LDBRUSWCTTYLFM-NNMXDRDESA-N 1 1 418.545 3.214 20 0 HGADMO c1csc(-c2cc(N3CC[C@@H]4[C@H](C[C@H](Cn5cncn5)[N@@H+]4CC4CC4)C3)ncn2)c1 ZINC001164749504 720850118 /nfs/dbraw/zinc/85/01/18/720850118.db2.gz VYAZNYQLOSJPEE-QWFCFKBJSA-N 1 1 421.574 3.176 20 0 HGADMO Cc1cc(N2CC[C@@H]3[C@H](C[C@@H](Cn4cncn4)[N@H+]3CC3CC3)C2)nc(C(C)(C)C)n1 ZINC001164744573 720850968 /nfs/dbraw/zinc/85/09/68/720850968.db2.gz KSJJDSIOIPMSOR-HSALFYBXSA-N 1 1 409.582 3.053 20 0 HGADMO CCc1nc2sccc2c(N2CC[C@@H]3[C@H](C[C@@H](Cn4cncn4)[N@H+]3CC3CC3)C2)n1 ZINC001164745999 720854178 /nfs/dbraw/zinc/85/41/78/720854178.db2.gz FBSXUAJGPGUQKV-ZIFCJYIRSA-N 1 1 423.590 3.225 20 0 HGADMO COCC[N@H+]1CCO[C@H]2CN(c3cc(Cl)nc4cc(OC)ccc43)CC[C@@H]2C1 ZINC001164862162 720854228 /nfs/dbraw/zinc/85/42/28/720854228.db2.gz ZEOKMXXLBJXXRB-QRWLVFNGSA-N 1 1 405.926 3.070 20 0 HGADMO c1ncn(C[C@H]2C[C@@H]3CN(c4nccc5c6c([nH]c54)CCC6)CC[C@H]3[N@H+]2CC2CC2)n1 ZINC001164753862 720857466 /nfs/dbraw/zinc/85/74/66/720857466.db2.gz YUWJZZIGOPYDQE-JBYIUTFZSA-N 1 1 417.561 3.023 20 0 HGADMO Clc1cnc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COCc2cccnc2)nc1 ZINC001164750145 720868020 /nfs/dbraw/zinc/86/80/20/720868020.db2.gz JAXBGGZCTGEYNL-SIKLNZKXSA-N 1 1 413.953 3.280 20 0 HGADMO Clc1cnc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COCc2cccnc2)nc1 ZINC001164750146 720868128 /nfs/dbraw/zinc/86/81/28/720868128.db2.gz JAXBGGZCTGEYNL-UGKGYDQZSA-N 1 1 413.953 3.280 20 0 HGADMO CCOc1cncc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COCc2cccnc2)n1 ZINC001164753927 720869094 /nfs/dbraw/zinc/86/90/94/720869094.db2.gz QKNSQKOWFOGBEN-QPPBQGQZSA-N 1 1 423.561 3.025 20 0 HGADMO COc1ccnc(N2CC[C@@]3(C2)C[N@H+](CC2CC2)C[C@@H]3COCc2cccnc2)c1 ZINC001164749055 720871635 /nfs/dbraw/zinc/87/16/35/720871635.db2.gz GPFQZWNBRLGFGJ-QPPBQGQZSA-N 1 1 408.546 3.240 20 0 HGADMO COc1ccnc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COCc2cccnc2)c1 ZINC001164749055 720871636 /nfs/dbraw/zinc/87/16/36/720871636.db2.gz GPFQZWNBRLGFGJ-QPPBQGQZSA-N 1 1 408.546 3.240 20 0 HGADMO COCC[N@H+]1CCO[C@H]2CN(c3cc(C(C)(C)C)nc(C(C)(C)C)n3)CC[C@H]2C1 ZINC001164863099 720873771 /nfs/dbraw/zinc/87/37/71/720873771.db2.gz SNJXKOPMMXYZBQ-ROUUACIJSA-N 1 1 404.599 3.245 20 0 HGADMO Cc1cc(C)c(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COCc2cccnc2)nn1 ZINC001164757863 720882251 /nfs/dbraw/zinc/88/22/51/720882251.db2.gz VXUZAPCYIIWCGR-ISKFKSNPSA-N 1 1 407.562 3.244 20 0 HGADMO Cc1ncnc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COCc2cccnc2)c1C ZINC001164755723 720884052 /nfs/dbraw/zinc/88/40/52/720884052.db2.gz NFCDOYZNSFLEGY-ISKFKSNPSA-N 1 1 407.562 3.244 20 0 HGADMO CCc1cc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COCc2cccnc2)nc(C)n1 ZINC001164755921 720897170 /nfs/dbraw/zinc/89/71/70/720897170.db2.gz NFSIOQBUNMEOHB-RDGATRHJSA-N 1 1 421.589 3.498 20 0 HGADMO CCc1cc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COCc2cccnc2)ncn1 ZINC001164750629 720915129 /nfs/dbraw/zinc/91/51/29/720915129.db2.gz JXXIHVKRMXBGEJ-XUZZJYLKSA-N 1 1 407.562 3.189 20 0 HGADMO COC(=O)c1ccc2ncnc(N3CCn4c(C[N@@H+](C)C(C)C)cnc4[C@@H]3C)c2c1 ZINC001164859114 720935460 /nfs/dbraw/zinc/93/54/60/720935460.db2.gz OWYDIDZWGWJNGB-HNNXBMFYSA-N 1 1 408.506 3.034 20 0 HGADMO COC(=O)/C=C\c1cc2cc[nH]c2c(N2CCn3c(C[N@@H+](C)C(C)C)cnc3[C@@H]2C)n1 ZINC001164859669 720987030 /nfs/dbraw/zinc/98/70/30/720987030.db2.gz KZAGSZJKXGLYOZ-WLMCBFPDSA-N 1 1 422.533 3.367 20 0 HGADMO COc1cc(C(F)(F)N2CCn3c(C[N@@H+](C)C(C)C)cnc3[C@@H]2C)nc(Cl)n1 ZINC001164857265 721022712 /nfs/dbraw/zinc/02/27/12/721022712.db2.gz BYYIJFPPNXNOOJ-LBPRGKRZSA-N 1 1 414.888 3.301 20 0 HGADMO Fc1ccc2nc(Cl)nc(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@@H]4C3)c2c1 ZINC001164868736 721055520 /nfs/dbraw/zinc/05/55/20/721055520.db2.gz QEIAVNRWQBHIAY-SJORKVTESA-N 1 1 413.884 3.297 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4ccc(-c5ccc(Cl)cc5)nn4)C[C@@H]3C2)cn1 ZINC001164766616 721086910 /nfs/dbraw/zinc/08/69/10/721086910.db2.gz KYSNERGQJCIDDL-MOPGFXCFSA-N 1 1 408.937 3.489 20 0 HGADMO Cc1cc(Cl)ncc1C(F)(F)N1CC[N@H+]2C[C@@H](OCc3cccnc3)C[C@H]2C1 ZINC001164865568 721090602 /nfs/dbraw/zinc/09/06/02/721090602.db2.gz NBWPYCJUCBIDNA-IRXDYDNUSA-N 1 1 408.880 3.463 20 0 HGADMO CCc1c(Cl)nnc(N2CC[N@H+]3C[C@H](OCc4cccnc4)C[C@@H]3C2)c1CC ZINC001164865763 721091590 /nfs/dbraw/zinc/09/15/90/721091590.db2.gz PHDKRSVTTQTSCM-IAGOWNOFSA-N 1 1 401.942 3.130 20 0 HGADMO Cc1ccc2c(c1)nc(Cl)nc2N1CC[N@H+]2C[C@@H](OCc3cccnc3)C[C@@H]2C1 ZINC001164867736 721092149 /nfs/dbraw/zinc/09/21/49/721092149.db2.gz ZUITZFORKIZSNK-MSOLQXFVSA-N 1 1 409.921 3.466 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4cc(C(=O)Nc5ccccc5)ccn4)C[C@H]3C2)cn1 ZINC001164773675 721138147 /nfs/dbraw/zinc/13/81/47/721138147.db2.gz YQDJBKALVQWTLY-LEWJYISDSA-N 1 1 416.529 3.026 20 0 HGADMO Cc1nc2c3ccccc3oc2c(N2C[C@@H]3CC[N@H+](Cc4cnn(C)c4)C[C@H]3C2)n1 ZINC001164771380 721163257 /nfs/dbraw/zinc/16/32/57/721163257.db2.gz SLQNHJRHBIMIBU-ROUUACIJSA-N 1 1 402.502 3.376 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4ccc(-c5ccccc5Cl)nn4)C[C@H]3C2)cn1 ZINC001164768527 721165285 /nfs/dbraw/zinc/16/52/85/721165285.db2.gz LHGRLKZCVHNGDI-QZTJIDSGSA-N 1 1 408.937 3.489 20 0 HGADMO c1ccc(Oc2nccnc2N2CC[N@H+]3C[C@@H](OCc4cccnc4)C[C@@H]3C2)cc1 ZINC001164880714 721171170 /nfs/dbraw/zinc/17/11/70/721171170.db2.gz XFFPBOWCGUYYJV-CTNGQTDRSA-N 1 1 403.486 3.144 20 0 HGADMO Cc1cc(-c2ccccc2F)nnc1N1CC[N@H+]2C[C@@H](OCc3cccnc3)C[C@@H]2C1 ZINC001164876479 721181331 /nfs/dbraw/zinc/18/13/31/721181331.db2.gz MRWODYFUMIPJRW-UXHICEINSA-N 1 1 419.504 3.466 20 0 HGADMO CCc1nc(Cl)nc(Cl)c1N1CC[N@H+]2C[C@@H](OCc3cccnc3)C[C@@H]2C1 ZINC001164866458 721183928 /nfs/dbraw/zinc/18/39/28/721183928.db2.gz AXJJTHLDXBMCGQ-CABCVRRESA-N 1 1 408.333 3.221 20 0 HGADMO Cc1cnc(N2CC[N@H+]3C[C@@H](OCc4cccnc4)C[C@H]3C2)nc1-c1ccccc1F ZINC001164875428 721184262 /nfs/dbraw/zinc/18/42/62/721184262.db2.gz LPLVJUBERYDGGC-PMACEKPBSA-N 1 1 419.504 3.466 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4ccc(NC(=O)OC(C)(C)C)cn4)C[C@@H]3C2)cn1 ZINC001164764167 721188633 /nfs/dbraw/zinc/18/86/33/721188633.db2.gz GKIBLLILJOKEKK-MSOLQXFVSA-N 1 1 412.538 3.120 20 0 HGADMO Fc1ccc2c(Cl)ncnc2c1N1CC[N@H+]2C[C@@H](OCc3cccnc3)C[C@H]2C1 ZINC001164868051 721190933 /nfs/dbraw/zinc/19/09/33/721190933.db2.gz JQZVOHAFZIBLBN-HOTGVXAUSA-N 1 1 413.884 3.297 20 0 HGADMO Fc1ccc2c(c1)[nH]c1ncnc(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@H]4C3)c21 ZINC001164870843 721193642 /nfs/dbraw/zinc/19/36/42/721193642.db2.gz WOSAMWLMNYOFQO-ROUUACIJSA-N 1 1 418.476 3.125 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(C(F)(F)c4cc(C5CC5)nnc4Cl)C[C@@H]3C2)cn1 ZINC001164762002 721205166 /nfs/dbraw/zinc/20/51/66/721205166.db2.gz BQWVQWOHWRAKAZ-CVEARBPZSA-N 1 1 422.911 3.244 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4nnc(Cl)c5ccc(F)cc54)C[C@H]3C2)cn1 ZINC001164763275 721224661 /nfs/dbraw/zinc/22/46/61/721224661.db2.gz FDNVRLLJPMMGQE-HUUCEWRRSA-N 1 1 400.889 3.114 20 0 HGADMO CCN(c1ccccc1)c1cc(N2C[C@@H]3CC[N@@H+](Cc4cnn(C)c4)C[C@H]3C2)ncn1 ZINC001164772425 721224814 /nfs/dbraw/zinc/22/48/14/721224814.db2.gz UQENTQXFFXXRGY-SFTDATJTSA-N 1 1 417.561 3.326 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4ccnc(CSc5ccccc5)n4)C[C@H]3C2)cn1 ZINC001164769862 721238971 /nfs/dbraw/zinc/23/89/71/721238971.db2.gz ZWFPFABCCCHRLV-VQTJNVASSA-N 1 1 420.586 3.461 20 0 HGADMO CN(C)C(=O)c1cc2cnc(N3CC4(C3)CC[N@@H+](CC3CC3)C4)nc2n1C1CCCC1 ZINC001164772506 721289291 /nfs/dbraw/zinc/28/92/91/721289291.db2.gz IDVMFOBXPJTDIO-UHFFFAOYSA-N 1 1 422.577 3.170 20 0 HGADMO CCN1CC[C@]2(CN(c3ccc4c(n3)CC[N@H+](Cc3ccccc3)C4)C[C@@H]2C)C1=O ZINC001164777299 721317946 /nfs/dbraw/zinc/31/79/46/721317946.db2.gz JNQWZOGNMFFMMW-UQBPGWFLSA-N 1 1 404.558 3.335 20 0 HGADMO CCOc1cccc(N2CCC[C@@]3(C2)COCC[N@@H+](Cc2c(C)noc2C)C3)n1 ZINC001164777790 721345903 /nfs/dbraw/zinc/34/59/03/721345903.db2.gz HXOGUSXBNSUKNX-JOCHJYFZSA-N 1 1 400.523 3.204 20 0 HGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@]2(CCCN(c3nc(C)cnc3Cl)C2)C1 ZINC001164778761 721352376 /nfs/dbraw/zinc/35/23/76/721352376.db2.gz OJANSOKQACDZJL-HXUWFJFHSA-N 1 1 405.930 3.162 20 0 HGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@]2(CCCN(c3nc(C)cnc3Cl)C2)C1 ZINC001164778761 721352379 /nfs/dbraw/zinc/35/23/79/721352379.db2.gz OJANSOKQACDZJL-HXUWFJFHSA-N 1 1 405.930 3.162 20 0 HGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@@]2(CCCN(c3nccc4ncsc43)C2)C1 ZINC001164784334 721360110 /nfs/dbraw/zinc/36/01/10/721360110.db2.gz RJARNHRYGBJTHH-NRFANRHFSA-N 1 1 413.547 3.415 20 0 HGADMO COc1nc(N2CCC[C@]3(C2)COCC[N@@H+](Cc2c(C)noc2C)C3)ccc1Cl ZINC001164782979 721361365 /nfs/dbraw/zinc/36/13/65/721361365.db2.gz OOLMJCMDFVMPLG-NRFANRHFSA-N 1 1 420.941 3.467 20 0 HGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@@]2(CCCN(c3ncc(F)c4cc[nH]c43)C2)C1 ZINC001164781403 721362242 /nfs/dbraw/zinc/36/22/42/721362242.db2.gz IXJOZSOVCHUIIP-QFIPXVFZSA-N 1 1 413.497 3.426 20 0 HGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@@]2(CCCN(c3nccc4nc(C)cnc43)C2)C1 ZINC001164787110 721370417 /nfs/dbraw/zinc/37/04/17/721370417.db2.gz ZEYFPSVKTFNPIE-QHCPKHFHSA-N 1 1 422.533 3.057 20 0 HGADMO C[NH+]1CCN(C[C@H]2CCC[C@@]3(CCN(C(F)(F)c4cccnc4Cl)C3)O2)CC1 ZINC001164892139 721381829 /nfs/dbraw/zinc/38/18/29/721381829.db2.gz RVSDXRGNBHZTAN-APWZRJJASA-N 1 1 414.928 3.045 20 0 HGADMO COc1cccc2ccc(N3CC[C@@]4(C3)CCC[C@H](CN3CC[NH+](C)CC3)O4)nc21 ZINC001164893617 721395503 /nfs/dbraw/zinc/39/55/03/721395503.db2.gz WEKQOOQWPCDCCW-HYBUGGRVSA-N 1 1 410.562 3.009 20 0 HGADMO COc1ccc2nc(Cl)cc(N3C[C@@H]4C[NH+](Cc5nccs5)C[C@H]4C3)c2n1 ZINC001164788992 721413172 /nfs/dbraw/zinc/41/31/72/721413172.db2.gz UBRFMWWMHDWGEB-STQMWFEESA-N 1 1 401.923 3.317 20 0 HGADMO CCOC(=O)c1cnc(Cl)c(C)c1N1C[C@H]2C[NH+](Cc3nccs3)C[C@@H]2C1 ZINC001164783955 721414292 /nfs/dbraw/zinc/41/42/92/721414292.db2.gz JKKLLHUTPKXMQM-ZIAGYGMSSA-N 1 1 406.939 3.245 20 0 HGADMO CC(C)(C)NC(=O)c1cc(Cl)nc(N2C[C@@H]3C[NH+](Cc4nccs4)C[C@H]3C2)c1 ZINC001164781750 721414811 /nfs/dbraw/zinc/41/48/11/721414811.db2.gz DSQQJMLPKFGWJC-GJZGRUSLSA-N 1 1 419.982 3.288 20 0 HGADMO C[NH+]1CCN(C[C@@H]2CCC[C@]3(CCN(c4nc(Cl)cc(C(C)(C)C)n4)C3)O2)CC1 ZINC001164891438 721428656 /nfs/dbraw/zinc/42/86/56/721428656.db2.gz GOFXMQANDFLIIK-HTAPYJJXSA-N 1 1 422.017 3.193 20 0 HGADMO Cc1cc(OCc2ccccc2)nc(N2C[C@@H]3C[NH+](Cc4nccs4)C[C@H]3C2)n1 ZINC001164785547 721434103 /nfs/dbraw/zinc/43/41/03/721434103.db2.gz NQDARVRIZQQIOJ-OALUTQOASA-N 1 1 407.543 3.389 20 0 HGADMO CCc1nc2sccc2c(N2CC[C@@]3(C2)CCC[C@@H](CN2CC[NH+](C)CC2)O3)n1 ZINC001164893039 721443365 /nfs/dbraw/zinc/44/33/65/721443365.db2.gz IUOKZBUWNVXQEK-HTAPYJJXSA-N 1 1 415.607 3.019 20 0 HGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1nc(C)nc3ccoc31)CC2 ZINC001164786764 721448602 /nfs/dbraw/zinc/44/86/02/721448602.db2.gz NKKVLGZZQSXZPI-LJQANCHMSA-N 1 1 414.550 3.265 20 0 HGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1ncnc3c1CCCC3)CC2 ZINC001164782739 721457827 /nfs/dbraw/zinc/45/78/27/721457827.db2.gz BHUGEVIJPUEZJE-FQEVSTJZSA-N 1 1 414.594 3.089 20 0 HGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1cc(C(C)C)ncn1)CC2 ZINC001164786878 721457867 /nfs/dbraw/zinc/45/78/67/721457867.db2.gz QDDNIDBTAHNNMD-FQEVSTJZSA-N 1 1 402.583 3.334 20 0 HGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1cc3ccccc3nn1)CC2 ZINC001164785482 721460566 /nfs/dbraw/zinc/46/05/66/721460566.db2.gz LMFGRULSMYQGGI-NRFANRHFSA-N 1 1 410.562 3.364 20 0 HGADMO CC(C)C(=O)N1CC[C@@H]2CN(c3ncnc4c3CC[N@H+](Cc3ccccc3)C4)CC[C@H]21 ZINC001164895109 721463817 /nfs/dbraw/zinc/46/38/17/721463817.db2.gz ZLLPWMAGLVBHAH-NFBKMPQASA-N 1 1 419.573 3.118 20 0 HGADMO CC(C)C(=O)N1CC[C@@H]2CN(c3ncnc4c3CC[N@@H+](Cc3ccccc3)C4)CC[C@H]21 ZINC001164895109 721463819 /nfs/dbraw/zinc/46/38/19/721463819.db2.gz ZLLPWMAGLVBHAH-NFBKMPQASA-N 1 1 419.573 3.118 20 0 HGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1cc(CC(C)C)ncn1)CC2 ZINC001164788803 721468069 /nfs/dbraw/zinc/46/80/69/721468069.db2.gz LFYUJTAMEUQRDR-JOCHJYFZSA-N 1 1 416.610 3.409 20 0 HGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1ncc(C(F)F)cn1)CC2 ZINC001164789866 721470529 /nfs/dbraw/zinc/47/05/29/721470529.db2.gz OQOBDCQAHAERNQ-SFHVURJKSA-N 1 1 410.509 3.148 20 0 HGADMO COC(=O)c1ccc(Cl)nc1N1CC[N@H+]2C[C@H](Oc3cccc(F)c3)C[C@H]2C1 ZINC001164901709 721510094 /nfs/dbraw/zinc/51/00/94/721510094.db2.gz YDTBOJGHHCMLOC-GOEBONIOSA-N 1 1 405.857 3.003 20 0 HGADMO Cc1nc(Cl)cc(C(F)(F)N2CC[N@H+]3C[C@@H](Oc4cccc(F)c4)C[C@H]3C2)n1 ZINC001164900721 721519321 /nfs/dbraw/zinc/51/93/21/721519321.db2.gz UIIBTKRANSXKAN-HOCLYGCPSA-N 1 1 412.843 3.464 20 0 HGADMO CC1(C)OCc2c1nc(Cl)nc2N1CC[N@H+]2C[C@H](Oc3cccc(F)c3)C[C@H]2C1 ZINC001164901685 721524676 /nfs/dbraw/zinc/52/46/76/721524676.db2.gz XYJNBCYZAIHITI-GOEBONIOSA-N 1 1 418.900 3.376 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2cc(C(=O)OC(C)(C)C)ccn2)[C@H]2CCCO[C@H]12 ZINC001164807760 721535184 /nfs/dbraw/zinc/53/51/84/721535184.db2.gz RCPTUJDRURRIGY-VWPQPMDRSA-N 1 1 424.545 3.300 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2ccnc(-c3ccccc3)n2)[C@H]2CCCO[C@H]12 ZINC001164801549 721536094 /nfs/dbraw/zinc/53/60/94/721536094.db2.gz FPTBAGPDPNKXOY-XJUOHMSHSA-N 1 1 401.514 3.407 20 0 HGADMO COC(=O)c1ccc(Cl)c(N2CC[N@H+]3C[C@@H](Oc4cccc(F)c4)C[C@H]3C2)n1 ZINC001164911998 721538181 /nfs/dbraw/zinc/53/81/81/721538181.db2.gz YAHCNUJIPHWLSA-HOCLYGCPSA-N 1 1 405.857 3.003 20 0 HGADMO COc1cc2ncnc(N3CC[N@H+]4C[C@@H](Oc5cccc(F)c5)C[C@@H]4C3)c2c(OC)c1 ZINC001164903452 721538221 /nfs/dbraw/zinc/53/82/21/721538221.db2.gz CRPOTYRRGPBHER-APWZRJJASA-N 1 1 424.476 3.128 20 0 HGADMO Cc1nc2cc(F)ccc2c(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@@H]32)n1 ZINC001164805590 721541235 /nfs/dbraw/zinc/54/12/35/721541235.db2.gz MKVLHEXOWJHGKI-FDFHNCONSA-N 1 1 407.493 3.341 20 0 HGADMO COc1nc(-c2ccccc2)nc(N2CC[N@H+]3C[C@@H](Oc4cccc(F)c4)C[C@@H]3C2)n1 ZINC001164902670 721541372 /nfs/dbraw/zinc/54/13/72/721541372.db2.gz AWMJRDQWTQMBSY-QUCCMNQESA-N 1 1 421.476 3.028 20 0 HGADMO CSc1nc2ncnc(N3CC[N@H+]4C[C@@H](Oc5cccc(F)c5)C[C@@H]4C3)c2s1 ZINC001164909326 721545552 /nfs/dbraw/zinc/54/55/52/721545552.db2.gz RLAYZLUSALVLOV-HIFRSBDPSA-N 1 1 417.535 3.289 20 0 HGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(C(F)(F)c2cc(N)cc(Cl)n2)[C@@H]2CCCO[C@@H]12 ZINC001164800325 721561897 /nfs/dbraw/zinc/56/18/97/721561897.db2.gz DUTDRUMLUHUJHL-GPMSIDNRSA-N 1 1 423.895 3.125 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(C(F)(F)c2cc(N)cc(Cl)n2)[C@@H]2CCCO[C@@H]12 ZINC001164800325 721561899 /nfs/dbraw/zinc/56/18/99/721561899.db2.gz DUTDRUMLUHUJHL-GPMSIDNRSA-N 1 1 423.895 3.125 20 0 HGADMO COc1cc2c(cc1F)ncnc2N1C[C@H]([N@@H+](C)Cc2cccnc2)[C@@H]2OCCC[C@H]21 ZINC001164809863 721566021 /nfs/dbraw/zinc/56/60/21/721566021.db2.gz XPHDLIIFFGOUHV-RZUBCFFCSA-N 1 1 423.492 3.041 20 0 HGADMO CN(C)C(=O)[C@@H]1CC12CCN(c1ccc3c(n1)CC[N@H+](Cc1ccccc1)C3)CC2 ZINC001164906606 721569494 /nfs/dbraw/zinc/56/94/94/721569494.db2.gz KGNFAPVUVCSEQX-NRFANRHFSA-N 1 1 404.558 3.335 20 0 HGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(C(F)(F)c2cnc(Cl)c(N)c2)[C@H]2CCCO[C@@H]12 ZINC001164806680 721573795 /nfs/dbraw/zinc/57/37/95/721573795.db2.gz QQUDIXWSOBIKFJ-RCCFBDPRSA-N 1 1 423.895 3.125 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(C(F)(F)c2cnc(Cl)c(N)c2)[C@H]2CCCO[C@@H]12 ZINC001164806680 721573799 /nfs/dbraw/zinc/57/37/99/721573799.db2.gz QQUDIXWSOBIKFJ-RCCFBDPRSA-N 1 1 423.895 3.125 20 0 HGADMO Cc1cc(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@H]3OCCC[C@H]32)nc(-c2ccco2)n1 ZINC001164810805 721583065 /nfs/dbraw/zinc/58/30/65/721583065.db2.gz WFPJQSUCLXTHOI-DXIQSLLYSA-N 1 1 405.502 3.308 20 0 HGADMO Cc1ccc(-c2ccc(N3C[C@H]([N@H+](C)Cc4cccnc4)[C@H]4OCCC[C@@H]43)nn2)o1 ZINC001164810221 721583530 /nfs/dbraw/zinc/58/35/30/721583530.db2.gz VGNJLHUGTJENRA-JTAQYXEDSA-N 1 1 405.502 3.308 20 0 HGADMO Cc1ccc(-c2ccc(N3C[C@H]([N@@H+](C)Cc4cccnc4)[C@H]4OCCC[C@@H]43)nn2)o1 ZINC001164810221 721583533 /nfs/dbraw/zinc/58/35/33/721583533.db2.gz VGNJLHUGTJENRA-JTAQYXEDSA-N 1 1 405.502 3.308 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2ccnc(Cc3ccccc3)n2)[C@@H]2CCCO[C@@H]12 ZINC001164799271 721583783 /nfs/dbraw/zinc/58/37/83/721583783.db2.gz AFYPBURHOFHZEQ-TZBSWOFLSA-N 1 1 415.541 3.331 20 0 HGADMO COC(=O)c1cccc(N2CCC(F)(F)[C@]3(CC[N@@H+](Cc4ccccn4)C3)C2)n1 ZINC001164906186 721584568 /nfs/dbraw/zinc/58/45/68/721584568.db2.gz LXSYBBQAXTUTBT-FQEVSTJZSA-N 1 1 402.445 3.001 20 0 HGADMO COC(=O)c1ccnc(N2CCC(F)(F)[C@]3(CC[N@@H+](Cc4ccccn4)C3)C2)c1 ZINC001164907040 721584785 /nfs/dbraw/zinc/58/47/85/721584785.db2.gz QMSQHXHQIBKKBH-FQEVSTJZSA-N 1 1 402.445 3.001 20 0 HGADMO CCOC(=O)c1ccnc(N2CCC(F)(F)[C@]3(CC[N@@H+](Cc4ccccn4)C3)C2)c1 ZINC001164906521 721585713 /nfs/dbraw/zinc/58/57/13/721585713.db2.gz NIBHLMQQKAGEKD-NRFANRHFSA-N 1 1 416.472 3.391 20 0 HGADMO CSc1cc(N2C[C@H]([N@H+](C)Cc3cccnc3)[C@H]3OCCC[C@@H]32)nc(SC)n1 ZINC001164800683 721590349 /nfs/dbraw/zinc/59/03/49/721590349.db2.gz CLWFQNKUEABXRM-BXWFABGCSA-N 1 1 417.604 3.184 20 0 HGADMO CSc1cc(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@H]3OCCC[C@@H]32)nc(SC)n1 ZINC001164800683 721590352 /nfs/dbraw/zinc/59/03/52/721590352.db2.gz CLWFQNKUEABXRM-BXWFABGCSA-N 1 1 417.604 3.184 20 0 HGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2nc3c(nc2Cl)CCCC3)[C@H]2CCCO[C@H]12 ZINC001164810193 721590585 /nfs/dbraw/zinc/59/05/85/721590585.db2.gz VCLAPYXEWYLONO-ZCNNSNEGSA-N 1 1 413.953 3.272 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2nc3c(nc2Cl)CCCC3)[C@H]2CCCO[C@H]12 ZINC001164810193 721590588 /nfs/dbraw/zinc/59/05/88/721590588.db2.gz VCLAPYXEWYLONO-ZCNNSNEGSA-N 1 1 413.953 3.272 20 0 HGADMO CCc1nc(N2C[C@H]([N@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@H]32)c(Cl)nc1C ZINC001164806775 721590711 /nfs/dbraw/zinc/59/07/11/721590711.db2.gz MZJAZTWRJDNFLI-CEXWTWQISA-N 1 1 401.942 3.264 20 0 HGADMO CCc1nc(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@H]32)c(Cl)nc1C ZINC001164806775 721590714 /nfs/dbraw/zinc/59/07/14/721590714.db2.gz MZJAZTWRJDNFLI-CEXWTWQISA-N 1 1 401.942 3.264 20 0 HGADMO CCc1nc(N2C[C@H]([N@H+](C)Cc3cccnc3)[C@H]3OCCC[C@H]32)c(Cl)nc1C ZINC001164806806 721590850 /nfs/dbraw/zinc/59/08/50/721590850.db2.gz MZJAZTWRJDNFLI-QYZOEREBSA-N 1 1 401.942 3.264 20 0 HGADMO CCc1nc(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@H]3OCCC[C@H]32)c(Cl)nc1C ZINC001164806806 721590852 /nfs/dbraw/zinc/59/08/52/721590852.db2.gz MZJAZTWRJDNFLI-QYZOEREBSA-N 1 1 401.942 3.264 20 0 HGADMO COc1cc(C)c2ncnc(N3C[C@H]([N@@H+](C)Cc4cccnc4)[C@H]4OCCC[C@H]43)c2c1 ZINC001164804100 721592191 /nfs/dbraw/zinc/59/21/91/721592191.db2.gz INMVVMJMZHGDBI-GIWBLDEGSA-N 1 1 419.529 3.210 20 0 HGADMO Cc1noc2ncnc(N3CCC(F)(F)[C@]4(CC[N@@H+](Cc5ccccn5)C4)C3)c12 ZINC001164913843 721732427 /nfs/dbraw/zinc/73/24/27/721732427.db2.gz YWRREVMKWRDXOL-IBGZPJMESA-N 1 1 400.433 3.059 20 0 HGADMO Cn1c(=O)ccc2ccc(N3CCc4c(C[N@H+](C)Cc5ccco5)cncc4C3)nc21 ZINC001164910880 721755379 /nfs/dbraw/zinc/75/53/79/721755379.db2.gz SWJMVVDEARDOBH-UHFFFAOYSA-N 1 1 415.497 3.116 20 0 HGADMO Cn1c(=O)ccc2ccc(N3CCc4c(C[N@@H+](C)Cc5ccco5)cncc4C3)nc21 ZINC001164910880 721755383 /nfs/dbraw/zinc/75/53/83/721755383.db2.gz SWJMVVDEARDOBH-UHFFFAOYSA-N 1 1 415.497 3.116 20 0 HGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2CCC[C@@]3(CCN(c4cncnc4)C3=O)C2)nc1 ZINC001165020201 721785451 /nfs/dbraw/zinc/78/54/51/721785451.db2.gz NJDVHRIQGCBFNH-ZJSXRUAMSA-N 1 1 420.561 3.442 20 0 HGADMO COC(=O)c1cnc(Cl)nc1N1C[C@@H]2CCC[C@H]([N@@H+](C)Cc3ccccn3)[C@H]2C1 ZINC001165021358 721801172 /nfs/dbraw/zinc/80/11/72/721801172.db2.gz GKZKFUJGXLZJGX-WBAXXEDZSA-N 1 1 415.925 3.049 20 0 HGADMO COC(=O)c1ccc(N2C[C@@H]3CCC[C@H]([N@@H+](C)Cc4ccccn4)[C@@H]3C2)nc1OC ZINC001165022087 721803457 /nfs/dbraw/zinc/80/34/57/721803457.db2.gz HUYOPGBURRFSKU-DBVUQKKJSA-N 1 1 410.518 3.009 20 0 HGADMO c1ccc(C[N@@H+]2CCc3c(ncnc3N3CCc4ncnc(C5CC5)c4CC3)C2)cc1 ZINC001164917731 721803646 /nfs/dbraw/zinc/80/36/46/721803646.db2.gz XQOSZISLIJDHTI-UHFFFAOYSA-N 1 1 412.541 3.308 20 0 HGADMO c1ccc(C[N@H+]2CCc3c(ncnc3N3CCc4ncnc(C5CC5)c4CC3)C2)cc1 ZINC001164917731 721803648 /nfs/dbraw/zinc/80/36/48/721803648.db2.gz XQOSZISLIJDHTI-UHFFFAOYSA-N 1 1 412.541 3.308 20 0 HGADMO CCOC(=O)Cc1cccnc1N1C[C@@H]2CCC[C@@H]([N@@H+](C)Cc3ccccn3)[C@@H]2C1 ZINC001165017757 721804349 /nfs/dbraw/zinc/80/43/49/721804349.db2.gz AJXLKUSGHGNSEI-KSEOMHKRSA-N 1 1 408.546 3.319 20 0 HGADMO CSc1nc(Cl)nc(N2C[C@@H]3CCC[C@H]([N@@H+](C)Cc4ccccn4)[C@H]3C2)n1 ZINC001165026636 721806969 /nfs/dbraw/zinc/80/69/69/721806969.db2.gz RQKQYULUAKGGBA-BPUTZDHNSA-N 1 1 404.971 3.379 20 0 HGADMO Cn1cnc2c1nc(Cl)nc2N1C[C@H]2CCC[C@@H]([N@@H+](C)Cc3ccccn3)[C@@H]2C1 ZINC001165018577 721808508 /nfs/dbraw/zinc/80/85/08/721808508.db2.gz BJVLVNUMQUAHTK-DJIMGWMZSA-N 1 1 411.941 3.149 20 0 HGADMO Cn1c(=O)ccc2ccc(N3C[C@@H]4CCC[C@@H]([N@@H+](C)Cc5ccccn5)[C@H]4C3)nc21 ZINC001165021622 721813319 /nfs/dbraw/zinc/81/33/19/721813319.db2.gz FHKIIPGWRASELY-SESVDKBCSA-N 1 1 403.530 3.065 20 0 HGADMO CNC(=O)c1nc(N2C[C@@H]3CCC[C@H]([N@@H+](C)Cc4ccccn4)[C@H]3C2)ccc1Cl ZINC001165025505 721816746 /nfs/dbraw/zinc/81/67/46/721816746.db2.gz NCHZZYPMRJDXHW-IEZWGBDMSA-N 1 1 413.953 3.227 20 0 HGADMO C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@H]2CN(c3cc(C(=O)N4CCCC4)ccn3)C[C@H]21 ZINC001165026129 721818924 /nfs/dbraw/zinc/81/89/24/721818924.db2.gz PHSGHJNCGZXCHK-MDNUFGMLSA-N 1 1 419.573 3.450 20 0 HGADMO C[N@H+](Cc1ccccn1)[C@@H]1CCC[C@@H]2CN(c3cccc(N4CCOCC4)n3)C[C@H]21 ZINC001165027621 721819320 /nfs/dbraw/zinc/81/93/20/721819320.db2.gz VJSBQMFOYPUGGD-CEMLEFRQSA-N 1 1 407.562 3.050 20 0 HGADMO C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@@H]2CN(c3cccc(N4CCOCC4)n3)C[C@H]21 ZINC001165027621 721819322 /nfs/dbraw/zinc/81/93/22/721819322.db2.gz VJSBQMFOYPUGGD-CEMLEFRQSA-N 1 1 407.562 3.050 20 0 HGADMO COc1cnc2c(c1)ncnc2N1C[C@@H]2CCC[C@@H]([N@@H+](C)Cc3ccccn3)[C@H]2C1 ZINC001165025922 721820673 /nfs/dbraw/zinc/82/06/73/721820673.db2.gz OESPJYOWAFULLV-NBHGPNQESA-N 1 1 404.518 3.165 20 0 HGADMO COC(=O)c1ccc(-c2ccc(N3CC[C@@H]4[C@H]3CC[N@H+]4CCN(C)C)nc2C)cc1 ZINC001164922384 721876513 /nfs/dbraw/zinc/87/65/13/721876513.db2.gz GKFZZNBRNCROKP-FGZHOGPDSA-N 1 1 408.546 3.058 20 0 HGADMO COC(=O)c1ccc(-c2ccc(N3CC[C@@H]4[C@H]3CCN4CC[NH+](C)C)nc2C)cc1 ZINC001164922384 721876515 /nfs/dbraw/zinc/87/65/15/721876515.db2.gz GKFZZNBRNCROKP-FGZHOGPDSA-N 1 1 408.546 3.058 20 0 HGADMO C[C@@H]1CCc2c(sc3nc(C[NH+]4CCCCC4)nc(N4CCNC(=O)[C@H]4C)c23)C1 ZINC001165036142 721883735 /nfs/dbraw/zinc/88/37/35/721883735.db2.gz JVNORPWLUHPAPC-HUUCEWRRSA-N 1 1 413.591 3.127 20 0 HGADMO CN(C)CC[N@@H+]1CC[C@H]2[C@@H]1CCN2c1ccc(-c2ccc(N3CCCCC3)cc2)nn1 ZINC001164935141 721885661 /nfs/dbraw/zinc/88/56/61/721885661.db2.gz WNCABUMVKLEYPC-ZEQRLZLVSA-N 1 1 420.605 3.349 20 0 HGADMO CN(C)CC[N@H+]1CC[C@H]2[C@@H]1CCN2c1ccc(-c2ccc(N3CCCCC3)cc2)nn1 ZINC001164935141 721885663 /nfs/dbraw/zinc/88/56/63/721885663.db2.gz WNCABUMVKLEYPC-ZEQRLZLVSA-N 1 1 420.605 3.349 20 0 HGADMO CCCNC(=O)c1ccc(N2CCC3(CC2)C[N@@H+](Cc2ccc(C)cc2)CCO3)nc1 ZINC001164940188 721931286 /nfs/dbraw/zinc/93/12/86/721931286.db2.gz RGTIFVOKOKAYDK-UHFFFAOYSA-N 1 1 422.573 3.401 20 0 HGADMO Cc1ccc(C[N@H+]2CCOC3(CCN(c4ncnc5c4ncn5C4CC4)CC3)C2)cc1 ZINC001164938659 721931522 /nfs/dbraw/zinc/93/15/22/721931522.db2.gz DADWSNVWONVCLF-UHFFFAOYSA-N 1 1 418.545 3.341 20 0 HGADMO COc1nc(N2CCC3(CC2)C[N@@H+](Cc2ccc(C)cc2)CCO3)nc2c1ccn2C ZINC001164942731 721932973 /nfs/dbraw/zinc/93/29/73/721932973.db2.gz MSYZKQJWQKEPAW-UHFFFAOYSA-N 1 1 421.545 3.157 20 0 HGADMO CCOC(=O)c1cc2ncnc(N3CC[NH+](CCOc4ccccc4)CC3)c2s1 ZINC001165044383 721957710 /nfs/dbraw/zinc/95/77/10/721957710.db2.gz JMDHDMAOABMDNH-UHFFFAOYSA-N 1 1 412.515 3.069 20 0 HGADMO Clc1nc2cc[nH]c2c(N2CCC3(CC2)COCC[N@@H+](Cc2ccncc2)C3)n1 ZINC001164960486 722051517 /nfs/dbraw/zinc/05/15/17/722051517.db2.gz PIKSAOQCNHBVDF-UHFFFAOYSA-N 1 1 412.925 3.125 20 0 HGADMO F[C@H](Oc1ccnc(Cl)c1)N1CCC2(CC1)COCC[N@@H+](Cc1ccncc1)C2 ZINC001164964867 722054503 /nfs/dbraw/zinc/05/45/03/722054503.db2.gz YUYZJTMJYHNQJE-FQEVSTJZSA-N 1 1 420.916 3.377 20 0 HGADMO Clc1cnc(Cl)c(N2CCC3(CC2)COCC[N@@H+](Cc2ccncc2)C3)n1 ZINC001164963143 722055023 /nfs/dbraw/zinc/05/50/23/722055023.db2.gz HOPZPGZRDSONMV-UHFFFAOYSA-N 1 1 408.333 3.297 20 0 HGADMO CCOc1c(Cl)ncnc1N1CCC2(CC1)COCC[N@@H+](Cc1ccncc1)C2 ZINC001164963794 722056963 /nfs/dbraw/zinc/05/69/63/722056963.db2.gz LBYQJQNPGUWASU-UHFFFAOYSA-N 1 1 417.941 3.043 20 0 HGADMO Fc1cnc2ccc(N3CCC4(CC3)COCC[N@@H+](Cc3ccncc3)C4)nc2c1 ZINC001164963279 722058876 /nfs/dbraw/zinc/05/88/76/722058876.db2.gz VIKBILVKKMWIOR-UHFFFAOYSA-N 1 1 407.493 3.283 20 0 HGADMO C[C@@H]1CCCCN1c1nc2ccccc2nc1N1C[C@@H]2C[N@H+](CC3CC3)C[C@H](C1)O2 ZINC001164967753 722075204 /nfs/dbraw/zinc/07/52/04/722075204.db2.gz UZQWCMBUHNWDOE-RLLQIKCJSA-N 1 1 407.562 3.308 20 0 HGADMO CN(C)C(=O)N[C@@H]1c2ccccc2[C@H]2CN(c3ccc(C[N@@H+](C)C4CC4)cn3)C[C@@H]21 ZINC001164985847 722098101 /nfs/dbraw/zinc/09/81/01/722098101.db2.gz XFFVRTQIIRDTCB-FUPPJEDESA-N 1 1 405.546 3.222 20 0 HGADMO Cc1cc(C(F)(F)N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)nc(Cl)n1 ZINC001164975002 722109794 /nfs/dbraw/zinc/10/97/94/722109794.db2.gz JEDBUHGQVQZAGQ-SJORKVTESA-N 1 1 423.895 3.106 20 0 HGADMO COc1ccc2nc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)ccc2c1 ZINC001164971937 722109816 /nfs/dbraw/zinc/10/98/16/722109816.db2.gz DUHCXFKFPVORPT-REWPJTCUSA-N 1 1 404.514 3.366 20 0 HGADMO Clc1nc2ccccc2nc1N1CC[C@@H]2C[N@@H+](Cc3cccnc3)CCO[C@@H]2C1 ZINC001164972580 722110643 /nfs/dbraw/zinc/11/06/43/722110643.db2.gz GBGDLZYDYDLCRI-YLJYHZDGSA-N 1 1 409.921 3.406 20 0 HGADMO Clc1ccnc2nc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)ccc12 ZINC001164977287 722125654 /nfs/dbraw/zinc/12/56/54/722125654.db2.gz MMTIRQRAWBTOFV-FXAWDEMLSA-N 1 1 409.921 3.406 20 0 HGADMO Clc1ccnc2nc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)ccc12 ZINC001164977291 722125813 /nfs/dbraw/zinc/12/58/13/722125813.db2.gz MMTIRQRAWBTOFV-PXNSSMCTSA-N 1 1 409.921 3.406 20 0 HGADMO c1csc(-c2cc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)ncn2)c1 ZINC001164983334 722144758 /nfs/dbraw/zinc/14/47/58/722144758.db2.gz UGSLUEZKVLDYQW-UYAOXDASSA-N 1 1 407.543 3.327 20 0 HGADMO CCc1nc(Cl)c(N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)c(Cl)n1 ZINC001164972648 722146304 /nfs/dbraw/zinc/14/63/04/722146304.db2.gz AFYNKMXTJQDTRO-JKSUJKDBSA-N 1 1 422.360 3.468 20 0 HGADMO Fc1ccccc1-c1ccc(N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)nn1 ZINC001164977042 722147902 /nfs/dbraw/zinc/14/79/02/722147902.db2.gz IAVBYYPFEVVSOE-XXBNENTESA-N 1 1 419.504 3.405 20 0 HGADMO COc1cc(C)c2ncnc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)c2c1 ZINC001164977124 722158778 /nfs/dbraw/zinc/15/87/78/722158778.db2.gz XGNKTHHMCOIOAQ-DENIHFKCSA-N 1 1 419.529 3.069 20 0 HGADMO OC[C@@H](Cc1ccccc1)[NH2+]Cc1ncc(Br)cc1Br ZINC000135301766 1126076613 /nfs/dbraw/zinc/07/66/13/1126076613.db2.gz VONVAXBTWWEFBD-CYBMUJFWSA-N 1 1 400.114 3.300 20 0 HGADMO CC(C)n1nc(C[NH+](C)C)c2c1CN(c1ccnc(NC(=O)OC(C)(C)C)n1)CC2 ZINC001164648042 719309305 /nfs/dbraw/zinc/30/93/05/719309305.db2.gz PVRQROBYEACUSJ-UHFFFAOYSA-N 1 1 415.542 3.225 20 0 HGADMO COc1cc2nc(C)nc(N3CCc4c(C[NH+](C)C)nn(C(C)C)c4C3)c2cc1OC ZINC001164648879 719311509 /nfs/dbraw/zinc/31/15/09/719311509.db2.gz MQCRHYSHUARIBX-UHFFFAOYSA-N 1 1 424.549 3.357 20 0 HGADMO CNC(=O)C[N@H+]1CCCC12CCN(c1nc(Cl)cc3cc(F)c(OC)cc31)CC2 ZINC001164691595 719758062 /nfs/dbraw/zinc/75/80/62/719758062.db2.gz OWIZAAJCSIDTPB-UHFFFAOYSA-N 1 1 420.916 3.217 20 0 HGADMO O=C1C[C@H]2[C@@H](CCN2c2nc(Cl)ccc2C[NH+]2CCCC2)N1Cc1cccnc1 ZINC001164691609 719769154 /nfs/dbraw/zinc/76/91/54/719769154.db2.gz PAZSLDBIWSTZSG-MOPGFXCFSA-N 1 1 411.937 3.106 20 0 HGADMO Cc1nc(CN2CCCC23CCN(c2nc(Cl)nc4c2CC[NH2+]C4)CC3)cs1 ZINC001164692748 719805318 /nfs/dbraw/zinc/80/53/18/719805318.db2.gz PCJRRNUZAYNJLW-UHFFFAOYSA-N 1 1 418.998 3.176 20 0 HGADMO Cc1nc(C[N@@H+]2CCCC23CCN(c2ncnc4c2[C@H](C)CC(=O)N4)CC3)cs1 ZINC001164693987 719809152 /nfs/dbraw/zinc/80/91/52/719809152.db2.gz SULJMJBPISEQPC-CQSZACIVSA-N 1 1 412.563 3.322 20 0 HGADMO COC(=O)[C@]1(C)C[C@H]([NH+]2CCOCC2)CCN1c1nccc2cc(Cl)ccc21 ZINC001164697225 719849627 /nfs/dbraw/zinc/84/96/27/719849627.db2.gz BTRYXECWVAIPST-UTKZUKDTSA-N 1 1 403.910 3.121 20 0 HGADMO COC(=O)[C@]1(C)C[C@@H]([NH+]2CCOCC2)CCN1c1cc(Cl)nc2c(C)csc21 ZINC001164701593 719862488 /nfs/dbraw/zinc/86/24/88/719862488.db2.gz LFUYFFDOVHTCBX-XOBRGWDASA-N 1 1 423.966 3.491 20 0 HGADMO COC(=O)[C@]1(C)C[C@H]([NH+]2CCOCC2)CCN1c1nc(Cl)cc2cc(C)ccc21 ZINC001164705083 719862640 /nfs/dbraw/zinc/86/26/40/719862640.db2.gz SQWKRROJFXJNMM-VGSWGCGISA-N 1 1 417.937 3.429 20 0 HGADMO COC(=O)[C@@]1(C)C[C@H]([NH+]2CCOCC2)CCN1c1nc(Cl)cc2cccc(C)c21 ZINC001164702275 719877069 /nfs/dbraw/zinc/87/70/69/719877069.db2.gz HUDDEVKZTFMZPE-VGOFRKELSA-N 1 1 417.937 3.429 20 0 HGADMO COC(=O)[C@]1(C)C[C@H]([NH+]2CCOCC2)CCN1c1nc(Cl)cc2cccc(F)c21 ZINC001164700832 719880506 /nfs/dbraw/zinc/88/05/06/719880506.db2.gz MJKGSIPLIMVSSK-VFNWGFHPSA-N 1 1 421.900 3.260 20 0 HGADMO COC(=O)c1ccnc(N2CCC3(CC2)C[N@@H+](Cc2cccs2)CCO3)c1C ZINC001164694745 719889707 /nfs/dbraw/zinc/88/97/07/719889707.db2.gz DWVXYUOHQWJBHW-UHFFFAOYSA-N 1 1 401.532 3.110 20 0 HGADMO CCC[N@H+]1CCCC[C@@H]1c1ccc(N2CC[C@H]3[C@H]2CC(=O)N3c2cnn(C)c2)nc1 ZINC001164711316 720076522 /nfs/dbraw/zinc/07/65/22/720076522.db2.gz LJWZBAURNXBAQN-QHAWAJNXSA-N 1 1 408.550 3.136 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1nnc(Cl)cc1-c1ccncc1)C2 ZINC001164810863 720082799 /nfs/dbraw/zinc/08/27/99/720082799.db2.gz MBYIYYKWACPODY-XMSQKQJNSA-N 1 1 413.953 3.377 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1cncc(OCc3ccccc3)n1)C2 ZINC001164809293 720087733 /nfs/dbraw/zinc/08/77/33/720087733.db2.gz JFSXOPCWBFHBGX-XUZZJYLKSA-N 1 1 408.546 3.240 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1nc(Cl)nc3c1COC3(C)C)C2 ZINC001164814861 720095171 /nfs/dbraw/zinc/09/51/71/720095171.db2.gz XMSSMMOYBUVHNX-BTYIYWSLSA-N 1 1 406.958 3.080 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1ccnc(NC(=O)OC(C)(C)C)n1)C2 ZINC001164814799 720098184 /nfs/dbraw/zinc/09/81/84/720098184.db2.gz WVKFZKAVOWVRGL-HTAPYJJXSA-N 1 1 417.554 3.008 20 0 HGADMO COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1nc(C)nc3[nH]ccc31)CC2 ZINC001164711032 720104690 /nfs/dbraw/zinc/10/46/90/720104690.db2.gz NISMWUXJJVUSRO-IBGZPJMESA-N 1 1 406.534 3.169 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1ccc3cc(C(=O)OC)ccc3n1)C2 ZINC001164813280 720106143 /nfs/dbraw/zinc/10/61/43/720106143.db2.gz QAIKOXWVALCBNM-HYBUGGRVSA-N 1 1 409.530 3.206 20 0 HGADMO CCOC(=O)c1cc(Cl)nc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COC)c1C ZINC001164811581 720114289 /nfs/dbraw/zinc/11/42/89/720114289.db2.gz MOQTTZBEPWQGEY-HTAPYJJXSA-N 1 1 421.969 3.405 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1ccc(C(=O)OC(C)(C)C)cn1)C2 ZINC001164810003 720115392 /nfs/dbraw/zinc/11/53/92/720115392.db2.gz JELHBDCQDSUIQE-AUSIDOKSSA-N 1 1 401.551 3.222 20 0 HGADMO COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1ncc(N)cc1Cl)CC2 ZINC001164715583 720118578 /nfs/dbraw/zinc/11/85/78/720118578.db2.gz IDQSFKQHRXMUSG-SFHVURJKSA-N 1 1 401.942 3.220 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1nccc(-c3cccc(OC)c3)n1)C2 ZINC001164807056 720144274 /nfs/dbraw/zinc/14/42/74/720144274.db2.gz AXCQWWNPRPRCHH-GBXCKJPGSA-N 1 1 408.546 3.337 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1cncc(Oc3cccc(OC)c3)n1)C2 ZINC001164813317 720145620 /nfs/dbraw/zinc/14/56/20/720145620.db2.gz QFDVVPCEEDQKBV-DVECYGJZSA-N 1 1 424.545 3.462 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1cncc(Oc3cccc(OC)c3)n1)C2 ZINC001164813314 720146089 /nfs/dbraw/zinc/14/60/89/720146089.db2.gz QFDVVPCEEDQKBV-CYFREDJKSA-N 1 1 424.545 3.462 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1nc(Cl)nc3c1ncn3C(C)C)C2 ZINC001164813861 720147924 /nfs/dbraw/zinc/14/79/24/720147924.db2.gz RGHDMHFAQPNVAV-KKSFZXQISA-N 1 1 418.973 3.245 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1ncc3c(n1)-c1ccccc1CC3)C2 ZINC001164817796 720151138 /nfs/dbraw/zinc/15/11/38/720151138.db2.gz QHJGXRLFOWFUPE-BWKNWUBXSA-N 1 1 404.558 3.427 20 0 HGADMO CCc1cc2c(nc(Cl)nc2N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COC)[nH]1 ZINC001164814246 720155032 /nfs/dbraw/zinc/15/50/32/720155032.db2.gz FDPTUTOJPRGERR-YCRPNKLZSA-N 1 1 403.958 3.358 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1nc(-c3ccncc3)nc(C)c1C)C2 ZINC001164816241 720184179 /nfs/dbraw/zinc/18/41/79/720184179.db2.gz KJHHZIMPOWJVLX-QPPBQGQZSA-N 1 1 407.562 3.340 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1nc(-c3ccncc3)nc3c1CCC3)C2 ZINC001164816671 720184871 /nfs/dbraw/zinc/18/48/71/720184871.db2.gz MAXMQSMYMWRVPH-CPJSRVTESA-N 1 1 419.573 3.212 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1ncnc3[nH]c4cc(F)ccc4c31)C2 ZINC001164811740 720203035 /nfs/dbraw/zinc/20/30/35/720203035.db2.gz JYIYEHFASGZHJC-WAIKUNEKSA-N 1 1 409.509 3.435 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1ncnc3[nH]c4cc(F)ccc4c31)C2 ZINC001164811732 720204090 /nfs/dbraw/zinc/20/40/90/720204090.db2.gz JYIYEHFASGZHJC-MWTRTKDXSA-N 1 1 409.509 3.435 20 0 HGADMO COc1ccc2nc(N3CCCn4c(=O)cc(C[N@@H+](C)C(C)C)nc4C3)c(C)cc2c1 ZINC001164811679 720208390 /nfs/dbraw/zinc/20/83/90/720208390.db2.gz JPKMENQKGUTJTH-UHFFFAOYSA-N 1 1 421.545 3.359 20 0 HGADMO CSc1cc(Cl)ncc1N1CCCn2c(=O)cc(C[N@@H+](C)C(C)C)nc2C1 ZINC001164814789 720218467 /nfs/dbraw/zinc/21/84/67/720218467.db2.gz ZESHHKVLHUIVNI-UHFFFAOYSA-N 1 1 407.971 3.264 20 0 HGADMO Cc1cccc(-c2ccc(N3CCCn4c(=O)cc(C[N@H+](C)C(C)C)nc4C3)nn2)c1 ZINC001164812176 720236853 /nfs/dbraw/zinc/23/68/53/720236853.db2.gz CLBJWZGDJCEGQL-UHFFFAOYSA-N 1 1 418.545 3.259 20 0 HGADMO O=C(NCc1ccccc1)c1cccnc1N1CC[C@@H]2[C@H]1CC[N@H+]2Cc1cccnc1 ZINC001164729816 720342800 /nfs/dbraw/zinc/34/28/00/720342800.db2.gz YIRQRCWYTQYXOM-DHIUTWEWSA-N 1 1 413.525 3.260 20 0 HGADMO CCOC(=O)c1c(C)cc(Cl)nc1N1CC[C@@H]2[C@H]1CC[N@H+]2Cc1cccnc1 ZINC001164725923 720364983 /nfs/dbraw/zinc/36/49/83/720364983.db2.gz OEPBAFHQYGLFHE-IAGOWNOFSA-N 1 1 400.910 3.468 20 0 HGADMO COC(=O)c1ccc2c(c1)nc(Cl)nc2N1CC[C@H]2[C@@H]1CC[N@H+]2Cc1cccnc1 ZINC001164727058 720386041 /nfs/dbraw/zinc/38/60/41/720386041.db2.gz QFEAVNREQVDLBY-OALUTQOASA-N 1 1 423.904 3.318 20 0 HGADMO COC(=O)c1ccc2c(c1)nc(Cl)nc2N1CC[C@@H]2[C@@H]1CC[N@H+]2Cc1cccnc1 ZINC001164727053 720387064 /nfs/dbraw/zinc/38/70/64/720387064.db2.gz QFEAVNREQVDLBY-MOPGFXCFSA-N 1 1 423.904 3.318 20 0 HGADMO CCC[N@H+]1CCCC[C@H]1c1ccc(N2CCCn3nnc(Cn4ccnc4)c3C2)nc1 ZINC001164831046 720398773 /nfs/dbraw/zinc/39/87/73/720398773.db2.gz UHKAUEVHFFPGFU-NRFANRHFSA-N 1 1 420.565 3.265 20 0 HGADMO COC(=O)c1cc(Cl)nc(N2CC[C@@H]3[C@@H](C[C@H](Cn4cccn4)[N@H+]3C(C)C)C2)c1 ZINC001164835790 720513341 /nfs/dbraw/zinc/51/33/41/720513341.db2.gz LJTVLUJZNAWZQI-RCCFBDPRSA-N 1 1 417.941 3.096 20 0 HGADMO COc1ccc2ncnc(N3CC[C@@H]4[C@H](C[C@H](Cn5cccn5)[N@H+]4C(C)C)C3)c2c1 ZINC001164837226 720520815 /nfs/dbraw/zinc/52/08/15/720520815.db2.gz OPIDRXWTELBMSF-JBYIUTFZSA-N 1 1 406.534 3.213 20 0 HGADMO CCOC(=O)c1cnc(N2CC[C@@H]3[C@@H](C[C@H](Cn4cccn4)[N@H+]3C(C)C)C2)c(C)c1 ZINC001164837113 720525049 /nfs/dbraw/zinc/52/50/49/720525049.db2.gz NQBIZDUDJYCQSX-PWRODBHTSA-N 1 1 411.550 3.141 20 0 HGADMO Cc1c[nH]c2nc(Cl)nc(N3CC[C@@H]4[C@@H](C[C@@H](Cn5cccn5)[N@@H+]4C(C)C)C3)c12 ZINC001164834926 720526174 /nfs/dbraw/zinc/52/61/74/720526174.db2.gz IGCKLHJXBRHXMO-YESZJQIVSA-N 1 1 413.957 3.494 20 0 HGADMO COC(=O)c1c(C)cc(C)nc1N1CC[C@@H]2[C@@H](C[C@@H](Cn3cccn3)[N@H+]2C(C)C)C1 ZINC001164833752 720541052 /nfs/dbraw/zinc/54/10/52/720541052.db2.gz BMNKJENTPZWOOL-SLFFLAALSA-N 1 1 411.550 3.059 20 0 HGADMO CSc1nc(Cl)ncc1N1CC[C@@H]2[C@@H](C[C@H](Cn3cccn3)[N@H+]2C(C)C)C1 ZINC001164842011 720543802 /nfs/dbraw/zinc/54/38/02/720543802.db2.gz WDBXCOFZXJEDLS-ARFHVFGLSA-N 1 1 406.987 3.426 20 0 HGADMO CC(C)[N@@H+]1[C@@H]2CCN([C@H](F)Oc3ccc(Cl)nc3)C[C@H]2C[C@H]1Cn1cccn1 ZINC001164839549 720544708 /nfs/dbraw/zinc/54/47/08/720544708.db2.gz QMROUIYSHDULJJ-HNAWSFBYSA-N 1 1 407.921 3.437 20 0 HGADMO COC(=O)c1ccc(Cl)c(N2CC[C@@H]3[C@H](C[C@H](Cn4cccn4)[N@H+]3C(C)C)C2)n1 ZINC001164839639 720553554 /nfs/dbraw/zinc/55/35/54/720553554.db2.gz RDJQBDCNYFRONS-GPMSIDNRSA-N 1 1 417.941 3.096 20 0 HGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@H]2CN(c3cc(C(=O)NC(C)(C)C)ccn3)CC[C@@H]21 ZINC001164839574 720578498 /nfs/dbraw/zinc/57/84/98/720578498.db2.gz QPEIECHPGTVSBS-ACRUOGEOSA-N 1 1 424.593 3.184 20 0 HGADMO CSc1cnc(Cl)c(N2CC[C@@H]3[C@@H](C[C@H](Cn4cccn4)[N@H+]3C(C)C)C2)n1 ZINC001164842218 720589867 /nfs/dbraw/zinc/58/98/67/720589867.db2.gz UQLISTGOSGLSKW-ARFHVFGLSA-N 1 1 406.987 3.426 20 0 HGADMO COc1cccc2ncnc(N3CC[C@@H]4[C@H](C[C@@H](Cn5cccn5)[N@H+]4C(C)C)C3)c21 ZINC001164837173 720608750 /nfs/dbraw/zinc/60/87/50/720608750.db2.gz HJEHKXSDWPPBRU-WSTZPKSXSA-N 1 1 406.534 3.213 20 0 HGADMO CC(C)[N@@H+]1[C@@H]2CCN(c3ccc(-c4ccncc4)nn3)C[C@@H]2C[C@H]1Cn1cccn1 ZINC001164835904 720623079 /nfs/dbraw/zinc/62/30/79/720623079.db2.gz CQQWTSJKKVGWQT-JAXLGGSGSA-N 1 1 403.534 3.113 20 0 HGADMO CC(C)[N@@H+]1[C@@H]2CCN(c3cncc(N4CCCCCC4)n3)C[C@H]2C[C@H]1Cn1cccn1 ZINC001164839600 720624369 /nfs/dbraw/zinc/62/43/69/720624369.db2.gz NYBYWXPBASPHJJ-BHIFYINESA-N 1 1 423.609 3.431 20 0 HGADMO CC(C)[N@@H+]1[C@@H]2CCN(c3cncc(N4CCCCCC4)n3)C[C@@H]2C[C@H]1Cn1cccn1 ZINC001164839605 720625969 /nfs/dbraw/zinc/62/59/69/720625969.db2.gz NYBYWXPBASPHJJ-FDFHNCONSA-N 1 1 423.609 3.431 20 0 HGADMO FC(F)(c1cc(Cl)cnc1Cl)N1CC[N@@H+]2C[C@H](Oc3cncnc3)C[C@@H]2C1 ZINC001164746892 720627060 /nfs/dbraw/zinc/62/70/60/720627060.db2.gz YOOWIBOTUQCTJH-CHWSQXEVSA-N 1 1 416.259 3.065 20 0 HGADMO FC(F)(c1cc(Cl)cnc1Cl)N1CC[N@H+]2C[C@H](Oc3cncnc3)C[C@@H]2C1 ZINC001164746892 720627067 /nfs/dbraw/zinc/62/70/67/720627067.db2.gz YOOWIBOTUQCTJH-CHWSQXEVSA-N 1 1 416.259 3.065 20 0 HGADMO CCOC(=O)c1cnc(N2CCC3(C[C@H]([N@@H+](C)Cc4ccccc4)CO3)CC2)nc1C ZINC001164845290 720687767 /nfs/dbraw/zinc/68/77/67/720687767.db2.gz XTXDPICASNVCKR-FQEVSTJZSA-N 1 1 424.545 3.222 20 0 HGADMO Cc1cccc(Sc2cncc(N3CC[N@H+]4C[C@@H](Oc5cncnc5)C[C@H]4C3)n2)c1 ZINC001164739900 720741224 /nfs/dbraw/zinc/74/12/24/720741224.db2.gz JLSZRIOXIDBJJG-ROUUACIJSA-N 1 1 420.542 3.068 20 0 HGADMO CC[C@@H]1N(c2ncnc3c2CC[N@H+](Cc2ccccc2)C3)CCC[C@@]12CCC(=O)N2 ZINC001164843906 720749591 /nfs/dbraw/zinc/74/95/91/720749591.db2.gz MNKHHZYGZRJSND-XUZZJYLKSA-N 1 1 405.546 3.063 20 0 HGADMO CC[C@@H]1N(c2ncnc3c2CC[N@@H+](Cc2ccccc2)C3)CCC[C@@]12CCC(=O)N2 ZINC001164843906 720749598 /nfs/dbraw/zinc/74/95/98/720749598.db2.gz MNKHHZYGZRJSND-XUZZJYLKSA-N 1 1 405.546 3.063 20 0 HGADMO Clc1cccc2ncc(N3CC[C@@H]4[C@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)nc12 ZINC001164738355 720818055 /nfs/dbraw/zinc/81/80/55/720818055.db2.gz DYXVBISEDQOITJ-FUHIMQAGSA-N 1 1 423.952 3.254 20 0 HGADMO Clc1ccc2ncc(N3CC[C@@H]4[C@@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)nc2c1 ZINC001164741386 720825108 /nfs/dbraw/zinc/82/51/08/720825108.db2.gz NTBVMPBLDHSJFO-DJPFJPOOSA-N 1 1 423.952 3.254 20 0 HGADMO Clc1cccc2nc(N3CC[C@@H]4[C@@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)ncc12 ZINC001164743587 720832628 /nfs/dbraw/zinc/83/26/28/720832628.db2.gz JJZMOQFAIJGHLF-XGHQBKJUSA-N 1 1 423.952 3.254 20 0 HGADMO COCC[N@H+]1CCO[C@H]2CN(C(F)(F)c3cc(Cl)nc(Cl)c3)CC[C@@H]2C1 ZINC001164857755 720835613 /nfs/dbraw/zinc/83/56/13/720835613.db2.gz YPEMSKRMVZJCSV-OCCSQVGLSA-N 1 1 410.292 3.107 20 0 HGADMO COCC[N@H+]1CCO[C@@H]2CN(c3ncnc4cc(C(C)(C)C)sc43)CC[C@@H]2C1 ZINC001164857568 720844383 /nfs/dbraw/zinc/84/43/83/720844383.db2.gz YGCNKLKGDUMKLZ-NVXWUHKLSA-N 1 1 404.580 3.162 20 0 HGADMO c1ncn(C[C@@H]2C[C@H]3CN(c4cc(-c5ccccc5)ncn4)CC[C@H]3[N@H+]2CC2CC2)n1 ZINC001164748953 720845948 /nfs/dbraw/zinc/84/59/48/720845948.db2.gz VERXEFRJKQKEDI-QNWVGRARSA-N 1 1 415.545 3.115 20 0 HGADMO COc1cccc2c1ccnc2N1CC[C@@H]2[C@H](C[C@@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164739545 720851516 /nfs/dbraw/zinc/85/15/16/720851516.db2.gz BATQEWWUBFFDRG-XQBPLPMBSA-N 1 1 418.545 3.214 20 0 HGADMO Cc1ccc(-c2ccc(N3CC[C@@H]4[C@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)nn2)o1 ZINC001164749717 720852384 /nfs/dbraw/zinc/85/23/84/720852384.db2.gz OBPMVHRDWPYYQP-SFHLNBCPSA-N 1 1 419.533 3.016 20 0 HGADMO COCC[N@H+]1CCO[C@H]2CN(c3nc4ccccc4c(-c4ccccc4)n3)CC[C@@H]2C1 ZINC001164856010 720852525 /nfs/dbraw/zinc/85/25/25/720852525.db2.gz NHJSQBKNPHEUGN-OFNKIYASSA-N 1 1 418.541 3.470 20 0 HGADMO CCc1nc2sccc2c(N2CC[C@@H]3[C@@H](C[C@@H](Cn4cncn4)[N@H+]3CC3CC3)C2)n1 ZINC001164745988 720854088 /nfs/dbraw/zinc/85/40/88/720854088.db2.gz FBSXUAJGPGUQKV-JENIJYKNSA-N 1 1 423.590 3.225 20 0 HGADMO COCC[N@H+]1CCO[C@@H]2CN(C(F)(F)c3ccc(SC)c(Cl)n3)CC[C@H]2C1 ZINC001164852500 720860961 /nfs/dbraw/zinc/86/09/61/720860961.db2.gz DNXXYAQNSPYZJG-UONOGXRCSA-N 1 1 421.941 3.175 20 0 HGADMO COCC[N@H+]1CCO[C@H]2CN(C(F)(F)c3cc(SC)cnc3Cl)CC[C@H]2C1 ZINC001164861374 720871351 /nfs/dbraw/zinc/87/13/51/720871351.db2.gz XTYSYISYVKRTIZ-BBRMVZONSA-N 1 1 421.941 3.175 20 0 HGADMO CCOc1ccc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COCc2cccnc2)nn1 ZINC001164750510 720873697 /nfs/dbraw/zinc/87/36/97/720873697.db2.gz JFRNTRAUSXXHJM-QPPBQGQZSA-N 1 1 423.561 3.025 20 0 HGADMO COCC[N@H+]1CCO[C@@H]2CN(c3c(Cl)ccc4c(Cl)ncnc43)CC[C@H]2C1 ZINC001164863852 720890837 /nfs/dbraw/zinc/89/08/37/720890837.db2.gz UUQWCKLHGONBPQ-XJKSGUPXSA-N 1 1 411.333 3.110 20 0 HGADMO Cc1cnc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COCc2cccnc2)c(N)c1 ZINC001164756245 720899995 /nfs/dbraw/zinc/89/99/95/720899995.db2.gz OQXLCIBVDRHFDC-XUZZJYLKSA-N 1 1 407.562 3.122 20 0 HGADMO COCc1ccc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COCc2cccnc2)nc1 ZINC001164751334 720914166 /nfs/dbraw/zinc/91/41/66/720914166.db2.gz LJVLADKKHRJONE-UKILVPOCSA-N 1 1 422.573 3.378 20 0 HGADMO CSc1nc2ncnc(N3CCn4c(C[N@@H+](C)C(C)C)cnc4[C@H]3C)c2s1 ZINC001164859756 720984668 /nfs/dbraw/zinc/98/46/68/720984668.db2.gz MLKFCSDNXQYDEJ-GFCCVEGCSA-N 1 1 403.581 3.426 20 0 HGADMO CC(C)[N@@H+](C)Cc1cnc2n1CCN(C(F)(F)COc1cncc(Cl)n1)[C@@H]2C ZINC001164864107 721006155 /nfs/dbraw/zinc/00/61/55/721006155.db2.gz XKFJWICBEFBAIQ-CYBMUJFWSA-N 1 1 414.888 3.215 20 0 HGADMO c1ccc(Oc2cc(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@H]4C3)ncn2)cc1 ZINC001164868032 721061256 /nfs/dbraw/zinc/06/12/56/721061256.db2.gz MHLZAHIMDDBYOI-FPOVZHCZSA-N 1 1 403.486 3.144 20 0 HGADMO FC(F)(Oc1ccc(Cl)nc1)N1CC[N@H+]2C[C@@H](OCc3cccnc3)C[C@@H]2C1 ZINC001164865866 721069817 /nfs/dbraw/zinc/06/98/17/721069817.db2.gz AUDRZTGCGYQQFK-WBVHZDCISA-N 1 1 410.852 3.034 20 0 HGADMO Cc1cccc2c1nc(Cl)nc2N1CC[N@H+]2C[C@@H](OCc3cccnc3)C[C@@H]2C1 ZINC001164866574 721072646 /nfs/dbraw/zinc/07/26/46/721072646.db2.gz FRKOQZOTJDTGIV-MSOLQXFVSA-N 1 1 409.921 3.466 20 0 HGADMO COc1ccc(C(F)(F)N2CC[N@H+]3C[C@H](OCc4cccnc4)C[C@H]3C2)nc1Cl ZINC001164863711 721100943 /nfs/dbraw/zinc/10/09/43/721100943.db2.gz CZIOHTXYJYXUQL-JKSUJKDBSA-N 1 1 424.879 3.163 20 0 HGADMO CCc1cc2c(nc(Cl)nc2N2CC[N@H+]3C[C@@H](OCc4cccnc4)C[C@H]3C2)[nH]1 ZINC001164879096 721129851 /nfs/dbraw/zinc/12/98/51/721129851.db2.gz RTDVVZMHQUHGQY-IRXDYDNUSA-N 1 1 412.925 3.048 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4cccc(-c5cccc(Cl)n5)n4)C[C@@H]3C2)cn1 ZINC001164770588 721136272 /nfs/dbraw/zinc/13/62/72/721136272.db2.gz RBYZKEKVQINFTO-MSOLQXFVSA-N 1 1 408.937 3.489 20 0 HGADMO COc1ccccc1-c1ccnc(N2CC[N@H+]3C[C@@H](OCc4cccnc4)C[C@H]3C2)n1 ZINC001164881077 721153768 /nfs/dbraw/zinc/15/37/68/721153768.db2.gz YXFYNYPYFZPIMK-PMACEKPBSA-N 1 1 417.513 3.027 20 0 HGADMO Fc1ccc2c(Cl)nnc(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@@H]4C3)c2c1 ZINC001164878987 721168821 /nfs/dbraw/zinc/16/88/21/721168821.db2.gz RDHUHKQGKVBLLR-SJORKVTESA-N 1 1 413.884 3.297 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4cncc(Oc5cccc(F)c5)n4)C[C@@H]3C2)cn1 ZINC001164768299 721170608 /nfs/dbraw/zinc/17/06/08/721170608.db2.gz KTYMVLFZTLIHOQ-ROUUACIJSA-N 1 1 408.481 3.100 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4cccc(OCc5ccccc5)n4)C[C@@H]3C2)cn1 ZINC001164768706 721173623 /nfs/dbraw/zinc/17/36/23/721173623.db2.gz LOQYPSZFKIPFES-YADHBBJMSA-N 1 1 403.530 3.352 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4nc(Cl)cc(Cc5ccccc5)n4)C[C@@H]3C2)cn1 ZINC001164770845 721174305 /nfs/dbraw/zinc/17/43/05/721174305.db2.gz OXCXNGWPAXWWBJ-UXHICEINSA-N 1 1 422.964 3.413 20 0 HGADMO Fc1ccc(-c2cncc(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@@H]4C3)n2)cc1 ZINC001164870990 721182383 /nfs/dbraw/zinc/18/23/83/721182383.db2.gz CUDORWMUDRJPMW-RTWAWAEBSA-N 1 1 405.477 3.157 20 0 HGADMO COc1cc2ccnc(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@H]4C3)c2cc1F ZINC001164877582 721185481 /nfs/dbraw/zinc/18/54/81/721185481.db2.gz OUCKOVXRWJXJDC-OALUTQOASA-N 1 1 408.477 3.257 20 0 HGADMO Fc1ccc2c(Cl)ncnc2c1N1CC[N@H+]2C[C@H](OCc3cccnc3)C[C@H]2C1 ZINC001164868053 721190789 /nfs/dbraw/zinc/19/07/89/721190789.db2.gz JQZVOHAFZIBLBN-JKSUJKDBSA-N 1 1 413.884 3.297 20 0 HGADMO Fc1ccc2c(c1)[nH]c1ncnc(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@H]4C3)c21 ZINC001164870844 721193853 /nfs/dbraw/zinc/19/38/53/721193853.db2.gz WOSAMWLMNYOFQO-ZWKOTPCHSA-N 1 1 418.476 3.125 20 0 HGADMO Cc1c(Cl)nc(C(C)(C)C)nc1N1C[C@@H]2C[N@@H+](Cc3cnn(C)c3)CC[C@@H]2C1 ZINC001164774443 721194198 /nfs/dbraw/zinc/19/41/98/721194198.db2.gz ZEUQAYBXZCTTAR-SJORKVTESA-N 1 1 402.974 3.428 20 0 HGADMO c1cc2c(nc(C3CCC3)nc2N2CC[N@H+]3C[C@@H](OCc4cccnc4)C[C@H]3C2)[nH]1 ZINC001164866778 721195880 /nfs/dbraw/zinc/19/58/80/721195880.db2.gz CWLAKOYSROGSCH-OALUTQOASA-N 1 1 404.518 3.100 20 0 HGADMO Cc1cc(OCc2ccccc2)nc(N2C[C@@H]3C[N@@H+](Cc4cnn(C)c4)CC[C@@H]3C2)n1 ZINC001164767249 721230668 /nfs/dbraw/zinc/23/06/68/721230668.db2.gz WMDITDSAIXENFQ-YADHBBJMSA-N 1 1 418.545 3.056 20 0 HGADMO CCOC(=O)c1sc2nc(C)nc(N3CC4(C3)CC[N@@H+](CC3CC3)C4)c2c1C ZINC001164768007 721297650 /nfs/dbraw/zinc/29/76/50/721297650.db2.gz DDRJGQNVNONNDJ-UHFFFAOYSA-N 1 1 400.548 3.407 20 0 HGADMO CN(C)C1=[NH+]OC2(C1)CCN(C(F)(F)c1ccc([Si](C)(C)C)c(Cl)n1)CC2 ZINC001164877983 721325909 /nfs/dbraw/zinc/32/59/09/721325909.db2.gz MBOUIFSXQVIQAB-UHFFFAOYSA-N 1 1 416.976 3.460 20 0 HGADMO CN(C)C1=[NH+]OC2(C1)CCN(C(F)(F)c1cc(Cl)nc(-c3ccncc3)n1)CC2 ZINC001164873428 721326649 /nfs/dbraw/zinc/32/66/49/721326649.db2.gz BZWZVCNTZGSOAX-UHFFFAOYSA-N 1 1 422.867 3.371 20 0 HGADMO C[N@@H+](Cc1ccc(N2CCC3(CCN(C(=O)c4cscn4)C3)CC2)nc1)C1CC1 ZINC001164873988 721329135 /nfs/dbraw/zinc/32/91/35/721329135.db2.gz FJEJVPRILVXDEJ-UHFFFAOYSA-N 1 1 411.575 3.265 20 0 HGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@@]2(CCCN(c3cnc4ccccc4n3)C2)C1 ZINC001164777595 721335126 /nfs/dbraw/zinc/33/51/26/721335126.db2.gz OJAYOISPADNWTM-QHCPKHFHSA-N 1 1 407.518 3.354 20 0 HGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@@]2(CCCN(c3cnc4ccccc4n3)C2)C1 ZINC001164777595 721335133 /nfs/dbraw/zinc/33/51/33/721335133.db2.gz OJAYOISPADNWTM-QHCPKHFHSA-N 1 1 407.518 3.354 20 0 HGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@@]2(CCCN(c3ccc(C(C)(C)C)nn3)C2)C1 ZINC001164782298 721366373 /nfs/dbraw/zinc/36/63/73/721366373.db2.gz MRUDYDDBPNNICD-QHCPKHFHSA-N 1 1 413.566 3.498 20 0 HGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@@]2(CCCN(c3ccc(C(C)(C)C)nn3)C2)C1 ZINC001164782298 721366378 /nfs/dbraw/zinc/36/63/78/721366378.db2.gz MRUDYDDBPNNICD-QHCPKHFHSA-N 1 1 413.566 3.498 20 0 HGADMO CCc1c(Cl)ncnc1N1CCC[C@@]2(C1)COCC[N@H+](Cc1c(C)noc1C)C2 ZINC001164787013 721368649 /nfs/dbraw/zinc/36/86/49/721368649.db2.gz XFAVWXFECURNMT-OAQYLSRUSA-N 1 1 419.957 3.416 20 0 HGADMO CCc1c(Cl)ncnc1N1CCC[C@@]2(C1)COCC[N@@H+](Cc1c(C)noc1C)C2 ZINC001164787013 721368651 /nfs/dbraw/zinc/36/86/51/721368651.db2.gz XFAVWXFECURNMT-OAQYLSRUSA-N 1 1 419.957 3.416 20 0 HGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@@]2(CCCN(c3ccc(-c4ccco4)nn3)C2)C1 ZINC001164782944 721369529 /nfs/dbraw/zinc/36/95/29/721369529.db2.gz NYOOTLWTDSJQPH-QHCPKHFHSA-N 1 1 423.517 3.460 20 0 HGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@@]2(CCCN(c3ccc(-c4ccco4)nn3)C2)C1 ZINC001164782944 721369531 /nfs/dbraw/zinc/36/95/31/721369531.db2.gz NYOOTLWTDSJQPH-QHCPKHFHSA-N 1 1 423.517 3.460 20 0 HGADMO CCc1cc(Cl)nc(N2CCC[C@]3(C2)COCC[N@H+](Cc2c(C)noc2C)C3)n1 ZINC001164782579 721373752 /nfs/dbraw/zinc/37/37/52/721373752.db2.gz MJXYOBHDIZNENM-NRFANRHFSA-N 1 1 419.957 3.416 20 0 HGADMO CCc1cc(Cl)nc(N2CCC[C@]3(C2)COCC[N@@H+](Cc2c(C)noc2C)C3)n1 ZINC001164782579 721373754 /nfs/dbraw/zinc/37/37/54/721373754.db2.gz MJXYOBHDIZNENM-NRFANRHFSA-N 1 1 419.957 3.416 20 0 HGADMO C[NH+]1CCN(C[C@@H]2CCC[C@]3(CCN(c4ncnc5ccc(Cl)cc54)C3)O2)CC1 ZINC001164892262 721392514 /nfs/dbraw/zinc/39/25/14/721392514.db2.gz SMSKQCDKAVEKKO-PGRDOPGGSA-N 1 1 415.969 3.049 20 0 HGADMO O=C(NC1CCCCC1)c1cccnc1N1C[C@@H]2C[NH+](Cc3nccs3)C[C@H]2C1 ZINC001164782190 721394184 /nfs/dbraw/zinc/39/41/84/721394184.db2.gz FDLZRNDGRBSICO-IRXDYDNUSA-N 1 1 411.575 3.169 20 0 HGADMO C[NH+]1CCN(C[C@H]2CCC[C@]3(CCN(c4ncnc5cc(Cl)ccc54)C3)O2)CC1 ZINC001164887677 721401284 /nfs/dbraw/zinc/40/12/84/721401284.db2.gz MDPMKZSLFIDZKW-XMSQKQJNSA-N 1 1 415.969 3.049 20 0 HGADMO C[NH+]1CCN(C[C@@H]2CCC[C@@]3(CCN(c4ncnc5cc(Cl)ccc54)C3)O2)CC1 ZINC001164887674 721401423 /nfs/dbraw/zinc/40/14/23/721401423.db2.gz MDPMKZSLFIDZKW-AVRDEDQJSA-N 1 1 415.969 3.049 20 0 HGADMO C[NH+]1CCN(C[C@H]2CCC[C@]3(CCN(c4cnc5c(Cl)cccc5n4)C3)O2)CC1 ZINC001164886689 721402017 /nfs/dbraw/zinc/40/20/17/721402017.db2.gz KSQQEAONQICCAO-VGOFRKELSA-N 1 1 415.969 3.049 20 0 HGADMO CCOC(=O)c1c(C)cc(Cl)nc1N1C[C@@H]2C[N@@H+](Cc3nccs3)C[C@@H]2C1 ZINC001164782909 721403142 /nfs/dbraw/zinc/40/31/42/721403142.db2.gz HAIZNDMPQAVIIX-OKILXGFUSA-N 1 1 406.939 3.245 20 0 HGADMO CCOC(=O)c1c(C)cc(Cl)nc1N1C[C@@H]2C[N@H+](Cc3nccs3)C[C@@H]2C1 ZINC001164782909 721403145 /nfs/dbraw/zinc/40/31/45/721403145.db2.gz HAIZNDMPQAVIIX-OKILXGFUSA-N 1 1 406.939 3.245 20 0 HGADMO C[NH+]1CCN(C[C@H]2CCC[C@@]3(CCN(c4cc5nccc(Cl)c5cn4)C3)O2)CC1 ZINC001164884731 721407861 /nfs/dbraw/zinc/40/78/61/721407861.db2.gz FKPSHCKCDXSNSF-VGSWGCGISA-N 1 1 415.969 3.049 20 0 HGADMO CCOC(=O)c1cc(N2C[C@@H]3C[NH+](Cc4nccs4)C[C@H]3C2)nc2ccccc21 ZINC001164785458 721408599 /nfs/dbraw/zinc/40/85/99/721408599.db2.gz MJPDKIKVQNWJDQ-HOTGVXAUSA-N 1 1 408.527 3.436 20 0 HGADMO COc1cc2c(cc1Cl)ncnc2N1C[C@H]2C[NH+](Cc3nccs3)C[C@@H]2C1 ZINC001164781136 721411161 /nfs/dbraw/zinc/41/11/61/721411161.db2.gz BXBRYMODOFNDPH-CHWSQXEVSA-N 1 1 401.923 3.317 20 0 HGADMO C[NH+]1CCN(C[C@@H]2CCC[C@@]3(CCN(c4ccc5c(Cl)ccnc5n4)C3)O2)CC1 ZINC001164889520 721419598 /nfs/dbraw/zinc/41/95/98/721419598.db2.gz RJEZUUNNRWPRSH-JTSKRJEESA-N 1 1 415.969 3.049 20 0 HGADMO Cc1c(Cl)cnc(Cl)c1N1CC[C@@]2(C1)CCC[C@@H](CN1CC[NH+](C)CC1)O2 ZINC001164892246 721429018 /nfs/dbraw/zinc/42/90/18/721429018.db2.gz HUDWMBZRMNMKFN-OXJNMPFZSA-N 1 1 413.393 3.462 20 0 HGADMO FC(F)(c1nc2ccc(Cl)nc2[nH]1)N1C[C@H]2C[NH+](Cc3nccs3)C[C@@H]2C1 ZINC001164786598 721429372 /nfs/dbraw/zinc/42/93/72/721429372.db2.gz PAAVCKYLNLUQMS-GHMZBOCLSA-N 1 1 410.881 3.181 20 0 HGADMO COC(=O)c1nc(N2C[C@@H]3C[N@@H+](Cc4nccs4)C[C@@H]3C2)c2ccccc2c1OC ZINC001164781969 721431964 /nfs/dbraw/zinc/43/19/64/721431964.db2.gz DXUPQCCMECXUQF-GASCZTMLSA-N 1 1 424.526 3.055 20 0 HGADMO COC(=O)c1nc(N2C[C@@H]3C[N@H+](Cc4nccs4)C[C@@H]3C2)c2ccccc2c1OC ZINC001164781969 721431965 /nfs/dbraw/zinc/43/19/65/721431965.db2.gz DXUPQCCMECXUQF-GASCZTMLSA-N 1 1 424.526 3.055 20 0 HGADMO Cc1csc2nc(C)nc(N3CC[C@]4(C3)CCC[C@@H](CN3CC[NH+](C)CC3)O4)c12 ZINC001164890240 721441046 /nfs/dbraw/zinc/44/10/46/721441046.db2.gz CQSBSOUZNDWBBA-AVRDEDQJSA-N 1 1 415.607 3.074 20 0 HGADMO Cc1c(Cl)nc(C(C)C)nc1N1CC[C@]2(C1)CCC[C@H](CN1CC[NH+](C)CC1)O2 ZINC001164895445 721446248 /nfs/dbraw/zinc/44/62/48/721446248.db2.gz PDQNQWWFSUPLBI-GCJKJVERSA-N 1 1 422.017 3.327 20 0 HGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1nccc(C(C)C)n1)CC2 ZINC001164789361 721463187 /nfs/dbraw/zinc/46/31/87/721463187.db2.gz XJALUXFZWYJIOD-HXUWFJFHSA-N 1 1 402.583 3.334 20 0 HGADMO COC(=O)c1cnc(Cl)nc1N1CCC2(CC([N@@H+](C)Cc3ccncc3)C2)CC1 ZINC001164791628 721490827 /nfs/dbraw/zinc/49/08/27/721490827.db2.gz CYBZGZUBLJAUJV-UHFFFAOYSA-N 1 1 415.925 3.193 20 0 HGADMO CCOC(=O)c1cc(Cl)nc(N2CC[N@H+]3C[C@H](Oc4cccc(F)c4)C[C@H]3C2)c1 ZINC001164901054 721508863 /nfs/dbraw/zinc/50/88/63/721508863.db2.gz WFPFUHCKFXFWDS-FUHWJXTLSA-N 1 1 419.884 3.393 20 0 HGADMO CSc1nc(Cl)cc(N2C[C@H]([N@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@@H]32)n1 ZINC001164794427 721526525 /nfs/dbraw/zinc/52/65/25/721526525.db2.gz DBHOMIIKXVIRFJ-RLFYNMQTSA-N 1 1 405.955 3.115 20 0 HGADMO CSc1nc(Cl)cc(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@@H]32)n1 ZINC001164794427 721526528 /nfs/dbraw/zinc/52/65/28/721526528.db2.gz DBHOMIIKXVIRFJ-RLFYNMQTSA-N 1 1 405.955 3.115 20 0 HGADMO COc1cc2ncnc(N3CC[N@H+]4C[C@@H](Oc5cccc(F)c5)C[C@H]4C3)c2c(OC)c1 ZINC001164903453 721538468 /nfs/dbraw/zinc/53/84/68/721538468.db2.gz CRPOTYRRGPBHER-LPHOPBHVSA-N 1 1 424.476 3.128 20 0 HGADMO COC(=O)c1ccc(Cl)c(N2CC[N@H+]3C[C@H](Oc4cccc(F)c4)C[C@@H]3C2)n1 ZINC001164911994 721538521 /nfs/dbraw/zinc/53/85/21/721538521.db2.gz YAHCNUJIPHWLSA-GDBMZVCRSA-N 1 1 405.857 3.003 20 0 HGADMO CCOC(=O)/C=C\c1ccc(N2CC[N@H+]3C[C@H](Oc4cccc(F)c4)C[C@H]3C2)nc1 ZINC001164907319 721543433 /nfs/dbraw/zinc/54/34/33/721543433.db2.gz MYCYVWHPCNUXGM-HDKDFSDTSA-N 1 1 411.477 3.139 20 0 HGADMO COc1cc2c(cc1F)ncnc2N1CC[N@H+]2C[C@@H](Oc3cccc(F)c3)C[C@@H]2C1 ZINC001164903008 721544449 /nfs/dbraw/zinc/54/44/49/721544449.db2.gz BREFVRDQUUDLGG-WBVHZDCISA-N 1 1 412.440 3.259 20 0 HGADMO CSc1cnc(Cl)nc1N1C[C@H]([N@H+](C)Cc2cccnc2)[C@@H]2OCCC[C@@H]21 ZINC001164798649 721558152 /nfs/dbraw/zinc/55/81/52/721558152.db2.gz BUOOSSARRHICER-YQQAZPJKSA-N 1 1 405.955 3.115 20 0 HGADMO CSc1cnc(Cl)nc1N1C[C@H]([N@@H+](C)Cc2cccnc2)[C@@H]2OCCC[C@@H]21 ZINC001164798649 721558156 /nfs/dbraw/zinc/55/81/56/721558156.db2.gz BUOOSSARRHICER-YQQAZPJKSA-N 1 1 405.955 3.115 20 0 HGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2ncnc3[nH]c4ccccc4c32)[C@@H]2CCCO[C@@H]12 ZINC001164800390 721559771 /nfs/dbraw/zinc/55/97/71/721559771.db2.gz FJYLHKCUUCKVCY-KCZVDYSFSA-N 1 1 414.513 3.374 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2ncnc3[nH]c4ccccc4c32)[C@@H]2CCCO[C@@H]12 ZINC001164800390 721559774 /nfs/dbraw/zinc/55/97/74/721559774.db2.gz FJYLHKCUUCKVCY-KCZVDYSFSA-N 1 1 414.513 3.374 20 0 HGADMO C[C@@H]1CCCN(c2cc(N3CC[N@H+]4C[C@@H](Oc5cccc(F)c5)C[C@@H]4C3)ncn2)C1 ZINC001164910836 721560321 /nfs/dbraw/zinc/56/03/21/721560321.db2.gz XLHRHYQOFLERPI-QFUCXCTJSA-N 1 1 411.525 3.194 20 0 HGADMO COC(=O)c1cc(C)nc(N2CCC(F)(F)[C@@]3(CC[N@@H+](Cc4ccccn4)C3)C2)c1 ZINC001164907948 721584934 /nfs/dbraw/zinc/58/49/34/721584934.db2.gz XCNIMOSEOGRHRH-OAQYLSRUSA-N 1 1 416.472 3.309 20 0 HGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2cncc(OCC3CCCC3)n2)[C@H]2CCCO[C@@H]12 ZINC001164802593 721589249 /nfs/dbraw/zinc/58/92/49/721589249.db2.gz GXUBRQUDCREVOX-YZUZCNPQSA-N 1 1 423.561 3.309 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2cncc(OCC3CCCC3)n2)[C@H]2CCCO[C@@H]12 ZINC001164802593 721589251 /nfs/dbraw/zinc/58/92/51/721589251.db2.gz GXUBRQUDCREVOX-YZUZCNPQSA-N 1 1 423.561 3.309 20 0 HGADMO CSc1cc(N2C[C@H]([N@H+](C)Cc3cccnc3)[C@H]3OCCC[C@H]32)nc(SC)n1 ZINC001164800688 721590150 /nfs/dbraw/zinc/59/01/50/721590150.db2.gz CLWFQNKUEABXRM-GJYPPUQNSA-N 1 1 417.604 3.184 20 0 HGADMO CSc1cc(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@H]3OCCC[C@H]32)nc(SC)n1 ZINC001164800688 721590151 /nfs/dbraw/zinc/59/01/51/721590151.db2.gz CLWFQNKUEABXRM-GJYPPUQNSA-N 1 1 417.604 3.184 20 0 HGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2nc3c(nc2Cl)CCCC3)[C@H]2CCCO[C@@H]12 ZINC001164810192 721590843 /nfs/dbraw/zinc/59/08/43/721590843.db2.gz VCLAPYXEWYLONO-XUVXKRRUSA-N 1 1 413.953 3.272 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2nc3c(nc2Cl)CCCC3)[C@H]2CCCO[C@@H]12 ZINC001164810192 721590846 /nfs/dbraw/zinc/59/08/46/721590846.db2.gz VCLAPYXEWYLONO-XUVXKRRUSA-N 1 1 413.953 3.272 20 0 HGADMO COc1ncc(Cl)c(N2CCC(F)(F)[C@]3(CC[N@@H+](Cc4ccccn4)C3)C2)n1 ZINC001164909801 721732770 /nfs/dbraw/zinc/73/27/70/721732770.db2.gz DSIFAYPXBCWWLI-SFHVURJKSA-N 1 1 409.868 3.271 20 0 HGADMO CCOC(=O)c1ccnc(N2CCc3c(C[N@H+](C)Cc4ccco4)cncc3C2)c1 ZINC001164908358 721745526 /nfs/dbraw/zinc/74/55/26/721745526.db2.gz GPDKNDARAJOCPF-UHFFFAOYSA-N 1 1 406.486 3.441 20 0 HGADMO CCOC(=O)c1ccnc(N2CCc3c(C[N@@H+](C)Cc4ccco4)cncc3C2)c1 ZINC001164908358 721745535 /nfs/dbraw/zinc/74/55/35/721745535.db2.gz GPDKNDARAJOCPF-UHFFFAOYSA-N 1 1 406.486 3.441 20 0 HGADMO COC(=O)c1cnc(N2CCc3c(C[N@H+](C)Cc4ccco4)cncc3C2)cc1OC ZINC001164909995 721747065 /nfs/dbraw/zinc/74/70/65/721747065.db2.gz XBGPNDBEFGGLST-UHFFFAOYSA-N 1 1 422.485 3.060 20 0 HGADMO COC(=O)c1cnc(N2CCc3c(C[N@@H+](C)Cc4ccco4)cncc3C2)cc1OC ZINC001164909995 721747067 /nfs/dbraw/zinc/74/70/67/721747067.db2.gz XBGPNDBEFGGLST-UHFFFAOYSA-N 1 1 422.485 3.060 20 0 HGADMO Clc1cc(N2CCO[C@]3(C2)COCC[N@H+](Cc2cccnc2)C3)c2ccccc2n1 ZINC001164910621 721767457 /nfs/dbraw/zinc/76/74/57/721767457.db2.gz JLWYMAYUOUGNRH-HSZRJFAPSA-N 1 1 424.932 3.391 20 0 HGADMO Clc1cc(N2CCO[C@]3(C2)COCC[N@@H+](Cc2cccnc2)C3)c2ccccc2n1 ZINC001164910621 721767460 /nfs/dbraw/zinc/76/74/60/721767460.db2.gz JLWYMAYUOUGNRH-HSZRJFAPSA-N 1 1 424.932 3.391 20 0 HGADMO C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@@H]2CN(c3ncccc3C(=O)N3CCCC3)C[C@H]21 ZINC001165020564 721799125 /nfs/dbraw/zinc/79/91/25/721799125.db2.gz FZZDLOIARUMISI-UEVCKROQSA-N 1 1 419.573 3.450 20 0 HGADMO C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@H]2CN(c3ccc(CN4CCOCC4)cn3)C[C@H]21 ZINC001165017744 721802108 /nfs/dbraw/zinc/80/21/08/721802108.db2.gz AINWXMRYDYSLKV-QPTUXGOLSA-N 1 1 421.589 3.046 20 0 HGADMO CCOC(=O)Cc1cccnc1N1C[C@@H]2CCC[C@H]([N@@H+](C)Cc3ccccn3)[C@@H]2C1 ZINC001165017758 721804272 /nfs/dbraw/zinc/80/42/72/721804272.db2.gz AJXLKUSGHGNSEI-NNWRFLSQSA-N 1 1 408.546 3.319 20 0 HGADMO CC(C)OC(=O)c1ccc(N2C[C@@H]3CCC[C@@H]([N@@H+](C)Cc4ccccn4)[C@@H]3C2)nn1 ZINC001165027341 721805379 /nfs/dbraw/zinc/80/53/79/721805379.db2.gz VNRKOXDODYOKJX-FBBABVLZSA-N 1 1 409.534 3.174 20 0 HGADMO COC(=O)c1c[nH]c2nc(N3C[C@@H]4CCC[C@@H]([N@@H+](C)Cc5ccccn5)[C@@H]4C3)ccc12 ZINC001165024722 721807792 /nfs/dbraw/zinc/80/77/92/721807792.db2.gz MRKCSQADHSSDJS-ZLGUVYLKSA-N 1 1 419.529 3.481 20 0 HGADMO CCOC(=O)Cc1ccc(N2C[C@@H]3CCC[C@@H]([N@@H+](C)Cc4ccccn4)[C@H]3C2)nc1 ZINC001165026236 721812810 /nfs/dbraw/zinc/81/28/10/721812810.db2.gz POVUMDWPJYGLKG-ILWGZMRPSA-N 1 1 408.546 3.319 20 0 HGADMO CNC(=O)c1nc(N2C[C@@H]3CCC[C@@H]([N@@H+](C)Cc4ccccn4)[C@@H]3C2)ccc1Cl ZINC001165025506 721816677 /nfs/dbraw/zinc/81/66/77/721816677.db2.gz NCHZZYPMRJDXHW-KVSKMBFKSA-N 1 1 413.953 3.227 20 0 HGADMO COCCOC(=O)c1ccnc(N2C[C@@H]3CCC[C@H]([N@@H+](C)Cc4ccccn4)[C@@H]3C2)c1 ZINC001165027771 721829778 /nfs/dbraw/zinc/82/97/78/721829778.db2.gz TZULBGIICKBEJT-NNWRFLSQSA-N 1 1 424.545 3.017 20 0 HGADMO C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@@H]2CN([C@@H](F)Oc3cncc(Cl)n3)C[C@@H]21 ZINC001165027883 721829788 /nfs/dbraw/zinc/82/97/88/721829788.db2.gz USGXEVOUQMMWOB-XNWPKKHHSA-N 1 1 405.905 3.389 20 0 HGADMO Cc1nc(CN2CCOC[C@@]3(CN(c4[nH+]ccc5cccc(C)c54)CCO3)C2)cs1 ZINC001164921249 721833401 /nfs/dbraw/zinc/83/34/01/721833401.db2.gz CSVVNFBCBPLCCW-QHCPKHFHSA-N 1 1 424.570 3.416 20 0 HGADMO Cc1c(C)n(Cc2ccccc2)c2ncnc(N3CC[C@H]4[C@H]3CC[N@@H+]4CCN(C)C)c12 ZINC001164931500 721878947 /nfs/dbraw/zinc/87/89/47/721878947.db2.gz FZQSEFTZNABTRU-FCHUYYIVSA-N 1 1 418.589 3.311 20 0 HGADMO Cc1c(C)n(Cc2ccccc2)c2ncnc(N3CC[C@H]4[C@H]3CCN4CC[NH+](C)C)c12 ZINC001164931500 721878948 /nfs/dbraw/zinc/87/89/48/721878948.db2.gz FZQSEFTZNABTRU-FCHUYYIVSA-N 1 1 418.589 3.311 20 0 HGADMO Cc1sc2nc(C[NH+]3CCCCC3)nc(N3CC[C@@H]4[C@@H]3CCC(=O)N4C)c2c1C ZINC001164930048 721893382 /nfs/dbraw/zinc/89/33/82/721893382.db2.gz BHINBPYVTBNCRP-SJORKVTESA-N 1 1 413.591 3.494 20 0 HGADMO Cc1ccc(C[N@H+]2CCOC3(CCN(c4ncnc5cnc(F)cc54)CC3)C2)cc1 ZINC001164939852 721924074 /nfs/dbraw/zinc/92/40/74/721924074.db2.gz OAJHOFZXKUYWJH-UHFFFAOYSA-N 1 1 407.493 3.344 20 0 HGADMO Cc1ccc(C[N@H+]2CCOC3(CCN(c4ncc5ncnc(Cl)c5n4)CC3)C2)cc1 ZINC001164940624 721928686 /nfs/dbraw/zinc/92/86/86/721928686.db2.gz UUXZMYQBMWDOTL-UHFFFAOYSA-N 1 1 424.936 3.253 20 0 HGADMO CCN(CCC(N)=O)c1nc(C[NH+]2CCCCC2)nc2sc3c(c21)CCCC3 ZINC001165047309 721984111 /nfs/dbraw/zinc/98/41/11/721984111.db2.gz MUTCZGLJJWXJNA-UHFFFAOYSA-N 1 1 401.580 3.258 20 0 HGADMO COC(=O)c1nc(N2CCC3(CC[N@@H+](Cc4cccnc4)C3)CC2)ccc1Cl ZINC001164952479 722016933 /nfs/dbraw/zinc/01/69/33/722016933.db2.gz LKUQMCCMKPXEIH-UHFFFAOYSA-N 1 1 400.910 3.409 20 0 HGADMO O=C(c1cccnc1N1CC[NH+](CCc2ccccn2)CC1)N1CCc2ccccc21 ZINC001165055217 722017167 /nfs/dbraw/zinc/01/71/67/722017167.db2.gz MHSWCZBVRVBXOF-UHFFFAOYSA-N 1 1 413.525 3.044 20 0 HGADMO CC[NH+](CC)Cc1nc2sc(C)c(C)c2c(N2C[C@H]3[C@@H](C2)[C@@H]3NC(=O)C(C)C)n1 ZINC001164961669 722039571 /nfs/dbraw/zinc/03/95/71/722039571.db2.gz LYKMJPDMPSLRKW-MNZLEMJZSA-N 1 1 415.607 3.357 20 0 HGADMO FC(F)(c1ccnc(Cl)n1)N1CCC2(CC1)COCC[N@@H+](Cc1ccncc1)C2 ZINC001164958787 722052055 /nfs/dbraw/zinc/05/20/55/722052055.db2.gz GHLJQWAQTHSBDU-UHFFFAOYSA-N 1 1 423.895 3.189 20 0 HGADMO F[C@@H](Oc1ccc(Cl)nc1)N1CCC2(CC1)COCC[N@@H+](Cc1ccncc1)C2 ZINC001164963806 722056309 /nfs/dbraw/zinc/05/63/09/722056309.db2.gz LVDBNIPCTHGLHW-HXUWFJFHSA-N 1 1 420.916 3.377 20 0 HGADMO Clc1nnc(N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)c2ccccc12 ZINC001164984272 722103871 /nfs/dbraw/zinc/10/38/71/722103871.db2.gz RUDFFNDYBAKUKF-XLIONFOSSA-N 1 1 409.921 3.406 20 0 HGADMO COc1ccc2c(ccnc2N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)c1 ZINC001164979916 722106911 /nfs/dbraw/zinc/10/69/11/722106911.db2.gz IIQFCPSQKZJBAM-OFNKIYASSA-N 1 1 404.514 3.366 20 0 HGADMO Clc1nnc(N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)c2sccc21 ZINC001164979312 722106992 /nfs/dbraw/zinc/10/69/92/722106992.db2.gz IAEUIFVZASTYSY-NVXWUHKLSA-N 1 1 415.950 3.467 20 0 HGADMO c1ccc(Oc2ccnc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)n2)cc1 ZINC001164982321 722107346 /nfs/dbraw/zinc/10/73/46/722107346.db2.gz NMVFDZGZONEXKE-RBBKRZOGSA-N 1 1 417.513 3.391 20 0 HGADMO Clc1cccc2nc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)cnc12 ZINC001164982016 722110330 /nfs/dbraw/zinc/11/03/30/722110330.db2.gz VSWBZNYTRFFBLZ-PXNSSMCTSA-N 1 1 409.921 3.406 20 0 HGADMO Clc1cnc2nc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)ccc2c1 ZINC001164975637 722112811 /nfs/dbraw/zinc/11/28/11/722112811.db2.gz KDMRWLVWCUJOCF-QUCCMNQESA-N 1 1 409.921 3.406 20 0 HGADMO CC(C)(C)OC(=O)c1ccc(N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)nc1 ZINC001164980508 722117846 /nfs/dbraw/zinc/11/78/46/722117846.db2.gz RNENCRWYTDYVPZ-LEWJYISDSA-N 1 1 424.545 3.159 20 0 HGADMO Clc1ccc2nc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)ncc2c1 ZINC001164978162 722121953 /nfs/dbraw/zinc/12/19/53/722121953.db2.gz NQRBQGKZUNNZGO-UTKZUKDTSA-N 1 1 409.921 3.406 20 0 HGADMO CCOc1ccc2ncnc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)c2c1 ZINC001164971427 722122118 /nfs/dbraw/zinc/12/21/18/722122118.db2.gz CKWSGGHOIYFLSD-CVDCTZTESA-N 1 1 419.529 3.151 20 0 HGADMO Clc1ccnc2cnc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)cc12 ZINC001164978371 722127663 /nfs/dbraw/zinc/12/76/63/722127663.db2.gz OMNLZPWNSWMVHC-UTKZUKDTSA-N 1 1 409.921 3.406 20 0 HGADMO c1ccc(-c2cc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)ncn2)cc1 ZINC001164975161 722138116 /nfs/dbraw/zinc/13/81/16/722138116.db2.gz DXOMFUUHWKYPQT-JTHBVZDNSA-N 1 1 401.514 3.266 20 0 HGADMO Cc1cc2ncnc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)c2cc1C ZINC001164972655 722152479 /nfs/dbraw/zinc/15/24/79/722152479.db2.gz IVMMVXOCEGGQHZ-NZQKXSOJSA-N 1 1 403.530 3.369 20 0 HGADMO Cc1nc(CN2CCO[C@@H]3CCN(c4[nH+]cnc5[nH]c(C)c(C)c54)CC[C@H]32)cs1 ZINC001164985918 722182369 /nfs/dbraw/zinc/18/23/69/722182369.db2.gz CFHWYULYKXUJLL-QZTJIDSGSA-N 1 1 412.563 3.209 20 0 HGADMO O=C1CCC(=O)N1Cc1ccc(N2CCC[C@@]3(CC[N@@H+]3Cc3cccc(F)c3)C2)nc1 ZINC001164995510 722204056 /nfs/dbraw/zinc/20/40/56/722204056.db2.gz NXIRLRHPVPANQU-XMMPIXPASA-N 1 1 422.504 3.115 20 0 HGADMO COCCOC(=O)c1ccnc(N2CCC[C@@]3(CC[N@H+]3Cc3cccc(F)c3)C2)c1 ZINC001164995724 722212269 /nfs/dbraw/zinc/21/22/69/722212269.db2.gz KEWDMBXLAMHOGZ-HSZRJFAPSA-N 1 1 413.493 3.269 20 0 HGADMO C[NH+]1CCN(c2ncnc3c2CCN(c2nc4ccccc4cc2Cl)CC3)CC1 ZINC001164997630 722232106 /nfs/dbraw/zinc/23/21/06/722232106.db2.gz RDWRLJRXTWICFL-UHFFFAOYSA-N 1 1 408.937 3.035 20 0 HGADMO C[NH+]1CCN(c2ncnc3c2CCN(c2ccc4c(Cl)cccc4n2)CC3)CC1 ZINC001164997590 722233137 /nfs/dbraw/zinc/23/31/37/722233137.db2.gz RILWCLKRRKZCJR-UHFFFAOYSA-N 1 1 408.937 3.035 20 0 HGADMO C[C@](CO)(Cc1ccc(Br)cc1)[NH2+]Cc1nnc(-c2cccc(O)c2)o1 ZINC001198219716 1126155146 /nfs/dbraw/zinc/15/51/46/1126155146.db2.gz RNERQBDCMZISOP-LJQANCHMSA-N 1 1 418.291 3.288 20 0 HGADMO COc1ccc(C[C@](C)(CO)[NH2+]Cc2ccc(CN(C)C)c3c2OC(F)(F)O3)cc1 ZINC001461734532 1126196654 /nfs/dbraw/zinc/19/66/54/1126196654.db2.gz FACGSCFTTLARKE-OAQYLSRUSA-N 1 1 422.472 3.162 20 0 HGADMO CCOC(=O)c1nnc(Cl)cc1N1CCC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21 ZINC001164625805 719074151 /nfs/dbraw/zinc/07/41/51/719074151.db2.gz NHLSFVOGJMWHTC-AEFFLSMTSA-N 1 1 400.910 3.408 20 0 HGADMO Clc1ncc(N2CCOCC2)c(N2CCC[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)n1 ZINC001164624960 719079814 /nfs/dbraw/zinc/07/98/14/719079814.db2.gz MHQMUFYRGKQFFI-AZUAARDMSA-N 1 1 413.953 3.067 20 0 HGADMO CON(C)C(=O)c1cc(Cl)nc(N2CCC[C@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)c1 ZINC001164620425 719080776 /nfs/dbraw/zinc/08/07/76/719080776.db2.gz DXPATNRNIPTXCG-HKUYNNGSSA-N 1 1 414.937 3.469 20 0 HGADMO CCOC(=O)[C@@H]1CCc2nnc(N3CCC[C@@H]4C[N@@H+](Cc5ccccc5)C[C@H]43)cc2C1 ZINC001164629042 719112798 /nfs/dbraw/zinc/11/27/98/719112798.db2.gz QOBFQRVLXYLVEY-TXTKFYIRSA-N 1 1 420.557 3.245 20 0 HGADMO CC(C)n1nc(C[NH+](C)C)c2c1CN(c1nc(Cl)nc3c(Cl)ncnc31)CC2 ZINC001164651065 719316534 /nfs/dbraw/zinc/31/65/34/719316534.db2.gz HGSCGTOJLZKSMU-UHFFFAOYSA-N 1 1 421.336 3.128 20 0 HGADMO Cc1oncc1C(=O)N[C@@H]1C[N@@H+](C(C)(C)c2ccnc(Cl)c2)C[C@H]2CCCO[C@@H]21 ZINC001164654545 719321293 /nfs/dbraw/zinc/32/12/93/719321293.db2.gz RLSMWHVOWVMAIK-BJZITVGISA-N 1 1 418.925 3.176 20 0 HGADMO Cc1oncc1C(=O)N[C@@H]1C[N@H+](C(C)(C)c2ccnc(Cl)c2)C[C@H]2CCCO[C@@H]21 ZINC001164654545 719321296 /nfs/dbraw/zinc/32/12/96/719321296.db2.gz RLSMWHVOWVMAIK-BJZITVGISA-N 1 1 418.925 3.176 20 0 HGADMO CNC(=O)C[N@H+]1CCCC12CCN(c1cc3cc(Cl)ncc3cc1OC)CC2 ZINC001164690341 719757758 /nfs/dbraw/zinc/75/77/58/719757758.db2.gz APNQKHIMKRHAGQ-UHFFFAOYSA-N 1 1 402.926 3.078 20 0 HGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2CC[C@@H]3[C@H]2CC(=O)N3Cc2cccnc2)nc1 ZINC001164690673 719774224 /nfs/dbraw/zinc/77/42/24/719774224.db2.gz GVYHETYTSDFZSO-YPAWHYETSA-N 1 1 405.546 3.403 20 0 HGADMO Cc1nc(C[N@H+]2CCCC23CCN(c2cc(Cl)ncc2C(N)=O)CC3)cs1 ZINC001164692224 719804396 /nfs/dbraw/zinc/80/43/96/719804396.db2.gz LSMRHYGJHYMUCB-UHFFFAOYSA-N 1 1 405.955 3.234 20 0 HGADMO Cc1nc(C[N@H+]2CCCC23CCN(c2c(Cl)nccc2C(N)=O)CC3)cs1 ZINC001164703176 719816007 /nfs/dbraw/zinc/81/60/07/719816007.db2.gz UOQPLZAFILWFLC-UHFFFAOYSA-N 1 1 405.955 3.234 20 0 HGADMO COC(=O)[C@@]1(C)C[C@@H]([NH+]2CCOCC2)CCN1c1nccc2cc(Cl)ccc21 ZINC001164697223 719849427 /nfs/dbraw/zinc/84/94/27/719849427.db2.gz BTRYXECWVAIPST-LAUBAEHRSA-N 1 1 403.910 3.121 20 0 HGADMO COC(=O)[C@]1(C)C[C@H]([NH+]2CCOCC2)CCN1c1nccc2cc(F)c(Cl)cc21 ZINC001164702332 719876215 /nfs/dbraw/zinc/87/62/15/719876215.db2.gz IIZAFSLONMKFIB-VFNWGFHPSA-N 1 1 421.900 3.260 20 0 HGADMO COC(=O)c1ccc(Cl)nc1N1CCC2(CC1)C[N@@H+](Cc1cccs1)CCO2 ZINC001164700330 719885803 /nfs/dbraw/zinc/88/58/03/719885803.db2.gz JWYORBCMLKSJNC-UHFFFAOYSA-N 1 1 421.950 3.455 20 0 HGADMO CCN(CC)c1cc(N2CCC3(CC2)C[N@@H+](Cc2cccs2)CCO3)ncn1 ZINC001164696630 719895659 /nfs/dbraw/zinc/89/56/59/719895659.db2.gz GKIFRUZJSQTUIP-UHFFFAOYSA-N 1 1 401.580 3.256 20 0 HGADMO c1csc(C[N@H+]2CCOC3(CCN(c4ccnc(N5CCCCC5)n4)CC3)C2)c1 ZINC001164697661 719897955 /nfs/dbraw/zinc/89/79/55/719897955.db2.gz MRKHUYLIRRNLKA-UHFFFAOYSA-N 1 1 413.591 3.400 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1nc(Cl)nc3ccc(OC)cc31)C2 ZINC001164806706 720067641 /nfs/dbraw/zinc/06/76/41/720067641.db2.gz CZRAGUULRXMHCF-OPAMFIHVSA-N 1 1 416.953 3.477 20 0 HGADMO CCOC(=O)c1cc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COC)ncc1Cl ZINC001164814249 720077014 /nfs/dbraw/zinc/07/70/14/720077014.db2.gz WIUBOTWRSROELX-KKSFZXQISA-N 1 1 407.942 3.096 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1nc(Cl)nc3c1CSCC3)C2 ZINC001164811660 720081956 /nfs/dbraw/zinc/08/19/56/720081956.db2.gz OTHCTKPLMUWYMJ-YWZLYKJASA-N 1 1 408.999 3.104 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(C(F)(F)Oc1ccc(Cl)nc1)C2 ZINC001164813195 720094958 /nfs/dbraw/zinc/09/49/58/720094958.db2.gz TUJYGKMTBDLDID-QAPCUYQASA-N 1 1 401.885 3.344 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1ccc3cc(C(=O)OC)ccc3n1)C2 ZINC001164813277 720106230 /nfs/dbraw/zinc/10/62/30/720106230.db2.gz QAIKOXWVALCBNM-GBXCKJPGSA-N 1 1 409.530 3.206 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(C(F)(F)COc1ccnc(Cl)c1)C2 ZINC001164812034 720110374 /nfs/dbraw/zinc/11/03/74/720110374.db2.gz OBLBPSQNMKJCCW-VQIMIIECSA-N 1 1 415.912 3.387 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1nccc(OCc3ccccc3)n1)C2 ZINC001164808622 720114332 /nfs/dbraw/zinc/11/43/32/720114332.db2.gz FWDWISWXQAFTJD-XUZZJYLKSA-N 1 1 408.546 3.240 20 0 HGADMO COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1nc(C)cc(SC)n1)CC2 ZINC001164714260 720117440 /nfs/dbraw/zinc/11/74/40/720117440.db2.gz BFOLJDSDARPDDL-LJQANCHMSA-N 1 1 413.591 3.409 20 0 HGADMO COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1nc(C)nc3c1CCC3)CC2 ZINC001164711202 720134985 /nfs/dbraw/zinc/13/49/85/720134985.db2.gz FZPRZMMZHCTBBS-HXUWFJFHSA-N 1 1 407.562 3.176 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(C(F)(F)c1nc(C)c(C)c(Cl)n1)C2 ZINC001164807980 720137061 /nfs/dbraw/zinc/13/70/61/720137061.db2.gz DHUROJZGNLXOGU-QFBILLFUSA-N 1 1 414.928 3.476 20 0 HGADMO COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1c(F)nc(F)nc1Cl)CC2 ZINC001164714876 720138795 /nfs/dbraw/zinc/13/87/95/720138795.db2.gz ZZPWNNZDAHSPAQ-OAHLLOKOSA-N 1 1 423.895 3.311 20 0 HGADMO COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1cc(-c3nnco3)ccn1)CC2 ZINC001164714013 720146692 /nfs/dbraw/zinc/14/66/92/720146692.db2.gz VGHBIRTZWZCQRJ-FQEVSTJZSA-N 1 1 420.517 3.034 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1ncc3c(n1)-c1ccccc1CC3)C2 ZINC001164817802 720150268 /nfs/dbraw/zinc/15/02/68/720150268.db2.gz QHJGXRLFOWFUPE-PXDATVDWSA-N 1 1 404.558 3.427 20 0 HGADMO CCc1cc2c(nc(Cl)nc2N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COC)[nH]1 ZINC001164814244 720155279 /nfs/dbraw/zinc/15/52/79/720155279.db2.gz FDPTUTOJPRGERR-VFNWGFHPSA-N 1 1 403.958 3.358 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1nccc(-c3ccccc3OC)n1)C2 ZINC001164816659 720173639 /nfs/dbraw/zinc/17/36/39/720173639.db2.gz LZMLEUFFLCMMAL-YADARESESA-N 1 1 408.546 3.337 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1cc(-c3ccc(OC)cc3)ncn1)C2 ZINC001164817860 720175226 /nfs/dbraw/zinc/17/52/26/720175226.db2.gz QNHPFGMKNFGVBP-RDPSFJRHSA-N 1 1 408.546 3.337 20 0 HGADMO CCCSc1ncnc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COC)c1OC ZINC001164812944 720200339 /nfs/dbraw/zinc/20/03/39/720200339.db2.gz NJWFQCURLJXEFK-DYESRHJHSA-N 1 1 406.596 3.172 20 0 HGADMO CC(C)[N@@H+](C)Cc1cc(=O)n2c(n1)CN(c1nc(Cl)cc(C(C)(C)C)n1)CCC2 ZINC001164813856 720232108 /nfs/dbraw/zinc/23/21/08/720232108.db2.gz QIUIWGBGFSTFRZ-UHFFFAOYSA-N 1 1 418.973 3.235 20 0 HGADMO O=C(NC1CCCCC1)c1cccnc1N1CC[C@@H]2[C@H]1CC[N@H+]2Cc1cccnc1 ZINC001164721717 720340276 /nfs/dbraw/zinc/34/02/76/720340276.db2.gz DBXPIXKMWKATFP-FGZHOGPDSA-N 1 1 405.546 3.392 20 0 HGADMO CCOC(=O)c1cc(Cl)nc(N2CC[C@H]3[C@@H]2CC[N@H+]3Cc2cccnc2)c1C ZINC001164724328 720380910 /nfs/dbraw/zinc/38/09/10/720380910.db2.gz JQVYYQVBSPPGHD-ROUUACIJSA-N 1 1 400.910 3.468 20 0 HGADMO COC(=O)c1cc(Cl)nc(C(F)(F)N2CC[C@H]3[C@@H]2CC[N@@H+]3Cc2cccnc2)c1 ZINC001164730397 720397799 /nfs/dbraw/zinc/39/77/99/720397799.db2.gz XHODZFVMTASPMG-HOTGVXAUSA-N 1 1 422.863 3.315 20 0 HGADMO COC(=O)c1cc(Cl)nc(C(F)(F)N2CC[C@H]3[C@@H]2CC[N@H+]3Cc2cccnc2)c1 ZINC001164730397 720397803 /nfs/dbraw/zinc/39/78/03/720397803.db2.gz XHODZFVMTASPMG-HOTGVXAUSA-N 1 1 422.863 3.315 20 0 HGADMO CCOC(=O)c1cc2ncnc(N3CC[C@H]4[C@@H]3CC[N@H+]4Cc3cccnc3)c2s1 ZINC001164734255 720411590 /nfs/dbraw/zinc/41/15/90/720411590.db2.gz RHIZQKCUCXNJIA-IRXDYDNUSA-N 1 1 409.515 3.116 20 0 HGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2C[C@@H]3COC[C@@H](CC(=O)NC(C)C)[C@@H]3C2)nc1 ZINC001164827202 720424558 /nfs/dbraw/zinc/42/45/58/720424558.db2.gz RSKNOZVCWKERNL-YUMYIRISSA-N 1 1 414.594 3.242 20 0 HGADMO COc1ccc(OC)c(-c2ccc(N3CC[C@@H]4[C@@H]3CC[N@H+]4Cc3cccnc3)nn2)c1 ZINC001164735044 720457580 /nfs/dbraw/zinc/45/75/80/720457580.db2.gz VEMXZXBXEVZYMF-YADHBBJMSA-N 1 1 417.513 3.409 20 0 HGADMO Cc1cc(N2CC[C@H]3[C@H]2CC[N@H+]3Cc2cccnc2)nc(NC(=O)c2ccccc2)n1 ZINC001164731655 720466989 /nfs/dbraw/zinc/46/69/89/720466989.db2.gz XGFJKJOPVVWBRA-LEWJYISDSA-N 1 1 414.513 3.286 20 0 HGADMO O[C@H]1CCN(c2ncnc3c2CC[N@H+](Cc2ccccc2)C3)[C@H]1Cc1ccccc1 ZINC001164835432 720487810 /nfs/dbraw/zinc/48/78/10/720487810.db2.gz XYJQKEXYGSOOGR-ZEQRLZLVSA-N 1 1 400.526 3.217 20 0 HGADMO O[C@H]1CCN(c2ncnc3c2CC[N@@H+](Cc2ccccc2)C3)[C@H]1Cc1ccccc1 ZINC001164835432 720487817 /nfs/dbraw/zinc/48/78/17/720487817.db2.gz XYJQKEXYGSOOGR-ZEQRLZLVSA-N 1 1 400.526 3.217 20 0 HGADMO CC(C)[N@@H+]1[C@@H]2CCN(C(F)(F)c3ccnc(Cl)n3)C[C@H]2C[C@H]1Cn1cccn1 ZINC001164839384 720504641 /nfs/dbraw/zinc/50/46/41/720504641.db2.gz TUHGOMUZRBWWQR-OWCLPIDISA-N 1 1 410.900 3.249 20 0 HGADMO CCOC(=O)c1ccc(N2CC[C@@H]3[C@H](C[C@@H](Cn4cccn4)[N@H+]3C(C)C)C2)nc1C ZINC001164836018 720507371 /nfs/dbraw/zinc/50/73/71/720507371.db2.gz LNVFLVANXJIWIQ-SVFBPWRDSA-N 1 1 411.550 3.141 20 0 HGADMO COc1nc2ccccc2nc1N1CC[C@@H]2[C@@H](C[C@H](Cn3cccn3)[N@H+]2C(C)C)C1 ZINC001164838526 720521891 /nfs/dbraw/zinc/52/18/91/720521891.db2.gz RNUFFZYDPSVOAM-WAOWUJCRSA-N 1 1 406.534 3.213 20 0 HGADMO COC(=O)c1nc(N2CC[C@@H]3[C@H](C[C@H](Cn4cccn4)[N@H+]3C(C)C)C2)ccc1Cl ZINC001164835891 720541006 /nfs/dbraw/zinc/54/10/06/720541006.db2.gz IXVBSBPNTZLVQD-JFIYKMOQSA-N 1 1 417.941 3.096 20 0 HGADMO CSc1nc(Cl)ncc1N1CC[C@@H]2[C@@H](C[C@@H](Cn3cccn3)[N@H+]2C(C)C)C1 ZINC001164842017 720543133 /nfs/dbraw/zinc/54/31/33/720543133.db2.gz WDBXCOFZXJEDLS-HRCADAONSA-N 1 1 406.987 3.426 20 0 HGADMO COc1c(Cl)nc(C)nc1N1CC[C@@H]2[C@@H](C[C@@H](Cn3cccn3)[N@H+]2C(C)C)C1 ZINC001164839319 720544082 /nfs/dbraw/zinc/54/40/82/720544082.db2.gz QFXNLTAMKXAXDJ-YESZJQIVSA-N 1 1 404.946 3.021 20 0 HGADMO COC(=O)c1ccc(Cl)c(N2CC[C@@H]3[C@@H](C[C@H](Cn4cccn4)[N@H+]3C(C)C)C2)n1 ZINC001164839638 720554606 /nfs/dbraw/zinc/55/46/06/720554606.db2.gz RDJQBDCNYFRONS-FRQCXROJSA-N 1 1 417.941 3.096 20 0 HGADMO CC(C)[N@@H+]1[C@@H]2CCN(c3cncc(N4CCCCC4)n3)C[C@@H]2C[C@H]1Cn1cccn1 ZINC001164839285 720575473 /nfs/dbraw/zinc/57/54/73/720575473.db2.gz PTSHBNKTPAFZRV-PCCBWWKXSA-N 1 1 409.582 3.041 20 0 HGADMO COc1cccc2c(N3CC[N@H+]4C[C@H](Oc5cncnc5)C[C@@H]4C3)cc(Cl)nc12 ZINC001164743746 720608092 /nfs/dbraw/zinc/60/80/92/720608092.db2.gz QKMRAPJLWLSNOI-HUUCEWRRSA-N 1 1 411.893 3.029 20 0 HGADMO FC(F)(c1ccc(Cl)nc1Cl)N1CC[N@@H+]2C[C@H](Oc3cncnc3)C[C@@H]2C1 ZINC001164744269 720618878 /nfs/dbraw/zinc/61/88/78/720618878.db2.gz QXJAFYQDTRUSQT-VXGBXAGGSA-N 1 1 416.259 3.065 20 0 HGADMO FC(F)(c1ccc(Cl)nc1Cl)N1CC[N@H+]2C[C@H](Oc3cncnc3)C[C@@H]2C1 ZINC001164744269 720618888 /nfs/dbraw/zinc/61/88/88/720618888.db2.gz QXJAFYQDTRUSQT-VXGBXAGGSA-N 1 1 416.259 3.065 20 0 HGADMO CC(C)[N@@H+]1[C@@H]2CCN(c3ccc(-c4ccncc4)nn3)C[C@H]2C[C@H]1Cn1cccn1 ZINC001164835909 720622625 /nfs/dbraw/zinc/62/26/25/720622625.db2.gz CQQWTSJKKVGWQT-RZUBCFFCSA-N 1 1 403.534 3.113 20 0 HGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@@H]2CN(c3ccc(-c4ccncc4)nn3)CC[C@@H]21 ZINC001164835910 720622784 /nfs/dbraw/zinc/62/27/84/720622784.db2.gz CQQWTSJKKVGWQT-URVUXULASA-N 1 1 403.534 3.113 20 0 HGADMO FC(F)(c1cc(Cl)cnc1Cl)N1CC[N@@H+]2C[C@H](Oc3cncnc3)C[C@H]2C1 ZINC001164746898 720627041 /nfs/dbraw/zinc/62/70/41/720627041.db2.gz YOOWIBOTUQCTJH-QWHCGFSZSA-N 1 1 416.259 3.065 20 0 HGADMO FC(F)(c1cc(Cl)cnc1Cl)N1CC[N@H+]2C[C@H](Oc3cncnc3)C[C@H]2C1 ZINC001164746898 720627045 /nfs/dbraw/zinc/62/70/45/720627045.db2.gz YOOWIBOTUQCTJH-QWHCGFSZSA-N 1 1 416.259 3.065 20 0 HGADMO CN(C)c1nc(Cl)cc(N2CCC3(C[C@@H]([N@@H+](C)Cc4ccccc4)CO3)CC2)n1 ZINC001164841032 720657064 /nfs/dbraw/zinc/65/70/64/720657064.db2.gz OSFLALJCWWYEKC-GOSISDBHSA-N 1 1 415.969 3.456 20 0 HGADMO C[N@@H+](Cc1ccccc1)[C@H]1COC2(C1)CCN(c1ncc(Cl)cc1C(N)=O)CC2 ZINC001164840420 720665867 /nfs/dbraw/zinc/66/58/67/720665867.db2.gz MHEXMFCJFADZIJ-GOSISDBHSA-N 1 1 414.937 3.094 20 0 HGADMO C[N@@H+](Cc1ccccc1)[C@H]1COC2(C1)CCN(c1ccc(Cl)c(C(N)=O)n1)CC2 ZINC001164838141 720666634 /nfs/dbraw/zinc/66/66/34/720666634.db2.gz GBGZJIFHZHDPJL-QGZVFWFLSA-N 1 1 414.937 3.094 20 0 HGADMO CCOC(=O)c1cc(C)nc(N2CCC3(C[C@@H]([N@@H+](C)Cc4ccccc4)CO3)CC2)n1 ZINC001164845353 720677641 /nfs/dbraw/zinc/67/76/41/720677641.db2.gz YPGLOLYEPPBGPJ-HXUWFJFHSA-N 1 1 424.545 3.222 20 0 HGADMO C[N@@H+](Cc1ccccc1)[C@H]1COC2(C1)CCN(c1[nH+][n-]c(Cl)c3ncnc1-3)CC2 ZINC001164844930 720699984 /nfs/dbraw/zinc/69/99/84/720699984.db2.gz WNDYVQKQUKPXPJ-MRXNPFEDSA-N 1 1 412.925 3.266 20 0 HGADMO C[N@H+](Cc1ccccc1)[C@@H]1COC2(C1)CCN(c1cccc(N3CCOCC3)n1)CC2 ZINC001164837031 720705602 /nfs/dbraw/zinc/70/56/02/720705602.db2.gz CXHBEIFVWQNXQY-QFIPXVFZSA-N 1 1 422.573 3.178 20 0 HGADMO C[N@@H+](Cc1ccccc1)[C@@H]1COC2(C1)CCN(c1cccc(N3CCOCC3)n1)CC2 ZINC001164837031 720705606 /nfs/dbraw/zinc/70/56/06/720705606.db2.gz CXHBEIFVWQNXQY-QFIPXVFZSA-N 1 1 422.573 3.178 20 0 HGADMO C[NH+]1CCC(Oc2ccnc(N3CC[C@H]4[C@H]3CCC(=O)N4c3ccccc3)c2)CC1 ZINC001164843743 720768343 /nfs/dbraw/zinc/76/83/43/720768343.db2.gz AMUSWLRVGPTLNI-YADHBBJMSA-N 1 1 406.530 3.329 20 0 HGADMO CC[C@H](C)c1nc(Cl)c(C)c(N2CC[N@H+]3C[C@H](Oc4cncnc4)C[C@@H]3C2)n1 ZINC001164745963 720800851 /nfs/dbraw/zinc/80/08/51/720800851.db2.gz KZVKQMIKWFTOPT-NUEKZKHPSA-N 1 1 402.930 3.084 20 0 HGADMO FC(F)(Sc1ccc(Cl)nc1)N1CC[N@@H+]2C[C@@H](Oc3cncnc3)C[C@@H]2C1 ZINC001164748341 720803800 /nfs/dbraw/zinc/80/38/00/720803800.db2.gz QTOKFSAMLVLWKP-OLZOCXBDSA-N 1 1 413.881 3.005 20 0 HGADMO FC(F)(Sc1ccc(Cl)nc1)N1CC[N@H+]2C[C@@H](Oc3cncnc3)C[C@@H]2C1 ZINC001164748341 720803803 /nfs/dbraw/zinc/80/38/03/720803803.db2.gz QTOKFSAMLVLWKP-OLZOCXBDSA-N 1 1 413.881 3.005 20 0 HGADMO CCC[N@H+]1CCCC[C@@H]1c1ccc(N2C[C@H](NC(=O)C3CCC3)[C@@H]3COC[C@H]32)nc1 ZINC001164849744 720804569 /nfs/dbraw/zinc/80/45/69/720804569.db2.gz SSTGNCBMFMUOFY-FNAHDJPLSA-N 1 1 412.578 3.139 20 0 HGADMO FC(F)(c1cccc(Cl)n1)N1CC[C@@H]2[C@@H](C[C@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164745420 720810308 /nfs/dbraw/zinc/81/03/08/720810308.db2.gz KHRDDZWVJNFEQV-GVDBMIGSSA-N 1 1 422.911 3.251 20 0 HGADMO Clc1ccnc2c1ccnc2N1CC[C@@H]2[C@H](C[C@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164738784 720815711 /nfs/dbraw/zinc/81/57/11/720815711.db2.gz GLOIGAXYFNIEFE-MBOZVWFJSA-N 1 1 423.952 3.254 20 0 HGADMO Clc1cccc2ncc(N3CC[C@@H]4[C@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)nc12 ZINC001164738356 720817956 /nfs/dbraw/zinc/81/79/56/720817956.db2.gz DYXVBISEDQOITJ-MBOZVWFJSA-N 1 1 423.952 3.254 20 0 HGADMO Clc1cc2ccnc(N3CC[C@@H]4[C@@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)c2cn1 ZINC001164738449 720821512 /nfs/dbraw/zinc/82/15/12/720821512.db2.gz FWHHSZVUHFEUTJ-NLWGTHIKSA-N 1 1 423.952 3.254 20 0 HGADMO Clc1ccc2c(cnnc2N2CC[C@@H]3[C@H](C[C@H](Cn4cncn4)[N@H+]3CC3CC3)C2)c1 ZINC001164741865 720831539 /nfs/dbraw/zinc/83/15/39/720831539.db2.gz OQFGWBITVVCIGH-YFVAEKQCSA-N 1 1 423.952 3.254 20 0 HGADMO c1csc(-c2ccc(N3CC[C@@H]4[C@@H](C[C@@H](Cn5cncn5)[N@@H+]4CC4CC4)C3)nn2)c1 ZINC001164751122 720836337 /nfs/dbraw/zinc/83/63/37/720836337.db2.gz YNPRRLRFRVPDRM-CMKODMSKSA-N 1 1 421.574 3.176 20 0 HGADMO Cc1cc(Cl)c(C)nc1N1CC[C@@H]2[C@@H](C[C@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164744505 720837536 /nfs/dbraw/zinc/83/75/36/720837536.db2.gz KJRAUTGZENXLSR-NLWGTHIKSA-N 1 1 400.958 3.323 20 0 HGADMO COCC[N@H+]1CCO[C@@H]2CN(C(F)(F)c3ccnc(Cl)c3Cl)CC[C@@H]2C1 ZINC001164857880 720837618 /nfs/dbraw/zinc/83/76/18/720837618.db2.gz YVJWFXHGRDUPGC-TZMCWYRMSA-N 1 1 410.292 3.107 20 0 HGADMO COc1ccc2cnc(N3CC[C@@H]4[C@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)cc2c1 ZINC001164741901 720839444 /nfs/dbraw/zinc/83/94/44/720839444.db2.gz FVJMECHVQATDTJ-MQSCRBSSSA-N 1 1 418.545 3.214 20 0 HGADMO c1ncn(C[C@@H]2C[C@@H]3CN(c4cc(-c5ccccc5)ncn4)CC[C@H]3[N@H+]2CC2CC2)n1 ZINC001164748948 720845751 /nfs/dbraw/zinc/84/57/51/720845751.db2.gz VERXEFRJKQKEDI-FUPPJEDESA-N 1 1 415.545 3.115 20 0 HGADMO Fc1ccc2ccc(N3CC[C@@H]4[C@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)nc2c1 ZINC001164745877 720848871 /nfs/dbraw/zinc/84/88/71/720848871.db2.gz OBNFQEKOZCUUIH-SYYKKAFVSA-N 1 1 406.509 3.345 20 0 HGADMO Clc1cnc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COCc2cccnc2)nc1 ZINC001164750144 720868313 /nfs/dbraw/zinc/86/83/13/720868313.db2.gz JAXBGGZCTGEYNL-KNQAVFIVSA-N 1 1 413.953 3.280 20 0 HGADMO Clc1ncncc1N1CC[C@]2(C1)C[N@@H+](CC1CC1)C[C@H]2COCc1cccnc1 ZINC001164754348 720876300 /nfs/dbraw/zinc/87/63/00/720876300.db2.gz RHXOTWCXDZWCQV-SIKLNZKXSA-N 1 1 413.953 3.280 20 0 HGADMO Clc1ccc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COCc2cccnc2)nn1 ZINC001164751575 720876351 /nfs/dbraw/zinc/87/63/51/720876351.db2.gz LBKCDQONUICTFU-KNQAVFIVSA-N 1 1 413.953 3.280 20 0 HGADMO Cc1ncnc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COCc2cccnc2)c1C ZINC001164755725 720884330 /nfs/dbraw/zinc/88/43/30/720884330.db2.gz NFCDOYZNSFLEGY-UPVQGACJSA-N 1 1 407.562 3.244 20 0 HGADMO Cc1nc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COCc2cccnc2)ncc1F ZINC001164755057 720886983 /nfs/dbraw/zinc/88/69/83/720886983.db2.gz KMRNXVYJBRGGFU-NFBKMPQASA-N 1 1 411.525 3.074 20 0 HGADMO CCc1ccc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COCc2cccnc2)nn1 ZINC001164758436 720897799 /nfs/dbraw/zinc/89/77/99/720897799.db2.gz YCEWLAWMHUCHBN-URXFXBBRSA-N 1 1 407.562 3.189 20 0 HGADMO CC(C)[N@@H+](C)Cc1cnc2n1CCN(c1nc(-c3ccccc3)nc(N(C)C)n1)[C@H]2C ZINC001164860567 720974294 /nfs/dbraw/zinc/97/42/94/720974294.db2.gz OTFKXDOVQZBQPW-KRWDZBQOSA-N 1 1 420.565 3.223 20 0 HGADMO Clc1c[nH]c2nc(Cl)nc(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@H]4C3)c12 ZINC001164871528 721044558 /nfs/dbraw/zinc/04/45/58/721044558.db2.gz ZNHJQRMKZQDGPN-KBPBESRZSA-N 1 1 419.316 3.139 20 0 HGADMO FC(F)(Oc1ccc(Cl)nc1)N1CC[N@H+]2C[C@@H](OCc3cccnc3)C[C@H]2C1 ZINC001164865865 721069527 /nfs/dbraw/zinc/06/95/27/721069527.db2.gz AUDRZTGCGYQQFK-RDJZCZTQSA-N 1 1 410.852 3.034 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(C(F)(F)c4nc(Cl)cc(Cl)n4)C[C@H]3C2)cn1 ZINC001164772558 721083461 /nfs/dbraw/zinc/08/34/61/721083461.db2.gz VCNLQXKXBDQCTE-CHWSQXEVSA-N 1 1 417.291 3.020 20 0 HGADMO CSc1nc2ccsc2c(N2C[C@H]3CC[N@@H+](Cc4cnn(C)c4)C[C@@H]3C2)n1 ZINC001164771728 721117774 /nfs/dbraw/zinc/11/77/74/721117774.db2.gz SSZWUZJCJPWYTM-HUUCEWRRSA-N 1 1 400.577 3.105 20 0 HGADMO Cc1cccc2nc(Cl)nc(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@@H]4C3)c12 ZINC001164866630 721119380 /nfs/dbraw/zinc/11/93/80/721119380.db2.gz UHQLXNZVJXZOKX-MSOLQXFVSA-N 1 1 409.921 3.466 20 0 HGADMO Cc1nc2c3ccccc3oc2c(N2C[C@H]3CC[N@H+](Cc4cnn(C)c4)C[C@@H]3C2)n1 ZINC001164771379 721162704 /nfs/dbraw/zinc/16/27/04/721162704.db2.gz SLQNHJRHBIMIBU-QZTJIDSGSA-N 1 1 402.502 3.376 20 0 HGADMO Fc1cccc(F)c1-c1ccc(N2CC[N@H+]3C[C@@H](OCc4cccnc4)C[C@@H]3C2)nn1 ZINC001164879050 721163675 /nfs/dbraw/zinc/16/36/75/721163675.db2.gz ROTJYRKVKMHVOY-MSOLQXFVSA-N 1 1 423.467 3.297 20 0 HGADMO Cc1nc(-c2ccncc2)nc(N2CC[N@H+]3C[C@@H](OCc4cccnc4)C[C@@H]3C2)c1C ZINC001164872536 721167042 /nfs/dbraw/zinc/16/70/42/721167042.db2.gz HJYLABLMZMHGHP-YADHBBJMSA-N 1 1 416.529 3.030 20 0 HGADMO Cc1nc(C)c(-c2ccc(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@H]4C3)nn2)s1 ZINC001164873548 721173465 /nfs/dbraw/zinc/17/34/65/721173465.db2.gz IOYDERMBNDBGML-OALUTQOASA-N 1 1 422.558 3.092 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(C(F)(F)c4cc5cc[nH]c5c(Cl)n4)C[C@H]3C2)cn1 ZINC001164762673 721181048 /nfs/dbraw/zinc/18/10/48/721181048.db2.gz DDCWLNDHBACGHT-JKSUJKDBSA-N 1 1 420.895 3.453 20 0 HGADMO COc1cc2ccnc(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@@H]4C3)c2cc1F ZINC001164877581 721184983 /nfs/dbraw/zinc/18/49/83/721184983.db2.gz OUCKOVXRWJXJDC-MOPGFXCFSA-N 1 1 408.477 3.257 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4ccc(NC(=O)OC(C)(C)C)cn4)C[C@@H]3C2)cn1 ZINC001164764172 721187640 /nfs/dbraw/zinc/18/76/40/721187640.db2.gz GKIBLLILJOKEKK-ROUUACIJSA-N 1 1 412.538 3.120 20 0 HGADMO Cc1c(Cl)nc(C(C)(C)C)nc1N1C[C@H]2CC[N@H+](Cc3cnn(C)c3)C[C@@H]2C1 ZINC001164774440 721193738 /nfs/dbraw/zinc/19/37/38/721193738.db2.gz ZEUQAYBXZCTTAR-IAGOWNOFSA-N 1 1 402.974 3.428 20 0 HGADMO CCc1nc2sc3c(c2c(N2C[C@@H]4CC[N@@H+](Cc5cnn(C)c5)C[C@H]4C2)n1)CCC3 ZINC001164771828 721194383 /nfs/dbraw/zinc/19/43/83/721194383.db2.gz RBLDZVNIWIFQHO-IRXDYDNUSA-N 1 1 422.602 3.434 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(C(F)(F)c4cc(C5CC5)nnc4Cl)C[C@H]3C2)cn1 ZINC001164762004 721205844 /nfs/dbraw/zinc/20/58/44/721205844.db2.gz BQWVQWOHWRAKAZ-HZPDHXFCSA-N 1 1 422.911 3.244 20 0 HGADMO CCc1ccc(-c2ccc(N3C[C@@H]4C[N@H+](Cc5cnn(C)c5)CC[C@@H]4C3)nn2)cc1 ZINC001164769552 721216002 /nfs/dbraw/zinc/21/60/02/721216002.db2.gz MSZMVIRSZKXETF-YADHBBJMSA-N 1 1 402.546 3.398 20 0 HGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@]2(CCCN(c3ncc(Cl)c(C)n3)C2)C1 ZINC001164779788 721341108 /nfs/dbraw/zinc/34/11/08/721341108.db2.gz WMWJDUHVZBCYLC-HXUWFJFHSA-N 1 1 405.930 3.162 20 0 HGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@]2(CCCN(c3ncc(Cl)c(C)n3)C2)C1 ZINC001164779788 721341111 /nfs/dbraw/zinc/34/11/11/721341111.db2.gz WMWJDUHVZBCYLC-HXUWFJFHSA-N 1 1 405.930 3.162 20 0 HGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@]2(CCCN(c3ncc(N)cc3Cl)C2)C1 ZINC001164778229 721351424 /nfs/dbraw/zinc/35/14/24/721351424.db2.gz LOGVWIOADSCGSB-HXUWFJFHSA-N 1 1 405.930 3.041 20 0 HGADMO COc1ccc(Cl)c(N2CCC[C@@]3(C2)COCC[N@H+](Cc2c(C)noc2C)C3)n1 ZINC001164776725 721351726 /nfs/dbraw/zinc/35/17/26/721351726.db2.gz CEMLPIOFVNTVHN-OAQYLSRUSA-N 1 1 420.941 3.467 20 0 HGADMO COc1ccc(Cl)c(N2CCC[C@@]3(C2)COCC[N@@H+](Cc2c(C)noc2C)C3)n1 ZINC001164776725 721351730 /nfs/dbraw/zinc/35/17/30/721351730.db2.gz CEMLPIOFVNTVHN-OAQYLSRUSA-N 1 1 420.941 3.467 20 0 HGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@@]2(CCCN(c3ncc(Cl)cc3N)C2)C1 ZINC001164787057 721364616 /nfs/dbraw/zinc/36/46/16/721364616.db2.gz XXHDULXPCCADNT-FQEVSTJZSA-N 1 1 405.930 3.041 20 0 HGADMO C[NH+]1CCN(C[C@@H]2CCC[C@]3(CCN(C(F)(F)c4cccc(Cl)n4)C3)O2)CC1 ZINC001164894577 721382669 /nfs/dbraw/zinc/38/26/69/721382669.db2.gz ZDFRDEBACHWHNJ-QFBILLFUSA-N 1 1 414.928 3.045 20 0 HGADMO C[NH+]1CCN(C[C@H]2CCC[C@]3(CCN(c4nccc(Oc5ccccc5)n4)C3)O2)CC1 ZINC001164884313 721396492 /nfs/dbraw/zinc/39/64/92/721396492.db2.gz AAKPIFLSEWYCTQ-ZJSXRUAMSA-N 1 1 423.561 3.034 20 0 HGADMO C[NH+]1CCN(C[C@H]2CCC[C@@]3(CCN(c4cnc5cc(Cl)ccc5n4)C3)O2)CC1 ZINC001164883508 721403326 /nfs/dbraw/zinc/40/33/26/721403326.db2.gz AHMPDAYZXPAVBO-GCJKJVERSA-N 1 1 415.969 3.049 20 0 HGADMO COc1ccc2nc(N3C[C@H]4C[NH+](Cc5nccs5)C[C@@H]4C3)c(Cl)nc2c1 ZINC001164784357 721405563 /nfs/dbraw/zinc/40/55/63/721405563.db2.gz JSXZEQCKOMQNEI-CHWSQXEVSA-N 1 1 401.923 3.317 20 0 HGADMO C[NH+]1CCN(C[C@H]2CCC[C@]3(CCN(c4cc5nccc(Cl)c5cn4)C3)O2)CC1 ZINC001164884728 721407905 /nfs/dbraw/zinc/40/79/05/721407905.db2.gz FKPSHCKCDXSNSF-VGOFRKELSA-N 1 1 415.969 3.049 20 0 HGADMO CCOC(=O)c1cc(N2C[C@H]3C[NH+](Cc4nccs4)C[C@@H]3C2)nc2ccccc21 ZINC001164785459 721408801 /nfs/dbraw/zinc/40/88/01/721408801.db2.gz MJPDKIKVQNWJDQ-HZPDHXFCSA-N 1 1 408.527 3.436 20 0 HGADMO COc1ccc2nc(Cl)cc(N3C[C@@H]4C[N@@H+](Cc5nccs5)C[C@@H]4C3)c2n1 ZINC001164788987 721412397 /nfs/dbraw/zinc/41/23/97/721412397.db2.gz UBRFMWWMHDWGEB-BETUJISGSA-N 1 1 401.923 3.317 20 0 HGADMO COc1ccc2nc(Cl)cc(N3C[C@@H]4C[N@H+](Cc5nccs5)C[C@@H]4C3)c2n1 ZINC001164788987 721412398 /nfs/dbraw/zinc/41/23/98/721412398.db2.gz UBRFMWWMHDWGEB-BETUJISGSA-N 1 1 401.923 3.317 20 0 HGADMO CCN(CC)C(=O)c1cc(Cl)nc(N2C[C@@H]3C[NH+](Cc4nccs4)C[C@H]3C2)c1 ZINC001164781800 721414074 /nfs/dbraw/zinc/41/40/74/721414074.db2.gz FFVJCSHQHNXNIU-HOTGVXAUSA-N 1 1 419.982 3.242 20 0 HGADMO Cc1c[nH]c2nc(Cl)cc(N3CC[C@@]4(C3)CCC[C@@H](CN3CC[NH+](C)CC3)O4)c12 ZINC001164896733 721431912 /nfs/dbraw/zinc/43/19/12/721431912.db2.gz RXABZOJGSYYLLE-HTAPYJJXSA-N 1 1 417.985 3.290 20 0 HGADMO Cc1c(Cl)nc(C(C)C)nc1N1CC[C@]2(C1)CCC[C@@H](CN1CC[NH+](C)CC1)O2 ZINC001164895444 721446484 /nfs/dbraw/zinc/44/64/84/721446484.db2.gz PDQNQWWFSUPLBI-AVRDEDQJSA-N 1 1 422.017 3.327 20 0 HGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1ccc(C(C)C)nn1)CC2 ZINC001164789211 721456097 /nfs/dbraw/zinc/45/60/97/721456097.db2.gz VTJNOWACMILYJE-HXUWFJFHSA-N 1 1 402.583 3.334 20 0 HGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1c(C)nc(C)nc1Cl)CC2 ZINC001164783579 721457936 /nfs/dbraw/zinc/45/79/36/721457936.db2.gz DMKGTIOVYDPKMG-LJQANCHMSA-N 1 1 423.001 3.481 20 0 HGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1nc(OC)ccc1Cl)CC2 ZINC001164789891 721460554 /nfs/dbraw/zinc/46/05/54/721460554.db2.gz YDVUKFCMSYUGEH-SFHVURJKSA-N 1 1 423.985 3.478 20 0 HGADMO CC(C)C(=O)N1CC[C@@H]2CN(c3ncnc4c3CC[N@H+](Cc3ccccc3)C4)CC[C@@H]21 ZINC001164895115 721463891 /nfs/dbraw/zinc/46/38/91/721463891.db2.gz ZLLPWMAGLVBHAH-OFNKIYASSA-N 1 1 419.573 3.118 20 0 HGADMO CC(C)C(=O)N1CC[C@@H]2CN(c3ncnc4c3CC[N@@H+](Cc3ccccc3)C4)CC[C@@H]21 ZINC001164895115 721463893 /nfs/dbraw/zinc/46/38/93/721463893.db2.gz ZLLPWMAGLVBHAH-OFNKIYASSA-N 1 1 419.573 3.118 20 0 HGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1nccc(C(F)F)n1)CC2 ZINC001164789968 721464447 /nfs/dbraw/zinc/46/44/47/721464447.db2.gz YTRXOOPGFOSUSM-QGZVFWFLSA-N 1 1 410.509 3.148 20 0 HGADMO CCOc1cccnc1N1CCC2(C[C@@H](COCC3CC3)[N@@H+](CCOC)C2)CC1 ZINC001164791653 721470723 /nfs/dbraw/zinc/47/07/23/721470723.db2.gz XIDRROUAESMBGR-FQEVSTJZSA-N 1 1 403.567 3.214 20 0 HGADMO CC(C)OC(=O)c1ccc(N2CCC3(CC([N@@H+](C)Cc4ccncc4)C3)CC2)nn1 ZINC001164793181 721492200 /nfs/dbraw/zinc/49/22/00/721492200.db2.gz OYOBGUMFJWUUOL-UHFFFAOYSA-N 1 1 409.534 3.318 20 0 HGADMO C[C@H]1CC(=O)Nc2ncnc(N3CCC4(CC([N@@H+](C)Cc5ccncc5)C4)CC3)c21 ZINC001164792205 721496124 /nfs/dbraw/zinc/49/61/24/721496124.db2.gz KGYMAPLBAKDIND-INIZCTEOSA-N 1 1 406.534 3.198 20 0 HGADMO Cn1c(=O)ccc2ccc(N3CCC4(CC([N@@H+](C)Cc5ccncc5)C4)CC3)nc21 ZINC001164792253 721496156 /nfs/dbraw/zinc/49/61/56/721496156.db2.gz LSWZIHWFHWPJDM-UHFFFAOYSA-N 1 1 403.530 3.210 20 0 HGADMO CCOC(=O)c1cnc(CC)nc1N1CCC2(CC([N@@H+](C)Cc3ccncc3)C2)CC1 ZINC001164794986 721503319 /nfs/dbraw/zinc/50/33/19/721503319.db2.gz GUQZMKQYPMKAKW-UHFFFAOYSA-N 1 1 423.561 3.492 20 0 HGADMO Fc1c[nH]c2nc(Cl)nc(N3CC[N@H+]4C[C@@H](Oc5cccc(F)c5)C[C@H]4C3)c12 ZINC001164896895 721510008 /nfs/dbraw/zinc/51/00/08/721510008.db2.gz CAXBLMZKZXVFDN-JSGCOSHPSA-N 1 1 405.836 3.231 20 0 HGADMO COC(=O)c1cc(N2CC[N@H+]3C[C@H](Oc4cccc(F)c4)C[C@H]3C2)ncc1Cl ZINC001164899598 721514340 /nfs/dbraw/zinc/51/43/40/721514340.db2.gz LGINNCUIZATLDO-GOEBONIOSA-N 1 1 405.857 3.003 20 0 HGADMO COC(=O)c1cc(Cl)cc(N2CC[N@H+]3C[C@H](Oc4cccc(F)c4)C[C@H]3C2)n1 ZINC001164901424 721520838 /nfs/dbraw/zinc/52/08/38/721520838.db2.gz XEWUYJGOTCXPSQ-DOTOQJQBSA-N 1 1 405.857 3.003 20 0 HGADMO Cc1c[nH]c2nc(Cl)nc(N3CC[N@H+]4C[C@H](Oc5cccc(F)c5)C[C@@H]4C3)c12 ZINC001164899052 721525683 /nfs/dbraw/zinc/52/56/83/721525683.db2.gz JUFHBKIZBBVVMG-GDBMZVCRSA-N 1 1 401.873 3.401 20 0 HGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(C(F)(F)Oc2cccnc2Cl)[C@H]2CCCO[C@@H]12 ZINC001164801350 721539591 /nfs/dbraw/zinc/53/95/91/721539591.db2.gz DZDUYKMNXFPENZ-LZLYRXPVSA-N 1 1 424.879 3.423 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(C(F)(F)Oc2cccnc2Cl)[C@H]2CCCO[C@@H]12 ZINC001164801350 721539597 /nfs/dbraw/zinc/53/95/97/721539597.db2.gz DZDUYKMNXFPENZ-LZLYRXPVSA-N 1 1 424.879 3.423 20 0 HGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN([C@H](F)Oc2ccnc(Cl)c2)[C@H]2CCCO[C@@H]12 ZINC001164802510 721541404 /nfs/dbraw/zinc/54/14/04/721541404.db2.gz GNQNAMAOEDWZDB-CUDHKJQZSA-N 1 1 406.889 3.126 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN([C@H](F)Oc2ccnc(Cl)c2)[C@H]2CCCO[C@@H]12 ZINC001164802510 721541406 /nfs/dbraw/zinc/54/14/06/721541406.db2.gz GNQNAMAOEDWZDB-CUDHKJQZSA-N 1 1 406.889 3.126 20 0 HGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN([C@H](F)Oc2ccnc(Cl)c2)[C@@H]2CCCO[C@@H]12 ZINC001164802515 721541586 /nfs/dbraw/zinc/54/15/86/721541586.db2.gz GNQNAMAOEDWZDB-LFGUQSLTSA-N 1 1 406.889 3.126 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN([C@H](F)Oc2ccnc(Cl)c2)[C@@H]2CCCO[C@@H]12 ZINC001164802515 721541590 /nfs/dbraw/zinc/54/15/90/721541590.db2.gz GNQNAMAOEDWZDB-LFGUQSLTSA-N 1 1 406.889 3.126 20 0 HGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2nc(Cl)nc3c2SCC3)[C@H]2CCCO[C@H]12 ZINC001164807245 721546072 /nfs/dbraw/zinc/54/60/72/721546072.db2.gz QVYNOSFFBRVFOA-BBWFWOEESA-N 1 1 417.966 3.041 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2nc(Cl)nc3c2SCC3)[C@H]2CCCO[C@H]12 ZINC001164807245 721546075 /nfs/dbraw/zinc/54/60/75/721546075.db2.gz QVYNOSFFBRVFOA-BBWFWOEESA-N 1 1 417.966 3.041 20 0 HGADMO COC(OC)c1cc(C)cnc1N1CC[N@H+]2C[C@@H](Oc3cccc(F)c3)C[C@H]2C1 ZINC001164909722 721547348 /nfs/dbraw/zinc/54/73/48/721547348.db2.gz RRSGMUHIOBEANX-HKUYNNGSSA-N 1 1 401.482 3.162 20 0 HGADMO CSc1cnc(Cl)nc1N1C[C@H]([N@H+](C)Cc2cccnc2)[C@@H]2OCCC[C@H]21 ZINC001164798646 721558395 /nfs/dbraw/zinc/55/83/95/721558395.db2.gz BUOOSSARRHICER-HLLBOEOZSA-N 1 1 405.955 3.115 20 0 HGADMO CSc1cnc(Cl)nc1N1C[C@H]([N@@H+](C)Cc2cccnc2)[C@@H]2OCCC[C@H]21 ZINC001164798646 721558397 /nfs/dbraw/zinc/55/83/97/721558397.db2.gz BUOOSSARRHICER-HLLBOEOZSA-N 1 1 405.955 3.115 20 0 HGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2ccc(-c3cccs3)nn2)[C@H]2CCCO[C@@H]12 ZINC001164806695 721564760 /nfs/dbraw/zinc/56/47/60/721564760.db2.gz QXDZMTAUYGPURO-NNMXDRDESA-N 1 1 407.543 3.468 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2ccc(-c3cccs3)nn2)[C@H]2CCCO[C@@H]12 ZINC001164806695 721564766 /nfs/dbraw/zinc/56/47/66/721564766.db2.gz QXDZMTAUYGPURO-NNMXDRDESA-N 1 1 407.543 3.468 20 0 HGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2ncnc3sc4c(c32)CCC4)[C@H]2CCCO[C@H]12 ZINC001164798573 721576299 /nfs/dbraw/zinc/57/62/99/721576299.db2.gz BLMZCXOITRYDOC-UEXGIBASSA-N 1 1 421.570 3.443 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2ncnc3sc4c(c32)CCC4)[C@H]2CCCO[C@H]12 ZINC001164798573 721576303 /nfs/dbraw/zinc/57/63/03/721576303.db2.gz BLMZCXOITRYDOC-UEXGIBASSA-N 1 1 421.570 3.443 20 0 HGADMO CCOC(=O)c1ccc(N2CCC(F)(F)[C@@]3(CC[N@@H+](Cc4ccccn4)C3)C2)nc1 ZINC001164902205 721584416 /nfs/dbraw/zinc/58/44/16/721584416.db2.gz CVCXISNJNKNBOI-OAQYLSRUSA-N 1 1 416.472 3.391 20 0 HGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(C(F)(F)Oc2ccnc(Cl)c2)[C@@H]2CCCO[C@@H]12 ZINC001164805113 721588965 /nfs/dbraw/zinc/58/89/65/721588965.db2.gz KRERYWRDCDSFDT-ZHALLVOQSA-N 1 1 424.879 3.423 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(C(F)(F)Oc2ccnc(Cl)c2)[C@@H]2CCCO[C@@H]12 ZINC001164805113 721588967 /nfs/dbraw/zinc/58/89/67/721588967.db2.gz KRERYWRDCDSFDT-ZHALLVOQSA-N 1 1 424.879 3.423 20 0 HGADMO Cc1nc(N(C)C)nc2c1COC[C@]21CC[N@H+](C(C)(C)c2ccnc(Cl)c2)C1 ZINC001164801229 721606855 /nfs/dbraw/zinc/60/68/55/721606855.db2.gz GEKFILYMUONVIA-OAQYLSRUSA-N 1 1 401.942 3.308 20 0 HGADMO CC(C)N(C)Cc1nnc2n1CCCN(c1nc(Cl)ccc1C[NH+]1CCCC1)C2 ZINC001165011840 721706227 /nfs/dbraw/zinc/70/62/27/721706227.db2.gz ZJKLZFAHQKYIMQ-UHFFFAOYSA-N 1 1 417.989 3.173 20 0 HGADMO FC1(F)CCN(c2[nH+][n-]c(Cl)c3ncnc2-3)C[C@@]12CC[N@@H+](Cc1ccccn1)C2 ZINC001164908091 721713071 /nfs/dbraw/zinc/71/30/71/721713071.db2.gz VOBLOVOIFPKAQX-SFHVURJKSA-N 1 1 419.867 3.139 20 0 HGADMO CN(C)C(=O)C[NH+]1CCC2(CCCN2C(F)(F)c2cc(Cl)cnc2Cl)CC1 ZINC001165007992 721730994 /nfs/dbraw/zinc/73/09/94/721730994.db2.gz IJNXBLVDKPWETC-UHFFFAOYSA-N 1 1 421.319 3.456 20 0 HGADMO COC(=O)c1cc(F)c(C)nc1N1CCc2c(C[N@H+](C)Cc3ccco3)cncc2C1 ZINC001164908979 721754416 /nfs/dbraw/zinc/75/44/16/721754416.db2.gz AYUAETCSWMDUBW-UHFFFAOYSA-N 1 1 424.476 3.498 20 0 HGADMO COC(=O)c1cc(F)c(C)nc1N1CCc2c(C[N@@H+](C)Cc3ccco3)cncc2C1 ZINC001164908979 721754421 /nfs/dbraw/zinc/75/44/21/721754421.db2.gz AYUAETCSWMDUBW-UHFFFAOYSA-N 1 1 424.476 3.498 20 0 HGADMO COc1nc(N2CCc3c(C[N@H+](C)Cc4ccco4)cncc3C2)nc2c1ccn2C ZINC001164910845 721765843 /nfs/dbraw/zinc/76/58/43/721765843.db2.gz LPQHKOYKIRBOSU-UHFFFAOYSA-N 1 1 418.501 3.160 20 0 HGADMO COc1nc(N2CCc3c(C[N@@H+](C)Cc4ccco4)cncc3C2)nc2c1ccn2C ZINC001164910845 721765845 /nfs/dbraw/zinc/76/58/45/721765845.db2.gz LPQHKOYKIRBOSU-UHFFFAOYSA-N 1 1 418.501 3.160 20 0 HGADMO C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@H]2CN(c3ncccc3C(=O)N3CCCC3)C[C@@H]21 ZINC001165020562 721799317 /nfs/dbraw/zinc/79/93/17/721799317.db2.gz FZZDLOIARUMISI-AJSBUHFISA-N 1 1 419.573 3.450 20 0 HGADMO C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@H]2CN(c3nc(Cl)c(F)cc3C(N)=O)C[C@@H]21 ZINC001165018703 721806443 /nfs/dbraw/zinc/80/64/43/721806443.db2.gz BYBKQXWCAYJMSV-QANKJYHBSA-N 1 1 417.916 3.105 20 0 HGADMO CCOC(=O)c1cc(C)nc(N2C[C@@H]3CCC[C@H]([N@@H+](C)Cc4ccccn4)[C@@H]3C2)n1 ZINC001165023407 721807027 /nfs/dbraw/zinc/80/70/27/721807027.db2.gz JSWIZNUVYXTZCE-DSKINZAPSA-N 1 1 409.534 3.094 20 0 HGADMO COC(=O)c1c[nH]c2nc(N3C[C@@H]4CCC[C@@H]([N@@H+](C)Cc5ccccn5)[C@H]4C3)ccc12 ZINC001165024718 721807142 /nfs/dbraw/zinc/80/71/42/721807142.db2.gz MRKCSQADHSSDJS-ORYQWCPZSA-N 1 1 419.529 3.481 20 0 HGADMO COC(=O)c1c[nH]c2nc(N3C[C@@H]4CCC[C@H]([N@@H+](C)Cc5ccccn5)[C@H]4C3)ccc12 ZINC001165024712 721807146 /nfs/dbraw/zinc/80/71/46/721807146.db2.gz MRKCSQADHSSDJS-NDXORKPFSA-N 1 1 419.529 3.481 20 0 HGADMO COCc1cc(N2C[C@@H]3CCC[C@H]([N@@H+](C)Cc4ccccn4)[C@@H]3C2)nc(SC)n1 ZINC001165026880 721811287 /nfs/dbraw/zinc/81/12/87/721811287.db2.gz SAPWQBJMRKXYIV-DBVUQKKJSA-N 1 1 413.591 3.477 20 0 HGADMO CCOC(=O)c1ncnc(N2C[C@@H]3CCC[C@H]([N@@H+](C)Cc4ccccn4)[C@H]3C2)c1C ZINC001165023607 721815090 /nfs/dbraw/zinc/81/50/90/721815090.db2.gz IJXVQSQFSBSZSE-IHPCNDPISA-N 1 1 409.534 3.094 20 0 HGADMO Cc1cnc2n1CCN(C)C21CCN(c2[nH+]cnc3c2ccn3C2CCCC2)CC1 ZINC001164916472 721816282 /nfs/dbraw/zinc/81/62/82/721816282.db2.gz FDWIHHYVKYICGX-UHFFFAOYSA-N 1 1 405.550 3.492 20 0 HGADMO COc1nc(N2C[C@@H]3CCC[C@@H]([N@@H+](C)Cc4ccccn4)[C@H]3C2)nc2c1ccn2C ZINC001165027004 721830559 /nfs/dbraw/zinc/83/05/59/721830559.db2.gz QSMONAAGPFMQMG-FFZOFVMBSA-N 1 1 406.534 3.109 20 0 HGADMO Cc1nc(CN2CCOC[C@]3(CN(c4[nH+]ccc5cccc(C)c54)CCO3)C2)cs1 ZINC001164921245 721833297 /nfs/dbraw/zinc/83/32/97/721833297.db2.gz CSVVNFBCBPLCCW-HSZRJFAPSA-N 1 1 424.570 3.416 20 0 HGADMO C[C@@H]1CCCCN1c1nc2ccccc2nc1N1CC[C@H]2[C@@H]1CC[N@@H+]2CCN(C)C ZINC001164936282 721878325 /nfs/dbraw/zinc/87/83/25/721878325.db2.gz ZDPGHOKKDAQHLU-COPCDDAFSA-N 1 1 408.594 3.223 20 0 HGADMO C[C@@H]1CCCCN1c1nc2ccccc2nc1N1CC[C@H]2[C@@H]1CC[N@H+]2CCN(C)C ZINC001164936282 721878328 /nfs/dbraw/zinc/87/83/28/721878328.db2.gz ZDPGHOKKDAQHLU-COPCDDAFSA-N 1 1 408.594 3.223 20 0 HGADMO Cc1ccccc1Oc1nc(Cl)ncc1N1CC[C@@H]2[C@@H]1CC[N@H+]2CCN(C)C ZINC001164934094 721888344 /nfs/dbraw/zinc/88/83/44/721888344.db2.gz PMFMTMDNKIYGFN-SJORKVTESA-N 1 1 401.942 3.445 20 0 HGADMO Cc1ccccc1Oc1nc(Cl)ncc1N1CC[C@@H]2[C@@H]1CC[N@@H+]2CCN(C)C ZINC001164934094 721888346 /nfs/dbraw/zinc/88/83/46/721888346.db2.gz PMFMTMDNKIYGFN-SJORKVTESA-N 1 1 401.942 3.445 20 0 HGADMO Cc1cccc(Oc2nc(Cl)ncc2N2CC[C@@H]3[C@H]2CC[N@H+]3CCN(C)C)c1 ZINC001164929610 721888356 /nfs/dbraw/zinc/88/83/56/721888356.db2.gz BXCVIGRQAAGXFF-QZTJIDSGSA-N 1 1 401.942 3.445 20 0 HGADMO Cc1cccc(Oc2nc(Cl)ncc2N2CC[C@@H]3[C@H]2CC[N@@H+]3CCN(C)C)c1 ZINC001164929610 721888357 /nfs/dbraw/zinc/88/83/57/721888357.db2.gz BXCVIGRQAAGXFF-QZTJIDSGSA-N 1 1 401.942 3.445 20 0 HGADMO COc1ccc(Oc2nc(Cl)ncc2N2CC[C@H]3[C@@H]2CC[N@@H+]3CCN(C)C)cc1 ZINC001164929646 721888745 /nfs/dbraw/zinc/88/87/45/721888745.db2.gz BXDWRBCPILXAAR-ROUUACIJSA-N 1 1 417.941 3.146 20 0 HGADMO COc1ccc(Oc2nc(Cl)ncc2N2CC[C@H]3[C@@H]2CC[N@H+]3CCN(C)C)cc1 ZINC001164929646 721888746 /nfs/dbraw/zinc/88/87/46/721888746.db2.gz BXDWRBCPILXAAR-ROUUACIJSA-N 1 1 417.941 3.146 20 0 HGADMO Cc1ccc(C[N@H+]2CCOC3(CCN(c4cc(Cl)nc(N(C)C)n4)CC3)C2)cc1 ZINC001164938340 721920090 /nfs/dbraw/zinc/92/00/90/721920090.db2.gz LRIHOIZNLPXJOG-UHFFFAOYSA-N 1 1 415.969 3.376 20 0 HGADMO CCCNC(=O)c1cccnc1N1CCC2(CC1)C[N@@H+](Cc1ccc(C)cc1)CCO2 ZINC001164939491 721930623 /nfs/dbraw/zinc/93/06/23/721930623.db2.gz LSBYOVHPOILCFS-UHFFFAOYSA-N 1 1 422.573 3.401 20 0 HGADMO Cc1ccc(CN2CCOC3(CCN(c4cc(-n5ccnc5)cc[nH+]4)CC3)C2)cc1 ZINC001164939411 721932532 /nfs/dbraw/zinc/93/25/32/721932532.db2.gz KKYUFBKWSKQIHP-UHFFFAOYSA-N 1 1 403.530 3.447 20 0 HGADMO COC[C@@]12COC[C@@H]1CN(c1nc(C[NH+]3CCCC3)nc3sc(C)c(C)c31)C2 ZINC001164953918 721995159 /nfs/dbraw/zinc/99/51/59/721995159.db2.gz SNDGJFBLNBAZOZ-KKSFZXQISA-N 1 1 402.564 3.003 20 0 HGADMO COc1ccc(Oc2cc(N3CC[NH+](CCc4ccccn4)CC3)nc(C)n2)cc1 ZINC001165055241 722019432 /nfs/dbraw/zinc/01/94/32/722019432.db2.gz NOEAJKZNLTXUOY-UHFFFAOYSA-N 1 1 405.502 3.346 20 0 HGADMO FC(F)(COc1cncc(Cl)n1)N1CCC2(CC[N@@H+](Cc3cccnc3)C2)CC1 ZINC001164956222 722022306 /nfs/dbraw/zinc/02/23/06/722022306.db2.gz YZVQJVCQEFIRKK-UHFFFAOYSA-N 1 1 423.895 3.485 20 0 HGADMO CCOC(=O)c1ccc(N2CCC3(CC2)COCC[N@@H+](Cc2ccncc2)C3)nc1C ZINC001164958722 722051848 /nfs/dbraw/zinc/05/18/48/722051848.db2.gz FXRLXLIPIBZDGG-UHFFFAOYSA-N 1 1 424.545 3.081 20 0 HGADMO CCOC(=O)c1cc(C)cnc1N1CCC2(CC1)COCC[N@@H+](Cc1ccncc1)C2 ZINC001164962360 722056223 /nfs/dbraw/zinc/05/62/23/722056223.db2.gz DGFYYHKXJWAIAB-UHFFFAOYSA-N 1 1 424.545 3.081 20 0 HGADMO F[C@@H](Oc1cccc(Cl)n1)N1CCC2(CC1)COCC[N@@H+](Cc1ccncc1)C2 ZINC001164962485 722056249 /nfs/dbraw/zinc/05/62/49/722056249.db2.gz DVPYBTRSZWNKRI-HXUWFJFHSA-N 1 1 420.916 3.377 20 0 HGADMO CCOC(=O)c1cc(N2CCC3(CC2)COCC[N@@H+](Cc2ccncc2)C3)ncc1C ZINC001164964023 722056947 /nfs/dbraw/zinc/05/69/47/722056947.db2.gz QXOLELXBOUFKLW-UHFFFAOYSA-N 1 1 424.545 3.081 20 0 HGADMO Fc1ccccc1Oc1nc(Cl)ncc1N1C[C@@H]2C[N@H+](CC3CC3)C[C@H](C1)O2 ZINC001164967880 722077578 /nfs/dbraw/zinc/07/75/78/722077578.db2.gz MERKSQJALFFPEU-GASCZTMLSA-N 1 1 404.873 3.361 20 0 HGADMO CC(=O)N1[C@@H]2CC[N@@H+](C(C)(C)c3ccnc(Cl)c3)C[C@@H]2C[C@H]1Cn1cccn1 ZINC001164970770 722081344 /nfs/dbraw/zinc/08/13/44/722081344.db2.gz RLUQSBMMLFKMLP-YTQUADARSA-N 1 1 401.942 3.178 20 0 HGADMO O=C(NC1CCC1)C1C[C@@H]2CN(c3nc(Cl)ccc3C[NH+]3CCCC3)C[C@H]2C1 ZINC001164976517 722085091 /nfs/dbraw/zinc/08/50/91/722085091.db2.gz VMKPXXLQIKBMRN-QZTJIDSGSA-N 1 1 402.970 3.462 20 0 HGADMO CC(C)(C)OC(=O)c1ccnc(N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)c1 ZINC001164986633 722104134 /nfs/dbraw/zinc/10/41/34/722104134.db2.gz ZQRFUTZOTRQEHF-RTWAWAEBSA-N 1 1 424.545 3.159 20 0 HGADMO FC(F)(Oc1cccnc1Cl)N1CC[C@H]2C[N@@H+](Cc3cccnc3)CCO[C@H]2C1 ZINC001164986652 722107146 /nfs/dbraw/zinc/10/71/46/722107146.db2.gz ZYSVZHBNYWUGSX-WMZOPIPTSA-N 1 1 424.879 3.282 20 0 HGADMO Clc1ccc2cc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)ncc2n1 ZINC001164979162 722122021 /nfs/dbraw/zinc/12/20/21/722122021.db2.gz PJXQEVRHFQIUAQ-AZUAARDMSA-N 1 1 409.921 3.406 20 0 HGADMO Clc1ccc2nc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)ncc2c1 ZINC001164978160 722122851 /nfs/dbraw/zinc/12/28/51/722122851.db2.gz NQRBQGKZUNNZGO-LAUBAEHRSA-N 1 1 409.921 3.406 20 0 HGADMO Cc1nc(C2CC2)nc(Cl)c1N1CC[C@@H]2C[N@@H+](Cc3cccnc3)CCO[C@@H]2C1 ZINC001164973140 722144504 /nfs/dbraw/zinc/14/45/04/722144504.db2.gz BAPRDOZEDRUVFW-RTBURBONSA-N 1 1 413.953 3.438 20 0 HGADMO Cc1nc(C2CC2)nc(Cl)c1N1CC[C@H]2C[N@@H+](Cc3cccnc3)CCO[C@H]2C1 ZINC001164973133 722144665 /nfs/dbraw/zinc/14/46/65/722144665.db2.gz BAPRDOZEDRUVFW-OALUTQOASA-N 1 1 413.953 3.438 20 0 HGADMO CSc1cc(N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)nc(SC)n1 ZINC001164974789 722156138 /nfs/dbraw/zinc/15/61/38/722156138.db2.gz QLGJLMONQXNIRI-SJORKVTESA-N 1 1 417.604 3.043 20 0 HGADMO CCCc1cc(N2CC[C@H]3OCCN(Cc4csc(C)n4)[C@H]3CC2)nc(C)[nH+]1 ZINC001164988486 722184056 /nfs/dbraw/zinc/18/40/56/722184056.db2.gz JRPJFZCAQUEYNO-VQTJNVASSA-N 1 1 401.580 3.372 20 0 HGADMO COC(=O)c1c[nH]c2ncnc(N3CCC[C@@]4(CC[N@H+]4Cc4cccc(F)c4)C3)c12 ZINC001164997299 722202390 /nfs/dbraw/zinc/20/23/90/722202390.db2.gz YXBOQDUVAXHQPU-JOCHJYFZSA-N 1 1 409.465 3.129 20 0 HGADMO OC[C@H](Cc1ccc(F)cc1)[NH2+]Cc1ncc(Br)cc1Br ZINC000474000044 1126094619 /nfs/dbraw/zinc/09/46/19/1126094619.db2.gz LQKYKCWCYQANSK-ZDUSSCGKSA-N 1 1 418.104 3.439 20 0 HGADMO OC[C@@H](Cc1ccc(F)cc1)[NH2+]Cc1ncc(Br)cc1Br ZINC000474000043 1126094715 /nfs/dbraw/zinc/09/47/15/1126094715.db2.gz LQKYKCWCYQANSK-CYBMUJFWSA-N 1 1 418.104 3.439 20 0 HGADMO O[C@@H](C(F)F)[C@H](Cc1ccccc1)[NH2+]Cc1ncc(I)s1 ZINC000511996449 1126095635 /nfs/dbraw/zinc/09/56/35/1126095635.db2.gz HQRMVBDZNVFWPM-GXFFZTMASA-N 1 1 424.254 3.075 20 0 HGADMO Cc1onc(-c2ccccc2)c1-c1nnc(C[NH2+]C2(CO)Cc3ccccc3C2)o1 ZINC000607753783 1126100542 /nfs/dbraw/zinc/10/05/42/1126100542.db2.gz CEJOTULDJFMASO-UHFFFAOYSA-N 1 1 402.454 3.320 20 0 HGADMO COc1ccc(C[C@@](C)(CO)[NH2+]Cc2nc(Cc3ccccc3C)no2)cc1OC ZINC001308118087 1126163838 /nfs/dbraw/zinc/16/38/38/1126163838.db2.gz QNPINDUXFPDMKB-QHCPKHFHSA-N 1 1 411.502 3.069 20 0 HGADMO COC(=O)c1cc(C[N@H+]2CCC[C@H](c3nn(-c4ccccc4)cc3C(N)=O)C2)c[nH]1 ZINC000328602558 569416601 /nfs/dbraw/zinc/41/66/01/569416601.db2.gz CBRPZDKLZPJPDH-INIZCTEOSA-N 1 1 407.474 3.250 20 0 HGADMO CCOC(=O)c1cnc(Cl)nc1N1CCC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21 ZINC001164618345 719054483 /nfs/dbraw/zinc/05/44/83/719054483.db2.gz ARROWSZYROQLHK-AEFFLSMTSA-N 1 1 400.910 3.408 20 0 HGADMO NC(=O)c1ccc(C(F)(F)N2CCC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)nc1Cl ZINC001164626579 719056098 /nfs/dbraw/zinc/05/60/98/719056098.db2.gz SFZDTRFCUXHOAL-WBVHZDCISA-N 1 1 420.891 3.480 20 0 HGADMO CCOC(=O)c1nc2ccn(C)c2c(N2CCC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)n1 ZINC001164632403 719092485 /nfs/dbraw/zinc/09/24/85/719092485.db2.gz ZITVRGGHCKFFAV-QUCCMNQESA-N 1 1 419.529 3.246 20 0 HGADMO CS(=O)(=O)c1ccc(Cl)nc1N1CCC[C@H]2C[N@H+](Cc3ccccc3)C[C@@H]21 ZINC001164621783 719093822 /nfs/dbraw/zinc/09/38/22/719093822.db2.gz AUFYDSOKYXQZJE-IRXDYDNUSA-N 1 1 405.951 3.239 20 0 HGADMO CS(=O)(=O)c1ccc(Cl)nc1N1CCC[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21 ZINC001164621783 719093827 /nfs/dbraw/zinc/09/38/27/719093827.db2.gz AUFYDSOKYXQZJE-IRXDYDNUSA-N 1 1 405.951 3.239 20 0 HGADMO C[C@H]1C[N@H+](C)[C@@H](C)CN1c1cc(NS(=O)(=O)c2ccc(Cl)nc2)ccc1F ZINC001164638430 719245213 /nfs/dbraw/zinc/24/52/13/719245213.db2.gz YVRRNYXBJPLHHK-STQMWFEESA-N 1 1 412.918 3.204 20 0 HGADMO C[C@H]1C[N@@H+](C)[C@@H](C)CN1c1cc(NS(=O)(=O)c2ccc(Cl)nc2)ccc1F ZINC001164638430 719245218 /nfs/dbraw/zinc/24/52/18/719245218.db2.gz YVRRNYXBJPLHHK-STQMWFEESA-N 1 1 412.918 3.204 20 0 HGADMO COC(=O)c1ccc2ccnc(N3CCc4c(C[NH+](C)C)nn(C(C)C)c4C3)c2c1 ZINC001164649141 719310151 /nfs/dbraw/zinc/31/01/51/719310151.db2.gz OIJOYWAMKJLAKR-UHFFFAOYSA-N 1 1 407.518 3.423 20 0 HGADMO CCOC(=O)c1cnc(N2CCc3c(C[NH+](C)C)nn(C(C)C)c3C2)cc1OCC ZINC001164649133 719310997 /nfs/dbraw/zinc/31/09/97/719310997.db2.gz OGUGZEJRXKCCQF-UHFFFAOYSA-N 1 1 415.538 3.059 20 0 HGADMO COc1cc(OC)c2ncnc(N3CCc4c(C[NH+](C)C)nn(C(C)C)c4C3)c2c1 ZINC001164655343 719318062 /nfs/dbraw/zinc/31/80/62/719318062.db2.gz WGWDMMACQWGWBE-UHFFFAOYSA-N 1 1 410.522 3.049 20 0 HGADMO CNC(=O)C[N@H+]1CCCC12CCN(c1cc(C(C)(C)C)nc(C(C)(C)C)n1)CC2 ZINC001164690094 719738281 /nfs/dbraw/zinc/73/82/81/719738281.db2.gz SJUBZYWOGKQYSG-UHFFFAOYSA-N 1 1 401.599 3.252 20 0 HGADMO CCOC(=O)c1ccc(N2CCC3(CCC[N@H+]3Cc3csc(C)n3)CC2)nn1 ZINC001164691790 719805177 /nfs/dbraw/zinc/80/51/77/719805177.db2.gz KBONRDDNAJCEAH-UHFFFAOYSA-N 1 1 401.536 3.053 20 0 HGADMO COC(=O)c1cnc(N2CCC3(CCC[N@H+]3Cc3csc(C)n3)CC2)c(F)c1 ZINC001164691953 719807040 /nfs/dbraw/zinc/80/70/40/719807040.db2.gz BMEISJUAGXXUIJ-UHFFFAOYSA-N 1 1 404.511 3.407 20 0 HGADMO CON(C)C(=O)c1ccnc(N2CCC3(CCC[N@H+]3Cc3csc(C)n3)CC2)c1 ZINC001164693939 719815418 /nfs/dbraw/zinc/81/54/18/719815418.db2.gz ZJDMSCHGNFDOJJ-UHFFFAOYSA-N 1 1 415.563 3.115 20 0 HGADMO COC(=O)[C@]1(C)C[C@H]([NH+]2CCOCC2)CCN1c1nc(Cl)cc2cccc(C)c21 ZINC001164702277 719877362 /nfs/dbraw/zinc/87/73/62/719877362.db2.gz HUDDEVKZTFMZPE-VGSWGCGISA-N 1 1 417.937 3.429 20 0 HGADMO CCOC(=O)Cc1ccc(N2CCC3(CC2)C[N@@H+](Cc2cccs2)CCO3)nc1 ZINC001164696243 719892936 /nfs/dbraw/zinc/89/29/36/719892936.db2.gz DSHHFXALGBPXED-UHFFFAOYSA-N 1 1 415.559 3.120 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1nc(Cl)nc3ccc(OC)cc31)C2 ZINC001164806704 720068061 /nfs/dbraw/zinc/06/80/61/720068061.db2.gz CZRAGUULRXMHCF-KSFYIVLOSA-N 1 1 416.953 3.477 20 0 HGADMO CCN(C)c1cc(C)nc(N2CCC3(C[C@H](COC)[N@H+](Cc4ccccn4)C3)CC2)n1 ZINC001164709984 720092887 /nfs/dbraw/zinc/09/28/87/720092887.db2.gz DRISRFXXVHCRMF-OAQYLSRUSA-N 1 1 424.593 3.144 20 0 HGADMO CCN(C)c1cc(C)nc(N2CCC3(C[C@H](COC)[N@@H+](Cc4ccccn4)C3)CC2)n1 ZINC001164709984 720092893 /nfs/dbraw/zinc/09/28/93/720092893.db2.gz DRISRFXXVHCRMF-OAQYLSRUSA-N 1 1 424.593 3.144 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1nccc3ccc(C(=O)OC)cc31)C2 ZINC001164811070 720104699 /nfs/dbraw/zinc/10/46/99/720104699.db2.gz LEJHWRGKKUDIDM-HYBUGGRVSA-N 1 1 409.530 3.206 20 0 HGADMO COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1nc(C)cnc1Cl)CC2 ZINC001164716997 720121551 /nfs/dbraw/zinc/12/15/51/720121551.db2.gz NBWKDXGPOXNWHH-SFHVURJKSA-N 1 1 401.942 3.341 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1nccc(-c3cccc(OC)c3)n1)C2 ZINC001164807057 720143866 /nfs/dbraw/zinc/14/38/66/720143866.db2.gz AXCQWWNPRPRCHH-HYBUGGRVSA-N 1 1 408.546 3.337 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1nc(Cl)nc3c1ncn3C(C)C)C2 ZINC001164813857 720148256 /nfs/dbraw/zinc/14/82/56/720148256.db2.gz RGHDMHFAQPNVAV-IERDGZPVSA-N 1 1 418.973 3.245 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1nc(-c3ccncc3)nc(C)c1C)C2 ZINC001164816243 720183100 /nfs/dbraw/zinc/18/31/00/720183100.db2.gz KJHHZIMPOWJVLX-XUZZJYLKSA-N 1 1 407.562 3.340 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1cncc(OCC3CCCC3)n1)C2 ZINC001164810760 720196380 /nfs/dbraw/zinc/19/63/80/720196380.db2.gz CNKADTDCMYIJLC-NFBKMPQASA-N 1 1 400.567 3.230 20 0 HGADMO CC(C)[N@@H+](C)Cc1cc(=O)n2c(n1)CN(c1nccc3cc(Cl)ncc31)CCC2 ZINC001164813407 720218726 /nfs/dbraw/zinc/21/87/26/720218726.db2.gz LOWQEQDHRBWYPL-UHFFFAOYSA-N 1 1 412.925 3.090 20 0 HGADMO CC(C)[N@@H+](C)Cc1cc(=O)n2c(n1)CN(c1nncc3cc(Cl)ccc31)CCC2 ZINC001164812023 720225935 /nfs/dbraw/zinc/22/59/35/720225935.db2.gz COMDEUDDWUMGAE-UHFFFAOYSA-N 1 1 412.925 3.090 20 0 HGADMO CSc1cc(Cl)cnc1N1CCCn2c(=O)cc(C[N@@H+](C)C(C)C)nc2C1 ZINC001164813487 720234156 /nfs/dbraw/zinc/23/41/56/720234156.db2.gz OVZBYQJSLWYRRE-UHFFFAOYSA-N 1 1 407.971 3.264 20 0 HGADMO CC(C)[N@@H+](C)Cc1cc(=O)n2c(n1)CN(c1ccc(-c3ccccc3F)nn1)CCC2 ZINC001164812105 720240715 /nfs/dbraw/zinc/24/07/15/720240715.db2.gz BADOZURNJUJJQU-UHFFFAOYSA-N 1 1 422.508 3.090 20 0 HGADMO CC(C)[N@@H+](C)Cc1cc(=O)n2c(n1)CN(c1ccc(-c3cccc(F)c3)nn1)CCC2 ZINC001164812704 720240799 /nfs/dbraw/zinc/24/07/99/720240799.db2.gz HQCVITDONMPXDR-UHFFFAOYSA-N 1 1 422.508 3.090 20 0 HGADMO CCc1nc2sccc2c(N2CCCn3c(=O)cc(C[N@@H+](C)C(C)C)nc3C2)n1 ZINC001164818342 720242578 /nfs/dbraw/zinc/24/25/78/720242578.db2.gz YSJWODSPDARJLG-UHFFFAOYSA-N 1 1 412.563 3.061 20 0 HGADMO CCOC(=O)c1sc2ncnc(N3CC[C@@H]4[C@@H]3CC[N@H+]4Cc3cccnc3)c2c1C ZINC001164728395 720329838 /nfs/dbraw/zinc/32/98/38/720329838.db2.gz VLLHWSNPOQLXGW-SJORKVTESA-N 1 1 423.542 3.425 20 0 HGADMO C[NH+]1CCC(CN2C(=O)CC[C@@H]3[C@H]2CCN3C(C)(C)c2ccnc(Cl)c2)CC1 ZINC001164831102 720355297 /nfs/dbraw/zinc/35/52/97/720355297.db2.gz XNTGKCDVZGEKDM-RTBURBONSA-N 1 1 404.986 3.377 20 0 HGADMO COC(=O)c1nc(Cl)ccc1C(F)(F)N1CC[C@@H]2[C@@H]1CC[N@@H+]2Cc1cccnc1 ZINC001164723157 720377624 /nfs/dbraw/zinc/37/76/24/720377624.db2.gz GIFOSUJRVWUQEI-CVEARBPZSA-N 1 1 422.863 3.315 20 0 HGADMO COC(=O)c1nc(Cl)ccc1C(F)(F)N1CC[C@@H]2[C@@H]1CC[N@H+]2Cc1cccnc1 ZINC001164723157 720377628 /nfs/dbraw/zinc/37/76/28/720377628.db2.gz GIFOSUJRVWUQEI-CVEARBPZSA-N 1 1 422.863 3.315 20 0 HGADMO COc1cc2nc(C)nc(N3CC[C@@H]4[C@@H]3CC[N@H+]4Cc3cccnc3)c2cc1OC ZINC001164723745 720386958 /nfs/dbraw/zinc/38/69/58/720386958.db2.gz HDDFPGVWCFZPLG-UXHICEINSA-N 1 1 405.502 3.204 20 0 HGADMO FC(F)(c1cnc2c(Cl)ncnc2c1)N1CC[C@@H]2[C@@H]1CC[N@@H+]2Cc1cccnc1 ZINC001164735360 720422527 /nfs/dbraw/zinc/42/25/27/720422527.db2.gz WOFQFJYLLHVVCV-SJORKVTESA-N 1 1 416.863 3.471 20 0 HGADMO FC(F)(c1cnc2c(Cl)ncnc2c1)N1CC[C@@H]2[C@@H]1CC[N@H+]2Cc1cccnc1 ZINC001164735360 720422528 /nfs/dbraw/zinc/42/25/28/720422528.db2.gz WOFQFJYLLHVVCV-SJORKVTESA-N 1 1 416.863 3.471 20 0 HGADMO c1ccc2nc(N3CC[C@H]4[C@@H]3CC[N@@H+]4Cc3cccnc3)c(N3CCCC3)nc2c1 ZINC001164726274 720429930 /nfs/dbraw/zinc/42/99/30/720429930.db2.gz BFVUUKOUTPOMJL-VXKWHMMOSA-N 1 1 400.530 3.478 20 0 HGADMO COC(=O)c1cnc(Cl)cc1C(F)(F)N1CC[C@@H]2[C@@H]1CC[N@@H+]2Cc1cccnc1 ZINC001164727171 720436119 /nfs/dbraw/zinc/43/61/19/720436119.db2.gz DEQNAZJXBBGDAJ-SJORKVTESA-N 1 1 422.863 3.315 20 0 HGADMO COC(=O)c1cnc(Cl)cc1C(F)(F)N1CC[C@@H]2[C@@H]1CC[N@H+]2Cc1cccnc1 ZINC001164727171 720436126 /nfs/dbraw/zinc/43/61/26/720436126.db2.gz DEQNAZJXBBGDAJ-SJORKVTESA-N 1 1 422.863 3.315 20 0 HGADMO CC(C)[N@@H+]1[C@@H]2CCN(c3ccc(N4CCCCC4)nn3)C[C@H]2C[C@H]1Cn1cccn1 ZINC001164837846 720506761 /nfs/dbraw/zinc/50/67/61/720506761.db2.gz PVIKICNYKMPELW-QHAWAJNXSA-N 1 1 409.582 3.041 20 0 HGADMO COC(=O)c1cnc(Cl)cc1N1CC[C@@H]2[C@@H](C[C@@H](Cn3cccn3)[N@H+]2C(C)C)C1 ZINC001164841237 720508200 /nfs/dbraw/zinc/50/82/00/720508200.db2.gz XYKDAGJROIFUHO-XYJFISCASA-N 1 1 417.941 3.096 20 0 HGADMO CC(C)[N@@H+]1[C@@H]2CCN(C(F)(F)c3ccc(Cl)nn3)C[C@H]2C[C@H]1Cn1cccn1 ZINC001164835278 720519375 /nfs/dbraw/zinc/51/93/75/720519375.db2.gz JNBHGXSXFYJDNV-OWCLPIDISA-N 1 1 410.900 3.249 20 0 HGADMO COc1ccc2ncnc(N3CC[C@@H]4[C@@H](C[C@H](Cn5cccn5)[N@H+]4C(C)C)C3)c2c1 ZINC001164837231 720520869 /nfs/dbraw/zinc/52/08/69/720520869.db2.gz OPIDRXWTELBMSF-NJNPRVFISA-N 1 1 406.534 3.213 20 0 HGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@@H]2CN([C@@H](F)Oc3ccnc(Cl)c3)CC[C@@H]21 ZINC001164835741 720523959 /nfs/dbraw/zinc/52/39/59/720523959.db2.gz KRIYHGNWVFWDDO-NDUPCHFUSA-N 1 1 407.921 3.437 20 0 HGADMO COC(=O)c1nc(N2CC[C@@H]3[C@H](C[C@@H](Cn4cccn4)[N@H+]3C(C)C)C2)ccc1Cl ZINC001164835893 720539996 /nfs/dbraw/zinc/53/99/96/720539996.db2.gz IXVBSBPNTZLVQD-SOLBZPMBSA-N 1 1 417.941 3.096 20 0 HGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@@H]2CN(c3nc4ncccc4nc3Cl)CC[C@@H]21 ZINC001164843069 720542204 /nfs/dbraw/zinc/54/22/04/720542204.db2.gz ZWDCCNHNKQQDFU-RYRKJORJSA-N 1 1 411.941 3.253 20 0 HGADMO COc1nc(Cl)nc(C)c1N1CC[C@@H]2[C@@H](C[C@@H](Cn3cccn3)[N@H+]2C(C)C)C1 ZINC001164841469 720544766 /nfs/dbraw/zinc/54/47/66/720544766.db2.gz WAMKGHAHTPPYQX-YESZJQIVSA-N 1 1 404.946 3.021 20 0 HGADMO CSc1cnc(Cl)nc1N1CC[C@@H]2[C@H](C[C@H](Cn3cccn3)[N@H+]2C(C)C)C1 ZINC001164833576 720551079 /nfs/dbraw/zinc/55/10/79/720551079.db2.gz AIKRECWEVJRADS-BZUAXINKSA-N 1 1 406.987 3.426 20 0 HGADMO CSc1cnc(Cl)nc1N1CC[C@@H]2[C@@H](C[C@H](Cn3cccn3)[N@H+]2C(C)C)C1 ZINC001164833575 720551303 /nfs/dbraw/zinc/55/13/03/720551303.db2.gz AIKRECWEVJRADS-ARFHVFGLSA-N 1 1 406.987 3.426 20 0 HGADMO CCOc1c(Cl)ncnc1N1CC[C@@H]2[C@H](C[C@@H](Cn3cccn3)[N@H+]2C(C)C)C1 ZINC001164840189 720554517 /nfs/dbraw/zinc/55/45/17/720554517.db2.gz SBQKXMAREOWGRX-IXDOHACOSA-N 1 1 404.946 3.103 20 0 HGADMO CCOC(=O)c1c(C)ccnc1N1CC[C@@H]2[C@H](C[C@H](Cn3cccn3)[N@H+]2C(C)C)C1 ZINC001164839828 720577322 /nfs/dbraw/zinc/57/73/22/720577322.db2.gz OVUQBVVYQPAMRT-VAMGGRTRSA-N 1 1 411.550 3.141 20 0 HGADMO Cc1noc(-c2cccnc2N2CC[C@@H]3[C@@H](C[C@H](Cn4cccn4)[N@@H+]3C(C)C)C2)n1 ZINC001164837280 720606635 /nfs/dbraw/zinc/60/66/35/720606635.db2.gz HWOHTTQLFNSUOX-NLWGTHIKSA-N 1 1 407.522 3.014 20 0 HGADMO Clc1ccc2nc(Cl)nc(N3CC[N@H+]4C[C@H](Oc5cncnc5)C[C@H]4C3)c2c1 ZINC001164745076 720608158 /nfs/dbraw/zinc/60/81/58/720608158.db2.gz UHGKALSVHGOEKF-UONOGXRCSA-N 1 1 417.300 3.069 20 0 HGADMO CC(C)[N@@H+]1[C@@H]2CCN(c3ccc(-c4ccccn4)nn3)C[C@H]2C[C@H]1Cn1cccn1 ZINC001164841668 720622557 /nfs/dbraw/zinc/62/25/57/720622557.db2.gz UAZWXTWACXEGAK-XQBPLPMBSA-N 1 1 403.534 3.113 20 0 HGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@@H]2CN(c3cncc(N4CCCCCC4)n3)CC[C@@H]21 ZINC001164839615 720625691 /nfs/dbraw/zinc/62/56/91/720625691.db2.gz NYBYWXPBASPHJJ-FSSWDIPSSA-N 1 1 423.609 3.431 20 0 HGADMO FC(F)(c1ccnc(Cl)c1Cl)N1CC[N@@H+]2C[C@@H](Oc3cncnc3)C[C@H]2C1 ZINC001164740315 720630948 /nfs/dbraw/zinc/63/09/48/720630948.db2.gz IMROQZFXLIMGRN-RYUDHWBXSA-N 1 1 416.259 3.065 20 0 HGADMO FC(F)(c1ccnc(Cl)c1Cl)N1CC[N@H+]2C[C@@H](Oc3cncnc3)C[C@H]2C1 ZINC001164740315 720630967 /nfs/dbraw/zinc/63/09/67/720630967.db2.gz IMROQZFXLIMGRN-RYUDHWBXSA-N 1 1 416.259 3.065 20 0 HGADMO CC(C)[N@@H+]1[C@@H]2CCN(c3ccnc(-c4nccs4)n3)C[C@@H]2C[C@H]1Cn1cccn1 ZINC001164843203 720646893 /nfs/dbraw/zinc/64/68/93/720646893.db2.gz VDZAAXFRFAMZDO-OKZBNKHCSA-N 1 1 409.563 3.174 20 0 HGADMO CC(C)(C)c1cc2ncnc(N3CC[N@H+]4C[C@H](Oc5cncnc5)C[C@H]4C3)c2s1 ZINC001164743213 720658496 /nfs/dbraw/zinc/65/84/96/720658496.db2.gz XBRONWLHIBIQOW-LSDHHAIUSA-N 1 1 410.547 3.121 20 0 HGADMO C[N@@H+](Cc1ccccc1)[C@@H]1COC2(C1)CCN(c1nc(Cl)nc(Cl)n1)CC2 ZINC001164844455 720677424 /nfs/dbraw/zinc/67/74/24/720677424.db2.gz SDHBJNNQQRDUDB-HNNXBMFYSA-N 1 1 408.333 3.438 20 0 HGADMO Cc1csc2c1nc(Cl)cc2N1CC[N@H+]2C[C@@H](Oc3cncnc3)C[C@@H]2C1 ZINC001164737874 720734600 /nfs/dbraw/zinc/73/46/00/720734600.db2.gz DDLBAHAXKDIQAH-KGLIPLIRSA-N 1 1 401.923 3.390 20 0 HGADMO CCC[N@H+]1CCCC[C@@H]1c1ccc(N2C[C@H](NC(=O)C3CCC3)[C@H]3COC[C@@H]32)nc1 ZINC001164849748 720804390 /nfs/dbraw/zinc/80/43/90/720804390.db2.gz SSTGNCBMFMUOFY-MBDNFAEBSA-N 1 1 412.578 3.139 20 0 HGADMO FC(F)(c1ccc(Cl)nc1)N1CC[C@@H]2[C@H](C[C@@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164743350 720807930 /nfs/dbraw/zinc/80/79/30/720807930.db2.gz FHWNOGKGTNNKPC-BPQIPLTHSA-N 1 1 422.911 3.251 20 0 HGADMO FC(F)(c1cccc(Cl)n1)N1CC[C@@H]2[C@H](C[C@@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164745423 720810442 /nfs/dbraw/zinc/81/04/42/720810442.db2.gz KHRDDZWVJNFEQV-IXDOHACOSA-N 1 1 422.911 3.251 20 0 HGADMO COc1ccc2c(ccnc2N2CC[C@@H]3[C@H](C[C@H](Cn4cncn4)[N@H+]3CC3CC3)C2)c1 ZINC001164745612 720818628 /nfs/dbraw/zinc/81/86/28/720818628.db2.gz XFAYDYCHIPTMFT-TXTKFYIRSA-N 1 1 418.545 3.214 20 0 HGADMO Clc1nc2ccccc2nc1N1CC[C@@H]2[C@H](C[C@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164739800 720823465 /nfs/dbraw/zinc/82/34/65/720823465.db2.gz IRAHDJVHQJAXBI-MBOZVWFJSA-N 1 1 423.952 3.254 20 0 HGADMO Clc1ccc2nc(N3CC[C@@H]4[C@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)ncc2c1 ZINC001164741173 720831985 /nfs/dbraw/zinc/83/19/85/720831985.db2.gz DNVHENNWRAJVKT-YFVAEKQCSA-N 1 1 423.952 3.254 20 0 HGADMO COCC[N@H+]1CCO[C@H]2CN(c3nc(Cl)nc4ccc(Cl)cc43)CC[C@@H]2C1 ZINC001164847923 720832479 /nfs/dbraw/zinc/83/24/79/720832479.db2.gz KYKAGDUIVXLSIR-DYVFJYSZSA-N 1 1 411.333 3.110 20 0 HGADMO Clc1ccnc2nc(N3CC[C@@H]4[C@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)ccc12 ZINC001164742979 720834920 /nfs/dbraw/zinc/83/49/20/720834920.db2.gz HQQTUOALANNEQS-MBOZVWFJSA-N 1 1 423.952 3.254 20 0 HGADMO COCC[N@H+]1CCO[C@@H]2CN(C(F)(F)c3ccc(Cl)nc3Cl)CC[C@@H]2C1 ZINC001164857161 720835608 /nfs/dbraw/zinc/83/56/08/720835608.db2.gz XXGNQZBMXKMBNP-TZMCWYRMSA-N 1 1 410.292 3.107 20 0 HGADMO Clc1ccnc2cnc(N3CC[C@@H]4[C@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)cc12 ZINC001164745879 720836186 /nfs/dbraw/zinc/83/61/86/720836186.db2.gz OBUJDQDTPHFAOG-CBGDNZLLSA-N 1 1 423.952 3.254 20 0 HGADMO COc1cc(N2CC[C@@H]3[C@@H](C[C@@H](Cn4cncn4)[N@H+]3CC3CC3)C2)nc2ccccc21 ZINC001164744683 720839582 /nfs/dbraw/zinc/83/95/82/720839582.db2.gz LDBRUSWCTTYLFM-CNNODRBYSA-N 1 1 418.545 3.214 20 0 HGADMO c1ncn(C[C@@H]2C[C@H]3CN(c4ccc(-c5ccncc5)cn4)CC[C@H]3[N@H+]2CC2CC2)n1 ZINC001164747720 720845331 /nfs/dbraw/zinc/84/53/31/720845331.db2.gz RMQGYGBRMZPDEL-RJGXRXQPSA-N 1 1 415.545 3.115 20 0 HGADMO COCC[N@H+]1CCO[C@H]2CN(C(F)(F)c3ccc(Cl)c(Cl)n3)CC[C@@H]2C1 ZINC001164854971 720854092 /nfs/dbraw/zinc/85/40/92/720854092.db2.gz LWGHDIUZHPWPGH-OCCSQVGLSA-N 1 1 410.292 3.107 20 0 HGADMO c1cc2ncc(N3CC[C@]4(C3)C[N@H+](CC3CC3)C[C@@H]4COCc3cccnc3)nc2[nH]1 ZINC001164754877 720869522 /nfs/dbraw/zinc/86/95/22/720869522.db2.gz UILQXEOIOCGGIR-HYBUGGRVSA-N 1 1 418.545 3.108 20 0 HGADMO COCC[N@H+]1CCO[C@@H]2CN(c3c(C)nc(-c4ccccc4)nc3Cl)CC[C@H]2C1 ZINC001164859918 720879100 /nfs/dbraw/zinc/87/91/00/720879100.db2.gz NFASTLMSIBSHLU-RBUKOAKNSA-N 1 1 416.953 3.279 20 0 HGADMO COCC[N@H+]1CCO[C@@H]2CN(c3cc(-c4ccc(Cl)nn4)ccc3F)CC[C@H]2C1 ZINC001164859954 720881116 /nfs/dbraw/zinc/88/11/16/720881116.db2.gz NKKCNBDPBXPBAU-OXJNMPFZSA-N 1 1 420.916 3.110 20 0 HGADMO COCC[N@H+]1CCO[C@@H]2CN(c3ccc(-c4cccc5ccccc54)nn3)CC[C@@H]2C1 ZINC001164853903 720882194 /nfs/dbraw/zinc/88/21/94/720882194.db2.gz DSOMWAUEEZCXPL-HYBUGGRVSA-N 1 1 418.541 3.470 20 0 HGADMO COCC[N@H+]1CCO[C@@H]2CN(c3nnc(Cl)c4ccc(Cl)cc43)CC[C@@H]2C1 ZINC001164863768 720884056 /nfs/dbraw/zinc/88/40/56/720884056.db2.gz UDZKADSRGOVHDJ-CXAGYDPISA-N 1 1 411.333 3.110 20 0 HGADMO COCC[N@H+]1CCO[C@@H]2CN(c3nc4c(Cl)cccc4nc3Cl)CC[C@H]2C1 ZINC001164865237 720886529 /nfs/dbraw/zinc/88/65/29/720886529.db2.gz ZAOVIBDCCFQDMZ-XJKSGUPXSA-N 1 1 411.333 3.110 20 0 HGADMO CCc1nccc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COCc2cccnc2)n1 ZINC001164751659 720895810 /nfs/dbraw/zinc/89/58/10/720895810.db2.gz DBKUZRZVTQZXOV-QPPBQGQZSA-N 1 1 407.562 3.189 20 0 HGADMO CC(C)[N@@H+](C)Cc1cnc2n1CCN(c1ncnc3c1ncn3-c1ccccc1)[C@H]2C ZINC001164856677 721015731 /nfs/dbraw/zinc/01/57/31/721015731.db2.gz BIRXHIGUHXDEAV-KRWDZBQOSA-N 1 1 416.533 3.433 20 0 HGADMO CCC[N@H+]1CCCC[C@@H]1c1ccc(N2CC[C@H]3[C@H]2CCN3C(=O)c2cnn(C)c2)nc1 ZINC001164761553 721039120 /nfs/dbraw/zinc/03/91/20/721039120.db2.gz GJZKBBLMMLMUNZ-VSKRKVRLSA-N 1 1 422.577 3.246 20 0 HGADMO Clc1cc(-c2ccncc2)c(N2CC[N@H+]3C[C@@H](OCc4cccnc4)C[C@H]3C2)nn1 ZINC001164869562 721057595 /nfs/dbraw/zinc/05/75/95/721057595.db2.gz UHWCUCKUBBDTHD-OALUTQOASA-N 1 1 422.920 3.067 20 0 HGADMO c1ccc(Oc2ccnc(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@@H]4C3)n2)cc1 ZINC001164868816 721066428 /nfs/dbraw/zinc/06/64/28/721066428.db2.gz QRKSRRTVAUPFAW-TZIWHRDSSA-N 1 1 403.486 3.144 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(C(F)(F)c4nc(Cl)cc(Cl)n4)C[C@@H]3C2)cn1 ZINC001164772559 721082956 /nfs/dbraw/zinc/08/29/56/721082956.db2.gz VCNLQXKXBDQCTE-OLZOCXBDSA-N 1 1 417.291 3.020 20 0 HGADMO Cc1ccc2c(c1)nc(Cl)nc2N1CC[N@H+]2C[C@H](OCc3cccnc3)C[C@H]2C1 ZINC001164867742 721091782 /nfs/dbraw/zinc/09/17/82/721091782.db2.gz ZUITZFORKIZSNK-ZWKOTPCHSA-N 1 1 409.921 3.466 20 0 HGADMO COc1cc2ccnc(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@@H]4C3)c2cc1OC ZINC001164866629 721096404 /nfs/dbraw/zinc/09/64/04/721096404.db2.gz UHOMIZXHWWWKDJ-WOJBJXKFSA-N 1 1 420.513 3.127 20 0 HGADMO Cc1cc(Cl)nc(C(F)(F)N2CC[N@H+]3C[C@H](OCc4cccnc4)C[C@H]3C2)c1 ZINC001164865462 721102446 /nfs/dbraw/zinc/10/24/46/721102446.db2.gz LNCIFLSDHBVEQT-DLBZAZTESA-N 1 1 408.880 3.463 20 0 HGADMO Cc1ccc(Cl)nc1C(F)(F)N1CC[N@H+]2C[C@@H](OCc3cccnc3)C[C@H]2C1 ZINC001164864558 721109067 /nfs/dbraw/zinc/10/90/67/721109067.db2.gz GGSVBLCBVINJRS-IRXDYDNUSA-N 1 1 408.880 3.463 20 0 HGADMO Cc1nc(C(F)(F)N2CC[N@H+]3C[C@@H](OCc4cccnc4)C[C@@H]3C2)nc(Cl)c1C ZINC001164867337 721109084 /nfs/dbraw/zinc/10/90/84/721109084.db2.gz XYCZGALYDKDCSP-SJORKVTESA-N 1 1 423.895 3.166 20 0 HGADMO Cc1cccc2nc(Cl)nc(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@H]4C3)c12 ZINC001164866632 721118005 /nfs/dbraw/zinc/11/80/05/721118005.db2.gz UHQLXNZVJXZOKX-ROUUACIJSA-N 1 1 409.921 3.466 20 0 HGADMO CCOC(=O)c1cc(N2C[C@@H]3C[N@H+](Cc4cnn(C)c4)CC[C@@H]3C2)nc2ccccc21 ZINC001164769008 721124949 /nfs/dbraw/zinc/12/49/49/721124949.db2.gz OTYGXKRIBRHWFM-MOPGFXCFSA-N 1 1 419.529 3.103 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4ncnc5c4ccn5C4CCCC4)C[C@H]3C2)cn1 ZINC001164771345 721144469 /nfs/dbraw/zinc/14/44/69/721144469.db2.gz SGJFEEGYZVNDSB-RTBURBONSA-N 1 1 405.550 3.238 20 0 HGADMO COc1ccccc1-c1ccnc(N2CC[N@H+]3C[C@H](OCc4cccnc4)C[C@H]3C2)n1 ZINC001164881080 721153831 /nfs/dbraw/zinc/15/38/31/721153831.db2.gz YXFYNYPYFZPIMK-VQTJNVASSA-N 1 1 417.513 3.027 20 0 HGADMO COc1ccc(-c2cc(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@@H]4C3)ncn2)cc1 ZINC001164877018 721154602 /nfs/dbraw/zinc/15/46/02/721154602.db2.gz NWKJAFIURWEICN-IRLDBZIGSA-N 1 1 417.513 3.027 20 0 HGADMO COc1ccc(-c2cc(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@H]4C3)ncn2)cc1 ZINC001164877020 721154798 /nfs/dbraw/zinc/15/47/98/721154798.db2.gz NWKJAFIURWEICN-UNMCSNQZSA-N 1 1 417.513 3.027 20 0 HGADMO Fc1ccc(Oc2ccnc(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@H]4C3)n2)cc1 ZINC001164871074 721161083 /nfs/dbraw/zinc/16/10/83/721161083.db2.gz DHVWITMWQXVJGS-FPOVZHCZSA-N 1 1 421.476 3.283 20 0 HGADMO Cc1nc2c3ccccc3oc2c(N2C[C@@H]3C[N@@H+](Cc4cnn(C)c4)CC[C@@H]3C2)n1 ZINC001164771378 721161626 /nfs/dbraw/zinc/16/16/26/721161626.db2.gz SLQNHJRHBIMIBU-MSOLQXFVSA-N 1 1 402.502 3.376 20 0 HGADMO Cc1nc(C)c(-c2ccc(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@@H]4C3)nn2)s1 ZINC001164873537 721173352 /nfs/dbraw/zinc/17/33/52/721173352.db2.gz IOYDERMBNDBGML-MOPGFXCFSA-N 1 1 422.558 3.092 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4nccc(Oc5cccc(F)c5)n4)C[C@@H]3C2)cn1 ZINC001164762626 721179434 /nfs/dbraw/zinc/17/94/34/721179434.db2.gz DBEKQAOSKQAYJM-ROUUACIJSA-N 1 1 408.481 3.100 20 0 HGADMO c1cc2c(nc(C3CCC3)nc2N2CC[N@H+]3C[C@@H](OCc4cccnc4)C[C@@H]3C2)[nH]1 ZINC001164866777 721195435 /nfs/dbraw/zinc/19/54/35/721195435.db2.gz CWLAKOYSROGSCH-MOPGFXCFSA-N 1 1 404.518 3.100 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4cc(-c5cccc(Cl)c5)ncn4)C[C@@H]3C2)cn1 ZINC001164773854 721210336 /nfs/dbraw/zinc/21/03/36/721210336.db2.gz XMCHNJGYTSENCQ-MOPGFXCFSA-N 1 1 408.937 3.489 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(C(F)(F)c4cc(Cl)nc5c4CCC5)C[C@H]3C2)cn1 ZINC001164765487 721248325 /nfs/dbraw/zinc/24/83/25/721248325.db2.gz RLRPGHYSMIBBEO-JKSUJKDBSA-N 1 1 421.923 3.460 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(C(F)(F)c4cc(Cl)nc5c4CCC5)C[C@@H]3C2)cn1 ZINC001164765485 721249867 /nfs/dbraw/zinc/24/98/67/721249867.db2.gz RLRPGHYSMIBBEO-HOTGVXAUSA-N 1 1 421.923 3.460 20 0 HGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2CC[C@@H]3OCC[C@@]3(C(=O)NCC3CC3)C2)nc1 ZINC001164882878 721345476 /nfs/dbraw/zinc/34/54/76/721345476.db2.gz IGZNSKPHKUSBLF-ZFGGDYGUSA-N 1 1 412.578 3.140 20 0 HGADMO COc1cc(Cl)nc(N2CCC[C@@]3(C2)COCC[N@H+](Cc2c(C)noc2C)C3)c1 ZINC001164776801 721347185 /nfs/dbraw/zinc/34/71/85/721347185.db2.gz CXARGXFCLPMKJT-OAQYLSRUSA-N 1 1 420.941 3.467 20 0 HGADMO COc1cc(Cl)nc(N2CCC[C@@]3(C2)COCC[N@@H+](Cc2c(C)noc2C)C3)c1 ZINC001164776801 721347189 /nfs/dbraw/zinc/34/71/89/721347189.db2.gz CXARGXFCLPMKJT-OAQYLSRUSA-N 1 1 420.941 3.467 20 0 HGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@@]2(CCCN(c3cc4ccccc4nn3)C2)C1 ZINC001164779985 721351417 /nfs/dbraw/zinc/35/14/17/721351417.db2.gz XVDDGXYEFXUFKB-QHCPKHFHSA-N 1 1 407.518 3.354 20 0 HGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@@]2(CCCN(c3cc4ccccc4nn3)C2)C1 ZINC001164779985 721351420 /nfs/dbraw/zinc/35/14/20/721351420.db2.gz XVDDGXYEFXUFKB-QHCPKHFHSA-N 1 1 407.518 3.354 20 0 HGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@@]2(CCCN(c3cc(C)nc(C4CC4)n3)C2)C1 ZINC001164786050 721369474 /nfs/dbraw/zinc/36/94/74/721369474.db2.gz VDGHMOTZVOCOBM-QHCPKHFHSA-N 1 1 411.550 3.386 20 0 HGADMO COCc1cc(N2C[C@@H]3C[N@@H+](Cc4nccs4)C[C@@H]3C2)nc(-c2ccccc2)n1 ZINC001164790713 721393593 /nfs/dbraw/zinc/39/35/93/721393593.db2.gz XMDJCLUJYVJHNU-HDICACEKSA-N 1 1 407.543 3.315 20 0 HGADMO COCc1cc(N2C[C@@H]3C[N@H+](Cc4nccs4)C[C@@H]3C2)nc(-c2ccccc2)n1 ZINC001164790713 721393598 /nfs/dbraw/zinc/39/35/98/721393598.db2.gz XMDJCLUJYVJHNU-HDICACEKSA-N 1 1 407.543 3.315 20 0 HGADMO C[NH+]1CCN(C[C@H]2CCC[C@@]3(CCN(c4cnc5c(Cl)cccc5n4)C3)O2)CC1 ZINC001164886690 721402060 /nfs/dbraw/zinc/40/20/60/721402060.db2.gz KSQQEAONQICCAO-VGSWGCGISA-N 1 1 415.969 3.049 20 0 HGADMO C[NH+]1CCN(C[C@@H]2CCC[C@]3(CCN(c4cc5nccc(Cl)c5cn4)C3)O2)CC1 ZINC001164884724 721407499 /nfs/dbraw/zinc/40/74/99/721407499.db2.gz FKPSHCKCDXSNSF-HTAPYJJXSA-N 1 1 415.969 3.049 20 0 HGADMO COc1cccc2nc(Cl)nc(N3C[C@H]4C[NH+](Cc5nccs5)C[C@@H]4C3)c21 ZINC001164780573 721413645 /nfs/dbraw/zinc/41/36/45/721413645.db2.gz BFPBGLVIKWYIRQ-CHWSQXEVSA-N 1 1 401.923 3.317 20 0 HGADMO FC(F)(COc1cccc(Cl)n1)N1C[C@@H]2C[NH+](Cc3nccs3)C[C@H]2C1 ZINC001164785018 721417338 /nfs/dbraw/zinc/41/73/38/721417338.db2.gz MCRPVFJGEWEKOZ-STQMWFEESA-N 1 1 400.882 3.227 20 0 HGADMO CC(C)n1cnc2c1nc(Cl)nc2N1C[C@@H]2C[NH+](Cc3nccs3)C[C@H]2C1 ZINC001164781739 721420075 /nfs/dbraw/zinc/42/00/75/721420075.db2.gz DMPQXQVVOQYQLS-STQMWFEESA-N 1 1 403.943 3.085 20 0 HGADMO CC(C)(C)c1noc(-c2ccnc(N3C[C@H]4C[NH+](Cc5nccs5)C[C@@H]4C3)c2)n1 ZINC001164785587 721422518 /nfs/dbraw/zinc/42/25/18/721422518.db2.gz NKVXEZYOQSAWOB-HZPDHXFCSA-N 1 1 410.547 3.454 20 0 HGADMO Cc1nc(N2CC[C@@]3(C2)CCC[C@H](CN2CC[NH+](C)CC2)O3)c(Cl)cc1Cl ZINC001164893124 721428727 /nfs/dbraw/zinc/42/87/27/721428727.db2.gz JBWMCRYMTYXGMG-OXQOHEQNSA-N 1 1 413.393 3.462 20 0 HGADMO COc1ccc(OC)c(-c2ccc(N3C[C@@H]4C[NH+](Cc5nccs5)C[C@H]4C3)nn2)c1 ZINC001164784680 721431494 /nfs/dbraw/zinc/43/14/94/721431494.db2.gz LPRWXVDSQZTLID-HOTGVXAUSA-N 1 1 423.542 3.186 20 0 HGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1ncnc3ccsc31)CC2 ZINC001164784047 721450685 /nfs/dbraw/zinc/45/06/85/721450685.db2.gz DITICVMJVOEANL-GOSISDBHSA-N 1 1 416.591 3.425 20 0 HGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1nccc3ncccc31)CC2 ZINC001164785962 721452600 /nfs/dbraw/zinc/45/26/00/721452600.db2.gz KKKKOUHMHPPUQP-FQEVSTJZSA-N 1 1 410.562 3.364 20 0 HGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1ccc(C(C)C)nn1)CC2 ZINC001164789209 721457378 /nfs/dbraw/zinc/45/73/78/721457378.db2.gz VTJNOWACMILYJE-FQEVSTJZSA-N 1 1 402.583 3.334 20 0 HGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1cc(Cl)cc(OC)n1)CC2 ZINC001164783528 721459058 /nfs/dbraw/zinc/45/90/58/721459058.db2.gz DICGYTQEURGCGC-LJQANCHMSA-N 1 1 423.985 3.478 20 0 HGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1ncc(C3CC3)cn1)CC2 ZINC001164783561 721460507 /nfs/dbraw/zinc/46/05/07/721460507.db2.gz DLOLHNYNFASEDR-OAQYLSRUSA-N 1 1 400.567 3.088 20 0 HGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1ccnc(C(C)C)n1)CC2 ZINC001164786721 721460970 /nfs/dbraw/zinc/46/09/70/721460970.db2.gz PGVZFNZSPMXGSZ-FQEVSTJZSA-N 1 1 402.583 3.334 20 0 HGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1nc(Cl)ccc1OC)CC2 ZINC001164786460 721461538 /nfs/dbraw/zinc/46/15/38/721461538.db2.gz OEXYIGXTHNCJFF-SFHVURJKSA-N 1 1 423.985 3.478 20 0 HGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1ncc(C)cc1OC)CC2 ZINC001164782832 721464084 /nfs/dbraw/zinc/46/40/84/721464084.db2.gz CSWUFNCYGGDTSD-HXUWFJFHSA-N 1 1 403.567 3.133 20 0 HGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1nccc(C(F)F)n1)CC2 ZINC001164789966 721464469 /nfs/dbraw/zinc/46/44/69/721464469.db2.gz YTRXOOPGFOSUSM-KRWDZBQOSA-N 1 1 410.509 3.148 20 0 HGADMO CCCc1ccc(N2CCC3(C[C@H](COCC4CC4)[N@@H+](CCOC)C3)CC2)nn1 ZINC001164791721 721467344 /nfs/dbraw/zinc/46/73/44/721467344.db2.gz XZCJKEOHXKSEKX-OAQYLSRUSA-N 1 1 402.583 3.163 20 0 HGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1cc(C)nc(C3CC3)n1)CC2 ZINC001164791722 721468774 /nfs/dbraw/zinc/46/87/74/721468774.db2.gz XZTYEZXCLCKKKC-NRFANRHFSA-N 1 1 414.594 3.396 20 0 HGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1nc(C)nc(C)c1C)CC2 ZINC001164790128 721469473 /nfs/dbraw/zinc/46/94/73/721469473.db2.gz RHCOVAJLESXXKP-NRFANRHFSA-N 1 1 402.583 3.136 20 0 HGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1ncc(C(F)F)cn1)CC2 ZINC001164789862 721470789 /nfs/dbraw/zinc/47/07/89/721470789.db2.gz OQOBDCQAHAERNQ-GOSISDBHSA-N 1 1 410.509 3.148 20 0 HGADMO COCCn1ccc2c1ncnc2N1CCC2(CC([N@@H+](C)Cc3ccncc3)C2)CC1 ZINC001164792007 721496464 /nfs/dbraw/zinc/49/64/64/721496464.db2.gz JHXNXCNPPOCATQ-UHFFFAOYSA-N 1 1 420.561 3.354 20 0 HGADMO Cc1cc(Cl)nc(C(F)(F)N2CC[N@H+]3C[C@@H](Oc4cccc(F)c4)C[C@H]3C2)n1 ZINC001164900057 721512780 /nfs/dbraw/zinc/51/27/80/721512780.db2.gz NQCNVSLLAOMYIB-HOCLYGCPSA-N 1 1 412.843 3.464 20 0 HGADMO O=C(c1cccnc1N1CC[N@H+]2C[C@@H](Oc3cccc(F)c3)C[C@@H]2C1)N1CCCCC1 ZINC001164900668 721513335 /nfs/dbraw/zinc/51/33/35/721513335.db2.gz SRCOQDTZRRCSOX-CTNGQTDRSA-N 1 1 424.520 3.189 20 0 HGADMO Fc1cccc(O[C@H]2C[C@@H]3CN(c4nc(Cl)nc5c4SCC5)CC[N@H+]3C2)c1 ZINC001164903947 721526857 /nfs/dbraw/zinc/52/68/57/721526857.db2.gz DLAYVFCHLRUCMD-HIFRSBDPSA-N 1 1 406.914 3.259 20 0 HGADMO COc1cc2ncc(N3CC[N@H+]4C[C@@H](Oc5cccc(F)c5)C[C@@H]4C3)nc2cc1OC ZINC001164905200 721531262 /nfs/dbraw/zinc/53/12/62/721531262.db2.gz GNPSHJCHAWJTJF-AEFFLSMTSA-N 1 1 424.476 3.128 20 0 HGADMO COC(=O)c1nc(N2CC[N@H+]3C[C@H](Oc4cccc(F)c4)C[C@@H]3C2)ccc1Cl ZINC001164906361 721532398 /nfs/dbraw/zinc/53/23/98/721532398.db2.gz KDDJYQZDBFGJLH-GDBMZVCRSA-N 1 1 405.857 3.003 20 0 HGADMO Nc1cc(Cl)nc(C(F)(F)N2CC[N@H+]3C[C@H](Oc4cccc(F)c4)C[C@@H]3C2)c1 ZINC001164906389 721539828 /nfs/dbraw/zinc/53/98/28/721539828.db2.gz KJKXONDGZZDMOP-GDBMZVCRSA-N 1 1 412.843 3.343 20 0 HGADMO Cc1nc2ccc(F)cc2c(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@H]32)n1 ZINC001164806589 721541366 /nfs/dbraw/zinc/54/13/66/721541366.db2.gz OWHZGGUAIQPLPJ-BHIFYINESA-N 1 1 407.493 3.341 20 0 HGADMO COc1nc(-c2ccccc2)nc(N2CC[N@H+]3C[C@H](Oc4cccc(F)c4)C[C@H]3C2)n1 ZINC001164902668 721541770 /nfs/dbraw/zinc/54/17/70/721541770.db2.gz AWMJRDQWTQMBSY-AZUAARDMSA-N 1 1 421.476 3.028 20 0 HGADMO Cc1nc2ccc(F)cc2c(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@H]3OCCC[C@H]32)n1 ZINC001164806592 721541787 /nfs/dbraw/zinc/54/17/87/721541787.db2.gz OWHZGGUAIQPLPJ-FSSWDIPSSA-N 1 1 407.493 3.341 20 0 HGADMO COc1nc(-c2ccccc2)nc(N2CC[N@H+]3C[C@H](Oc4cccc(F)c4)C[C@@H]3C2)n1 ZINC001164902671 721541838 /nfs/dbraw/zinc/54/18/38/721541838.db2.gz AWMJRDQWTQMBSY-UYAOXDASSA-N 1 1 421.476 3.028 20 0 HGADMO CCOC(=O)/C=C/c1ccc(N2CC[N@H+]3C[C@H](Oc4cccc(F)c4)C[C@@H]3C2)nc1 ZINC001164907328 721543606 /nfs/dbraw/zinc/54/36/06/721543606.db2.gz MYCYVWHPCNUXGM-PWIIPBGMSA-N 1 1 411.477 3.139 20 0 HGADMO COc1cc2c(cc1F)ncnc2N1CC[N@H+]2C[C@H](Oc3cccc(F)c3)C[C@H]2C1 ZINC001164903003 721543725 /nfs/dbraw/zinc/54/37/25/721543725.db2.gz BREFVRDQUUDLGG-DOTOQJQBSA-N 1 1 412.440 3.259 20 0 HGADMO Cc1c[nH]c2nc(Cl)nc(N3C[C@H]([N@H+](C)Cc4cccnc4)[C@@H]4OCCC[C@@H]43)c12 ZINC001164801478 721543916 /nfs/dbraw/zinc/54/39/16/721543916.db2.gz FKZBGUZVDVKGNU-XYJFISCASA-N 1 1 412.925 3.183 20 0 HGADMO Cc1c[nH]c2nc(Cl)nc(N3C[C@H]([N@@H+](C)Cc4cccnc4)[C@@H]4OCCC[C@@H]43)c12 ZINC001164801478 721543923 /nfs/dbraw/zinc/54/39/23/721543923.db2.gz FKZBGUZVDVKGNU-XYJFISCASA-N 1 1 412.925 3.183 20 0 HGADMO COC(=O)/C=C\c1cc(C)cnc1N1CC[N@H+]2C[C@H](Oc3cccc(F)c3)C[C@H]2C1 ZINC001164906908 721548016 /nfs/dbraw/zinc/54/80/16/721548016.db2.gz LTMREJWRDKQNLU-ABDUDLSGSA-N 1 1 411.477 3.057 20 0 HGADMO Cc1cc(N2CC[N@H+]3C[C@H](Oc4cccc(F)c4)C[C@@H]3C2)nc(-c2ccccn2)n1 ZINC001164906475 721552570 /nfs/dbraw/zinc/55/25/70/721552570.db2.gz JKGMXHZCICPKSG-UYAOXDASSA-N 1 1 405.477 3.328 20 0 HGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN([C@H](F)Oc2cccc(Cl)n2)[C@H]2CCCO[C@@H]12 ZINC001164798538 721554008 /nfs/dbraw/zinc/55/40/08/721554008.db2.gz BGTYMGKSRIAWSM-FIYPYCPBSA-N 1 1 406.889 3.126 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN([C@H](F)Oc2cccc(Cl)n2)[C@H]2CCCO[C@@H]12 ZINC001164798538 721554010 /nfs/dbraw/zinc/55/40/10/721554010.db2.gz BGTYMGKSRIAWSM-FIYPYCPBSA-N 1 1 406.889 3.126 20 0 HGADMO Fc1cccc(O[C@H]2C[C@@H]3CN(c4cncc(N5CCCCCC5)n4)CC[N@H+]3C2)c1 ZINC001164903540 721560182 /nfs/dbraw/zinc/56/01/82/721560182.db2.gz CCYWJVDAFZZQBQ-CTNGQTDRSA-N 1 1 411.525 3.338 20 0 HGADMO CCCN(CCC)c1cc(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@H]32)ncn1 ZINC001164802919 721566915 /nfs/dbraw/zinc/56/69/15/721566915.db2.gz ISLDEUIWUIXTSY-ZFGGDYGUSA-N 1 1 424.593 3.366 20 0 HGADMO CCCN(CCC)c1cncc(N2C[C@H]([N@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@H]32)n1 ZINC001164806238 721568321 /nfs/dbraw/zinc/56/83/21/721568321.db2.gz PKPYOTPDJOEUJL-ZFGGDYGUSA-N 1 1 424.593 3.366 20 0 HGADMO CCCN(CCC)c1cncc(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@H]32)n1 ZINC001164806238 721568327 /nfs/dbraw/zinc/56/83/27/721568327.db2.gz PKPYOTPDJOEUJL-ZFGGDYGUSA-N 1 1 424.593 3.366 20 0 HGADMO CCCN(CCC)c1cncc(N2C[C@H]([N@H+](C)Cc3cccnc3)[C@H]3OCCC[C@@H]32)n1 ZINC001164806236 721568365 /nfs/dbraw/zinc/56/83/65/721568365.db2.gz PKPYOTPDJOEUJL-HFMPRLQTSA-N 1 1 424.593 3.366 20 0 HGADMO CCCN(CCC)c1cncc(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@H]3OCCC[C@@H]32)n1 ZINC001164806236 721568369 /nfs/dbraw/zinc/56/83/69/721568369.db2.gz PKPYOTPDJOEUJL-HFMPRLQTSA-N 1 1 424.593 3.366 20 0 HGADMO CC[N@H+]1CCCC[C@H]1c1ccc(N2CCO[C@@]3(CCCN(c4cnccn4)C3)C2)nc1 ZINC001164903412 721580705 /nfs/dbraw/zinc/58/07/05/721580705.db2.gz NENITASZZFGSGW-XUZZJYLKSA-N 1 1 422.577 3.294 20 0 HGADMO Cc1nc(-c2ccncc2)cc(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@@H]32)n1 ZINC001164810214 721583025 /nfs/dbraw/zinc/58/30/25/721583025.db2.gz VDTUXYSMILZREX-WPFOTENUSA-N 1 1 416.529 3.110 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2ccnc(Cc3ccccc3)n2)[C@@H]2CCCO[C@H]12 ZINC001164799269 721583519 /nfs/dbraw/zinc/58/35/19/721583519.db2.gz AFYPBURHOFHZEQ-RQTOMXEWSA-N 1 1 415.541 3.331 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2ccnc(Cc3ccccc3)n2)[C@H]2CCCO[C@@H]12 ZINC001164799270 721583597 /nfs/dbraw/zinc/58/35/97/721583597.db2.gz AFYPBURHOFHZEQ-SGIRGMQISA-N 1 1 415.541 3.331 20 0 HGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2cncc(N3CCCCCC3)n2)[C@@H]2CCCO[C@@H]12 ZINC001164804307 721585380 /nfs/dbraw/zinc/58/53/80/721585380.db2.gz JJSJFEUOSNBRKZ-PQNGQFLHSA-N 1 1 422.577 3.120 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2cncc(N3CCCCCC3)n2)[C@@H]2CCCO[C@@H]12 ZINC001164804307 721585384 /nfs/dbraw/zinc/58/53/84/721585384.db2.gz JJSJFEUOSNBRKZ-PQNGQFLHSA-N 1 1 422.577 3.120 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2nc(C3CCC3)nc3[nH]ccc32)[C@@H]2CCCO[C@@H]12 ZINC001164802530 721591631 /nfs/dbraw/zinc/59/16/31/721591631.db2.gz GGVYOQJWIPSKAY-NJDAHSKKSA-N 1 1 418.545 3.489 20 0 HGADMO FC1(F)CCN(c2nc(Cl)nc3c2COC3)C[C@@]12CC[N@@H+](Cc1ccccn1)C2 ZINC001164905544 721695383 /nfs/dbraw/zinc/69/53/83/721695383.db2.gz JUTMXFGTYCCQAA-IBGZPJMESA-N 1 1 421.879 3.293 20 0 HGADMO COCc1cc(N2CCC(F)(F)[C@@]3(CC[N@@H+](Cc4ccccn4)C3)C2)nc(C)n1 ZINC001164906983 721699982 /nfs/dbraw/zinc/69/99/82/721699982.db2.gz QBEDLBBUQTWCMC-HXUWFJFHSA-N 1 1 403.477 3.064 20 0 HGADMO COc1cc(OC)nc(N2CCC(F)(F)[C@]3(CC[N@@H+](Cc4ccccn4)C3)C2)c1 ZINC001164904380 721703825 /nfs/dbraw/zinc/70/38/25/721703825.db2.gz CYQJCZCDGDYFAY-FQEVSTJZSA-N 1 1 404.461 3.232 20 0 HGADMO COC(=O)c1cc(N2CCC(F)(F)[C@]3(CC[N@@H+](Cc4ccccn4)C3)C2)ncc1C ZINC001164905480 721710638 /nfs/dbraw/zinc/71/06/38/721710638.db2.gz GTQWSTYBVHLELA-NRFANRHFSA-N 1 1 416.472 3.309 20 0 HGADMO CC(C)Oc1nccnc1N1CCC(F)(F)[C@]2(CC[N@@H+](Cc3ccccn3)C2)C1 ZINC001164912277 721731522 /nfs/dbraw/zinc/73/15/22/721731522.db2.gz NPUHIVPTUQYHII-FQEVSTJZSA-N 1 1 403.477 3.397 20 0 HGADMO C[N@H+](Cc1ccco1)Cc1cncc2c1CCN(c1cc(Cl)ncc1C(N)=O)C2 ZINC001164908878 721745994 /nfs/dbraw/zinc/74/59/94/721745994.db2.gz NHVRYUUMAHDALT-UHFFFAOYSA-N 1 1 411.893 3.017 20 0 HGADMO C[N@@H+](Cc1ccco1)Cc1cncc2c1CCN(c1cc(Cl)ncc1C(N)=O)C2 ZINC001164908878 721746000 /nfs/dbraw/zinc/74/60/00/721746000.db2.gz NHVRYUUMAHDALT-UHFFFAOYSA-N 1 1 411.893 3.017 20 0 HGADMO CC(C)OC(=O)c1ccc(N2CCc3c(C[N@H+](C)Cc4ccco4)cncc3C2)nn1 ZINC001164910053 721748215 /nfs/dbraw/zinc/74/82/15/721748215.db2.gz ZNZVYJNHVFOTFH-UHFFFAOYSA-N 1 1 421.501 3.225 20 0 HGADMO CC(C)OC(=O)c1ccc(N2CCc3c(C[N@@H+](C)Cc4ccco4)cncc3C2)nn1 ZINC001164910053 721748216 /nfs/dbraw/zinc/74/82/16/721748216.db2.gz ZNZVYJNHVFOTFH-UHFFFAOYSA-N 1 1 421.501 3.225 20 0 HGADMO CCn1cnc2c1ncnc2N1CCc2c(C[N@H+](C)Cc3ccco3)cncc2C1 ZINC001164911837 721760590 /nfs/dbraw/zinc/76/05/90/721760590.db2.gz SPXXFHBERSHXQV-UHFFFAOYSA-N 1 1 403.490 3.029 20 0 HGADMO CCn1cnc2c1ncnc2N1CCc2c(C[N@@H+](C)Cc3ccco3)cncc2C1 ZINC001164911837 721760595 /nfs/dbraw/zinc/76/05/95/721760595.db2.gz SPXXFHBERSHXQV-UHFFFAOYSA-N 1 1 403.490 3.029 20 0 HGADMO COc1cnc(N2C[C@@H]3CCC[C@@H]([N@@H+](C)Cc4ccccn4)[C@H]3C2)nc1NC(C)C ZINC001165024456 721797948 /nfs/dbraw/zinc/79/79/48/721797948.db2.gz LBOFVLSYHXEEIF-YSIASYRMSA-N 1 1 410.566 3.437 20 0 HGADMO CCOC(=O)Cc1cccnc1N1C[C@@H]2CCC[C@@H]([N@@H+](C)Cc3ccccn3)[C@H]2C1 ZINC001165017756 721804239 /nfs/dbraw/zinc/80/42/39/721804239.db2.gz AJXLKUSGHGNSEI-ILWGZMRPSA-N 1 1 408.546 3.319 20 0 HGADMO CCOC(=O)c1cnc(N2C[C@@H]3CCC[C@H]([N@@H+](C)Cc4ccccn4)[C@H]3C2)nc1C ZINC001165025475 721810324 /nfs/dbraw/zinc/81/03/24/721810324.db2.gz MWVDNYQTEMUXPH-YYWHXJBOSA-N 1 1 409.534 3.094 20 0 HGADMO CCOC(=O)c1cnc(N2C[C@@H]3CCC[C@@H]([N@@H+](C)Cc4ccccn4)[C@H]3C2)nc1C ZINC001165025469 721810383 /nfs/dbraw/zinc/81/03/83/721810383.db2.gz MWVDNYQTEMUXPH-DZFGPLHGSA-N 1 1 409.534 3.094 20 0 HGADMO C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@@H]2CN(c3ncc4ncnc(Cl)c4n3)C[C@H]21 ZINC001165025509 721818667 /nfs/dbraw/zinc/81/86/67/721818667.db2.gz NCKBCHPIQQJJFL-QGPMSJSTSA-N 1 1 409.925 3.205 20 0 HGADMO CN(C)CC[N@@H+]1CC[C@@H]2[C@@H]1CCN2c1ccc(C(=O)Nc2cccc(Cl)c2)cn1 ZINC001164933344 721879980 /nfs/dbraw/zinc/87/99/80/721879980.db2.gz MICBUYXZXVUQEF-VQTJNVASSA-N 1 1 413.953 3.202 20 0 HGADMO CN(C)CC[N@H+]1CC[C@@H]2[C@@H]1CCN2c1ccc(C(=O)Nc2cccc(Cl)c2)cn1 ZINC001164933344 721879982 /nfs/dbraw/zinc/87/99/82/721879982.db2.gz MICBUYXZXVUQEF-VQTJNVASSA-N 1 1 413.953 3.202 20 0 HGADMO CN(C)CC[N@@H+]1CC[C@H]2[C@@H]1CCN2c1cnc(Cl)nc1Oc1ccccc1F ZINC001164935560 721888173 /nfs/dbraw/zinc/88/81/73/721888173.db2.gz XSPPVCCOVIMWIU-HOTGVXAUSA-N 1 1 405.905 3.276 20 0 HGADMO CN(C)CC[N@H+]1CC[C@H]2[C@@H]1CCN2c1cnc(Cl)nc1Oc1ccccc1F ZINC001164935560 721888175 /nfs/dbraw/zinc/88/81/75/721888175.db2.gz XSPPVCCOVIMWIU-HOTGVXAUSA-N 1 1 405.905 3.276 20 0 HGADMO Cc1cccc(Oc2nc(Cl)ncc2N2CC[C@@H]3[C@@H]2CC[N@H+]3CCN(C)C)c1 ZINC001164929586 721888203 /nfs/dbraw/zinc/88/82/03/721888203.db2.gz BXCVIGRQAAGXFF-MSOLQXFVSA-N 1 1 401.942 3.445 20 0 HGADMO Cc1cccc(Oc2nc(Cl)ncc2N2CC[C@@H]3[C@@H]2CC[N@@H+]3CCN(C)C)c1 ZINC001164929586 721888204 /nfs/dbraw/zinc/88/82/04/721888204.db2.gz BXCVIGRQAAGXFF-MSOLQXFVSA-N 1 1 401.942 3.445 20 0 HGADMO Cc1ccc(CN2CCOC3(CCN(c4nccc(C5CC[NH2+]CC5)n4)CC3)C2)cc1 ZINC001164939113 721929115 /nfs/dbraw/zinc/92/91/15/721929115.db2.gz JDFZXCASRIRZPC-UHFFFAOYSA-N 1 1 421.589 3.123 20 0 HGADMO [O-][n+]1ccc(C(F)(F)N2CCC3(CC[N@@H+](Cc4cccnc4)C3)CC2)cc1Cl ZINC001164961308 722025044 /nfs/dbraw/zinc/02/50/44/722025044.db2.gz MSSBXVLLWFWHJM-UHFFFAOYSA-N 1 1 408.880 3.406 20 0 HGADMO Clc1nc2c(c(N3CCC4(CC3)COCC[N@@H+](Cc3ccncc3)C4)n1)CCC2 ZINC001164958014 722053381 /nfs/dbraw/zinc/05/33/81/722053381.db2.gz AAWGRUTVQZOCPV-UHFFFAOYSA-N 1 1 413.953 3.133 20 0 HGADMO Clc1nnc(N2CCC3(CC2)COCC[N@@H+](Cc2ccncc2)C3)c2ncccc12 ZINC001164962224 722056451 /nfs/dbraw/zinc/05/64/51/722056451.db2.gz BQDUYXZTURRGQL-UHFFFAOYSA-N 1 1 424.936 3.192 20 0 HGADMO CCC[N@H+]1CCCC[C@H]1c1ccc(N2CCO[C@@]3(CCCN(C(C)=O)C3)C2)nc1 ZINC001164969097 722084168 /nfs/dbraw/zinc/08/41/68/722084168.db2.gz JVEZIXNXELHDBM-JTHBVZDNSA-N 1 1 400.567 3.236 20 0 HGADMO FC(F)(c1ccc(Cl)nc1)N1CC[C@H]2C[N@@H+](Cc3cccnc3)CCO[C@H]2C1 ZINC001164981352 722098642 /nfs/dbraw/zinc/09/86/42/722098642.db2.gz LDPSFBSEVXSMBQ-WMZOPIPTSA-N 1 1 408.880 3.402 20 0 HGADMO Clc1ccnc2cc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)ncc12 ZINC001164971854 722113966 /nfs/dbraw/zinc/11/39/66/722113966.db2.gz CRRZQASFVTUBEB-DYESRHJHSA-N 1 1 409.921 3.406 20 0 HGADMO CCOc1cc(Cl)nc(N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)c1 ZINC001164981531 722114735 /nfs/dbraw/zinc/11/47/35/722114735.db2.gz ULVPKFUMFIWVRM-MJGOQNOKSA-N 1 1 402.926 3.256 20 0 HGADMO Clc1ccnc2nc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)ccc12 ZINC001164977296 722125735 /nfs/dbraw/zinc/12/57/35/722125735.db2.gz MMTIRQRAWBTOFV-XLIONFOSSA-N 1 1 409.921 3.406 20 0 HGADMO CCCN(CCC)c1cncc(N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)n1 ZINC001164983834 722131239 /nfs/dbraw/zinc/13/12/39/722131239.db2.gz VNEPVHRWHPIXTC-YADHBBJMSA-N 1 1 424.593 3.225 20 0 HGADMO COc1ccc2ccnc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)c2c1 ZINC001164974125 722134051 /nfs/dbraw/zinc/13/40/51/722134051.db2.gz CJLGOQXLUZOFCS-NFBKMPQASA-N 1 1 404.514 3.366 20 0 HGADMO CC(C)n1ccc2c1ncnc2N1CC[C@H]2C[N@@H+](Cc3cccnc3)CCO[C@@H]2C1 ZINC001164978884 722136600 /nfs/dbraw/zinc/13/66/00/722136600.db2.gz KHWUULDLYNDEBK-PZJWPPBQSA-N 1 1 406.534 3.135 20 0 HGADMO Clc1nc2c(nc1N1CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C1)CCCC2 ZINC001164975279 722157117 /nfs/dbraw/zinc/15/71/17/722157117.db2.gz QUKISTNIOSXOIB-XLIONFOSSA-N 1 1 413.953 3.131 20 0 HGADMO CN1CCN(c2cccc(N3CCC[C@]4(CC[N@@H+]4Cc4cccc(F)c4)C3)n2)CC1 ZINC001164995941 722203573 /nfs/dbraw/zinc/20/35/73/722203573.db2.gz QEXBFAZPMFIGSE-DEOSSOPVSA-N 1 1 409.553 3.217 20 0 HGADMO CN1CCN(c2cccc(N3CCC[C@]4(CC[N@H+]4Cc4cccc(F)c4)C3)n2)CC1 ZINC001164995941 722203577 /nfs/dbraw/zinc/20/35/77/722203577.db2.gz QEXBFAZPMFIGSE-DEOSSOPVSA-N 1 1 409.553 3.217 20 0 HGADMO Fc1cccc(C[N@H+]2CC[C@]23CCCN(c2cc(N4CCSCC4)ncn2)C3)c1 ZINC001164997848 722210563 /nfs/dbraw/zinc/21/05/63/722210563.db2.gz SLCSSIDFCUSMER-QFIPXVFZSA-N 1 1 413.566 3.414 20 0 HGADMO C[NH+]1CCN(c2ncnc3c2CCN(c2nccc4cc(Cl)ccc42)CC3)CC1 ZINC001164998052 722232254 /nfs/dbraw/zinc/23/22/54/722232254.db2.gz VIRBOJLGFRNSEP-UHFFFAOYSA-N 1 1 408.937 3.035 20 0 HGADMO C[C@@](CO)(Cc1ccccc1F)[NH2+]Cc1nc2sc3c(c2c(N)n1)CCCC3 ZINC001176587217 1126149734 /nfs/dbraw/zinc/14/97/34/1126149734.db2.gz HMMPLMDDZINWJX-NRFANRHFSA-N 1 1 400.523 3.375 20 0 HGADMO OC[C@]1([NH2+]Cc2ncn(-c3ccccc3)n2)CCc2cc(Br)ccc2C1 ZINC001307927644 1126162040 /nfs/dbraw/zinc/16/20/40/1126162040.db2.gz FBPBBBUZJOOUCB-FQEVSTJZSA-N 1 1 413.319 3.039 20 0 HGADMO COc1ccc(C[C@](C)(CO)[NH2+]Cc2nc(-c3cc(F)c(F)c(F)c3)no2)cc1 ZINC001460854952 1126192170 /nfs/dbraw/zinc/19/21/70/1126192170.db2.gz AXBSLCQLCWMEIM-HXUWFJFHSA-N 1 1 407.392 3.246 20 0 HGADMO CS(=O)(=O)c1ccc(Cl)nc1N1CCC[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]21 ZINC001164621786 719094727 /nfs/dbraw/zinc/09/47/27/719094727.db2.gz AUFYDSOKYXQZJE-SJORKVTESA-N 1 1 405.951 3.239 20 0 HGADMO CS(=O)(=O)c1ccc(Cl)nc1N1CCC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21 ZINC001164621786 719094731 /nfs/dbraw/zinc/09/47/31/719094731.db2.gz AUFYDSOKYXQZJE-SJORKVTESA-N 1 1 405.951 3.239 20 0 HGADMO CC(C)n1nc(C[NH+](C)C)c2c1CN(c1ncccc1C(=O)N1CCCCC1)CC2 ZINC001164650255 719307478 /nfs/dbraw/zinc/30/74/78/719307478.db2.gz ZXJIGSGTKODPAF-UHFFFAOYSA-N 1 1 410.566 3.109 20 0 HGADMO CSc1nc2c(c(N3CCc4c(C[NH+](C)C)nn(C(C)C)c4C3)n1)CCCC2 ZINC001164648712 719310226 /nfs/dbraw/zinc/31/02/26/719310226.db2.gz KRLGUIJPUAZCMT-UHFFFAOYSA-N 1 1 400.596 3.479 20 0 HGADMO Cc1oncc1C(=O)N[C@@H]1C[N@@H+](C(C)(C)c2ccnc(Cl)c2)C[C@@H]2CCCO[C@H]12 ZINC001164654548 719321270 /nfs/dbraw/zinc/32/12/70/719321270.db2.gz RLSMWHVOWVMAIK-YJLNNSPDSA-N 1 1 418.925 3.176 20 0 HGADMO Cc1oncc1C(=O)N[C@@H]1C[N@H+](C(C)(C)c2ccnc(Cl)c2)C[C@@H]2CCCO[C@H]12 ZINC001164654548 719321274 /nfs/dbraw/zinc/32/12/74/719321274.db2.gz RLSMWHVOWVMAIK-YJLNNSPDSA-N 1 1 418.925 3.176 20 0 HGADMO C[N@H+]1CCO[C@H]2CN(c3cc(-c4ccc(Cl)nc4)ccc3C3OCCCO3)C[C@@H]21 ZINC001164666472 719421245 /nfs/dbraw/zinc/42/12/45/719421245.db2.gz CVTLCPRRTIXQSD-PMACEKPBSA-N 1 1 415.921 3.357 20 0 HGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2C[C@H](C(=O)N3CCCC3)C[C@H]3OCC[C@@H]32)nc1 ZINC001164679417 719545309 /nfs/dbraw/zinc/54/53/09/719545309.db2.gz ZXSOFUJDVQGBFG-YUMYIRISSA-N 1 1 412.578 3.235 20 0 HGADMO CNC(=O)C[N@H+]1CCCC12CCN(C(F)(F)c1ccc3nc(Cl)cnc3c1)CC2 ZINC001164681772 719716046 /nfs/dbraw/zinc/71/60/46/719716046.db2.gz AHOIKWVKMQXTEP-UHFFFAOYSA-N 1 1 423.895 3.009 20 0 HGADMO CCOC(=O)c1nccnc1N1CCC2(CCC[N@H+]2Cc2csc(C)n2)CC1 ZINC001164694470 719808598 /nfs/dbraw/zinc/80/85/98/719808598.db2.gz YNWPEOSAKYSYGG-UHFFFAOYSA-N 1 1 401.536 3.053 20 0 HGADMO COC(=O)c1nc(Cl)cnc1N1CCC2(CCC[N@H+]2Cc2csc(C)n2)CC1 ZINC001164692552 719808967 /nfs/dbraw/zinc/80/89/67/719808967.db2.gz IZZUQUIAOISSTO-UHFFFAOYSA-N 1 1 421.954 3.317 20 0 HGADMO COC(=O)[C@]1(C)C[C@@H]([NH+]2CCOCC2)CCN1c1nccc2ccc(Cl)cc21 ZINC001164705847 719849372 /nfs/dbraw/zinc/84/93/72/719849372.db2.gz WDHGSHUOIFSAHC-UWJYYQICSA-N 1 1 403.910 3.121 20 0 HGADMO COC(=O)[C@@]1(C)C[C@@H]([NH+]2CCOCC2)CCN1c1nccc2c(Cl)cccc21 ZINC001164702938 719852747 /nfs/dbraw/zinc/85/27/47/719852747.db2.gz OHVBTQNHVIEJTD-YCRPNKLZSA-N 1 1 403.910 3.121 20 0 HGADMO COC(=O)[C@@]1(C)C[C@@H]([NH+]2CCOCC2)CCN1c1nc(Cl)cc2ccc(C)cc21 ZINC001164700570 719861819 /nfs/dbraw/zinc/86/18/19/719861819.db2.gz ICTJGUOMJOCDEU-HTAPYJJXSA-N 1 1 417.937 3.429 20 0 HGADMO COC(=O)[C@@]1(C)C[C@@H]([NH+]2CCOCC2)CCN1c1nccc2cc(F)c(Cl)cc21 ZINC001164702333 719876030 /nfs/dbraw/zinc/87/60/30/719876030.db2.gz IIZAFSLONMKFIB-YCRPNKLZSA-N 1 1 421.900 3.260 20 0 HGADMO COC(=O)[C@@]1(C)C[C@@H]([NH+]2CCOCC2)CCN1c1cc(Cl)nc2c(F)cccc12 ZINC001164705369 719878229 /nfs/dbraw/zinc/87/82/29/719878229.db2.gz YKLSPHPAILEOTE-LHSJRXKWSA-N 1 1 421.900 3.260 20 0 HGADMO COC(=O)[C@@]1(C)C[C@H]([NH+]2CCOCC2)CCN1c1nc(Cl)cc2cccc(F)c21 ZINC001164700830 719880610 /nfs/dbraw/zinc/88/06/10/719880610.db2.gz MJKGSIPLIMVSSK-QVKFZJNVSA-N 1 1 421.900 3.260 20 0 HGADMO c1csc(C[N@H+]2CCOC3(CCN(c4cc(N5CCCCC5)ncn4)CC3)C2)c1 ZINC001164697710 719897702 /nfs/dbraw/zinc/89/77/02/719897702.db2.gz NXFRHPQHXUWXBT-UHFFFAOYSA-N 1 1 413.591 3.400 20 0 HGADMO c1csc(C[N@H+]2CCOC3(CCN(c4cc(-c5ccncc5)ncn4)CC3)C2)c1 ZINC001164705882 719899666 /nfs/dbraw/zinc/89/96/66/719899666.db2.gz FCZOERYCDYYMMZ-UHFFFAOYSA-N 1 1 407.543 3.472 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(C(F)(F)c1nc(C)cc(Cl)n1)C2 ZINC001164808468 720074607 /nfs/dbraw/zinc/07/46/07/720074607.db2.gz HNKACJFYGKLUHU-YJBOKZPZSA-N 1 1 400.901 3.168 20 0 HGADMO COCc1cc(N2CC[C@@]3(C2)C[N@H+](CC2CC2)C[C@@H]3COC)nc(-c2ccccc2)n1 ZINC001164810389 720076381 /nfs/dbraw/zinc/07/63/81/720076381.db2.gz LMFCQEQRKIMCOL-BWKNWUBXSA-N 1 1 422.573 3.475 20 0 HGADMO CCN(CC)Cc1nc2sc(C)c(C)c2c(-n2nc(COC)c3c2C[NH2+]C3)n1 ZINC001164709418 720078713 /nfs/dbraw/zinc/07/87/13/720078713.db2.gz DWENUFMQKRAFSM-UHFFFAOYSA-N 1 1 400.552 3.085 20 0 HGADMO CCN(C)c1cc(C)nc(N2CCC3(C[C@@H](COC)[N@H+](Cc4ccccn4)C3)CC2)n1 ZINC001164709980 720093410 /nfs/dbraw/zinc/09/34/10/720093410.db2.gz DRISRFXXVHCRMF-NRFANRHFSA-N 1 1 424.593 3.144 20 0 HGADMO CCN(C)c1cc(C)nc(N2CCC3(C[C@@H](COC)[N@@H+](Cc4ccccn4)C3)CC2)n1 ZINC001164709980 720093415 /nfs/dbraw/zinc/09/34/15/720093415.db2.gz DRISRFXXVHCRMF-NRFANRHFSA-N 1 1 424.593 3.144 20 0 HGADMO COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1ncnc3cnc(F)cc31)CC2 ZINC001164719062 720107228 /nfs/dbraw/zinc/10/72/28/720107228.db2.gz VBVBZIAIGHFWHW-GOSISDBHSA-N 1 1 422.508 3.066 20 0 HGADMO C=C(OCC)c1ccc(N2CCC3(C[C@H](COC)[N@@H+](Cc4ccccn4)C3)CC2)nn1 ZINC001164716963 720117811 /nfs/dbraw/zinc/11/78/11/720117811.db2.gz MLNLVASTSKHQKL-OAQYLSRUSA-N 1 1 423.561 3.386 20 0 HGADMO COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1nc(C)cc(SC)n1)CC2 ZINC001164714259 720117992 /nfs/dbraw/zinc/11/79/92/720117992.db2.gz BFOLJDSDARPDDL-IBGZPJMESA-N 1 1 413.591 3.409 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(C(F)(F)c1cnc(Cl)cc1N)C2 ZINC001164811564 720121449 /nfs/dbraw/zinc/12/14/49/720121449.db2.gz MLZBNHPZGAMDTQ-RDTXWAMCSA-N 1 1 400.901 3.047 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1nc(Cl)nc3sc(C)nc31)C2 ZINC001164813121 720124345 /nfs/dbraw/zinc/12/43/45/720124345.db2.gz PPJBPLAGXSPWEI-AUUYWEPGSA-N 1 1 407.971 3.233 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(C(F)(F)c1ccc(OC)c(Cl)n1)C2 ZINC001164813328 720127384 /nfs/dbraw/zinc/12/73/84/720127384.db2.gz QGGKXGJLJAQRHW-DNVCBOLYSA-N 1 1 415.912 3.473 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(C(F)(F)c1cc(N)cc(Cl)n1)C2 ZINC001164816229 720129395 /nfs/dbraw/zinc/12/93/95/720129395.db2.gz YOLYTZNMKNFIEW-KBXCAEBGSA-N 1 1 400.901 3.047 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(C(F)(F)c1cc(N)cc(Cl)n1)C2 ZINC001164816231 720129980 /nfs/dbraw/zinc/12/99/80/720129980.db2.gz YOLYTZNMKNFIEW-KSSFIOAISA-N 1 1 400.901 3.047 20 0 HGADMO CCOC(=O)c1c(C)cc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COC)nc1C ZINC001164816161 720132598 /nfs/dbraw/zinc/13/25/98/720132598.db2.gz XZPFRTWTTYDDDO-AUSIDOKSSA-N 1 1 401.551 3.060 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(C(F)(F)c1nc(C)c(C)c(Cl)n1)C2 ZINC001164807976 720138317 /nfs/dbraw/zinc/13/83/17/720138317.db2.gz DHUROJZGNLXOGU-APWZRJJASA-N 1 1 414.928 3.476 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1nc3ccccc3cc1C(=O)OC)C2 ZINC001164815423 720142020 /nfs/dbraw/zinc/14/20/20/720142020.db2.gz VNVKHJGKHNPUGO-NTKDMRAZSA-N 1 1 409.530 3.206 20 0 HGADMO COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1ccc(Cl)c(N)n1)CC2 ZINC001164715631 720156861 /nfs/dbraw/zinc/15/68/61/720156861.db2.gz VMCFAGPTIFIUSS-KRWDZBQOSA-N 1 1 401.942 3.220 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1cc3ccc(C(=O)OC)cc3cn1)C2 ZINC001164814392 720158093 /nfs/dbraw/zinc/15/80/93/720158093.db2.gz GBUDRJJXJCXYIR-QPPBQGQZSA-N 1 1 409.530 3.206 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1nc3ccccc3nc1N1CCCC1)C2 ZINC001164817424 720160051 /nfs/dbraw/zinc/16/00/51/720160051.db2.gz PIOMHQPAUZOWKR-CJFMBICVSA-N 1 1 421.589 3.415 20 0 HGADMO CC(C)[N@@H+](C)Cc1cc(=O)n2c(n1)CN(c1nc(C(C)(C)C)nc3[nH]ccc31)CCC2 ZINC001164812335 720232027 /nfs/dbraw/zinc/23/20/27/720232027.db2.gz FSYBLLAGSOJVFL-UHFFFAOYSA-N 1 1 423.565 3.063 20 0 HGADMO CC(C)[N@@H+](C)Cc1cc(=O)n2c(n1)CN(c1nccnc1Oc1ccccc1)CCC2 ZINC001164814627 720241525 /nfs/dbraw/zinc/24/15/25/720241525.db2.gz ZQKIYGSOOMPPHV-UHFFFAOYSA-N 1 1 420.517 3.076 20 0 HGADMO Cc1cc2ncnc(N3CCCn4c(=O)cc(C[N@H+](C)C(C)C)nc4C3)c2cc1C ZINC001164818248 720244067 /nfs/dbraw/zinc/24/40/67/720244067.db2.gz XPYIZJZAWPLVBO-UHFFFAOYSA-N 1 1 406.534 3.054 20 0 HGADMO CC(C)[N@@H+](C)Cc1cc(=O)n2c(n1)CN(c1nc(C3CCC3)nc3[nH]ccc31)CCC2 ZINC001164817462 720247787 /nfs/dbraw/zinc/24/77/87/720247787.db2.gz RITSIUHBBCMEFO-UHFFFAOYSA-N 1 1 421.549 3.033 20 0 HGADMO CCOC(=O)c1nc2ccccc2c(N2CC[C@@H]3[C@@H]2CC[N@H+]3Cc2cccnc2)n1 ZINC001164726644 720340811 /nfs/dbraw/zinc/34/08/11/720340811.db2.gz QTIUWCQPZBUDMP-UXHICEINSA-N 1 1 403.486 3.055 20 0 HGADMO O=C(NCc1ccccc1)c1cccnc1N1CC[C@@H]2[C@@H]1CC[N@H+]2Cc1cccnc1 ZINC001164729818 720342820 /nfs/dbraw/zinc/34/28/20/720342820.db2.gz YIRQRCWYTQYXOM-PKTZIBPZSA-N 1 1 413.525 3.260 20 0 HGADMO COC(=O)c1cc(Cl)ncc1C(F)(F)N1CC[C@@H]2[C@H]1CC[N@@H+]2Cc1cccnc1 ZINC001164731028 720369219 /nfs/dbraw/zinc/36/92/19/720369219.db2.gz YEEFQVQFKRHHHK-IAGOWNOFSA-N 1 1 422.863 3.315 20 0 HGADMO COC(=O)c1cc(Cl)ncc1C(F)(F)N1CC[C@@H]2[C@H]1CC[N@H+]2Cc1cccnc1 ZINC001164731028 720369229 /nfs/dbraw/zinc/36/92/29/720369229.db2.gz YEEFQVQFKRHHHK-IAGOWNOFSA-N 1 1 422.863 3.315 20 0 HGADMO COC(=O)c1nc(Cl)ccc1C(F)(F)N1CC[C@H]2[C@H]1CC[N@@H+]2Cc1cccnc1 ZINC001164723163 720377038 /nfs/dbraw/zinc/37/70/38/720377038.db2.gz GIFOSUJRVWUQEI-JKSUJKDBSA-N 1 1 422.863 3.315 20 0 HGADMO COC(=O)c1nc(Cl)ccc1C(F)(F)N1CC[C@H]2[C@H]1CC[N@H+]2Cc1cccnc1 ZINC001164723163 720377040 /nfs/dbraw/zinc/37/70/40/720377040.db2.gz GIFOSUJRVWUQEI-JKSUJKDBSA-N 1 1 422.863 3.315 20 0 HGADMO CCN(CC)C(=O)c1cc(Cl)nc(N2CC[C@@H]3[C@@H]2CC[N@H+]3Cc2cccnc2)c1 ZINC001164731312 720395555 /nfs/dbraw/zinc/39/55/55/720395555.db2.gz ZCBVOBMYAUTLJQ-MOPGFXCFSA-N 1 1 413.953 3.465 20 0 HGADMO FC(F)(c1ccc2ncnc(Cl)c2n1)N1CC[C@@H]2[C@@H]1CC[N@@H+]2Cc1cccnc1 ZINC001164723938 720403956 /nfs/dbraw/zinc/40/39/56/720403956.db2.gz IGZOUXIWRODKIA-CVEARBPZSA-N 1 1 416.863 3.471 20 0 HGADMO FC(F)(c1ccc2ncnc(Cl)c2n1)N1CC[C@@H]2[C@@H]1CC[N@H+]2Cc1cccnc1 ZINC001164723938 720403959 /nfs/dbraw/zinc/40/39/59/720403959.db2.gz IGZOUXIWRODKIA-CVEARBPZSA-N 1 1 416.863 3.471 20 0 HGADMO COc1ccc(OC)c(-c2ccc(N3CC[C@H]4[C@@H]3CC[N@H+]4Cc3cccnc3)nn2)c1 ZINC001164735043 720457193 /nfs/dbraw/zinc/45/71/93/720457193.db2.gz VEMXZXBXEVZYMF-VXKWHMMOSA-N 1 1 417.513 3.409 20 0 HGADMO CCOC(=O)c1ccc(N2CC[C@@H]3[C@H](C[C@H](Cn4cccn4)[N@H+]3C(C)C)C2)nc1C ZINC001164836017 720507859 /nfs/dbraw/zinc/50/78/59/720507859.db2.gz LNVFLVANXJIWIQ-SFHLNBCPSA-N 1 1 411.550 3.141 20 0 HGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@H]2CN(c3nccc(N4CCCCC4)n3)CC[C@@H]21 ZINC001164837397 720569179 /nfs/dbraw/zinc/56/91/79/720569179.db2.gz MGVXQIBBNXAMLL-ACRUOGEOSA-N 1 1 409.582 3.041 20 0 HGADMO CC(C)[N@@H+]1[C@@H]2CCN(c3nccc(-c4cccnc4F)n3)C[C@H]2C[C@H]1Cn1cccn1 ZINC001164841416 720572401 /nfs/dbraw/zinc/57/24/01/720572401.db2.gz VFGUEUQLABXACX-LVCYWYKZSA-N 1 1 421.524 3.252 20 0 HGADMO COC(OC)c1cc(C)cnc1N1CC[C@@H]2[C@@H](C[C@H](Cn3cccn3)[N@H+]2C(C)C)C1 ZINC001164843525 720582751 /nfs/dbraw/zinc/58/27/51/720582751.db2.gz XSPNSLIFWXATEU-QKNQBKEWSA-N 1 1 413.566 3.256 20 0 HGADMO Cc1noc(-c2ccnc(N3CC[C@@H]4[C@H](C[C@@H](Cn5cccn5)[N@@H+]4C(C)C)C3)c2)n1 ZINC001164842898 720613230 /nfs/dbraw/zinc/61/32/30/720613230.db2.gz WGDBCWBMIFAXAN-HSALFYBXSA-N 1 1 407.522 3.014 20 0 HGADMO CC(C)[N@@H+]1[C@@H]2CCN(c3cc(N4CCC[C@@H](C)C4)ncn3)C[C@@H]2C[C@H]1Cn1cccn1 ZINC001164836248 720625222 /nfs/dbraw/zinc/62/52/22/720625222.db2.gz FNPIOQHVEOSFQR-CLAROIROSA-N 1 1 423.609 3.287 20 0 HGADMO FC(F)(c1cnc(Cl)cc1Cl)N1CC[N@@H+]2C[C@@H](Oc3cncnc3)C[C@@H]2C1 ZINC001164743801 720626957 /nfs/dbraw/zinc/62/69/57/720626957.db2.gz QTZZDPNKCNTZBM-NEPJUHHUSA-N 1 1 416.259 3.065 20 0 HGADMO FC(F)(c1cnc(Cl)cc1Cl)N1CC[N@H+]2C[C@@H](Oc3cncnc3)C[C@@H]2C1 ZINC001164743801 720626963 /nfs/dbraw/zinc/62/69/63/720626963.db2.gz QTZZDPNKCNTZBM-NEPJUHHUSA-N 1 1 416.259 3.065 20 0 HGADMO FC(F)(c1cnc(Cl)cc1Cl)N1CC[N@@H+]2C[C@@H](Oc3cncnc3)C[C@H]2C1 ZINC001164743803 720628836 /nfs/dbraw/zinc/62/88/36/720628836.db2.gz QTZZDPNKCNTZBM-RYUDHWBXSA-N 1 1 416.259 3.065 20 0 HGADMO FC(F)(c1cnc(Cl)cc1Cl)N1CC[N@H+]2C[C@@H](Oc3cncnc3)C[C@H]2C1 ZINC001164743803 720628838 /nfs/dbraw/zinc/62/88/38/720628838.db2.gz QTZZDPNKCNTZBM-RYUDHWBXSA-N 1 1 416.259 3.065 20 0 HGADMO CC(C)OC(=O)c1cccnc1N1CC[C@@H]2[C@@H](C[C@@H](Cn3cccn3)[N@H+]2C(C)C)C1 ZINC001164835183 720636827 /nfs/dbraw/zinc/63/68/27/720636827.db2.gz AMEVVDWEWHTWDK-IRFCIJBXSA-N 1 1 411.550 3.221 20 0 HGADMO COC(=O)c1cnc(N2CCC3(C[C@@H]([N@@H+](C)Cc4ccccc4)CO3)CC2)c(C)c1 ZINC001164842639 720679870 /nfs/dbraw/zinc/67/98/70/720679870.db2.gz LXZNBKJJMSRNGJ-OAQYLSRUSA-N 1 1 409.530 3.437 20 0 HGADMO Clc1cccc2c1nc(Cl)nc2N1CC[N@H+]2C[C@@H](Oc3cncnc3)C[C@H]2C1 ZINC001164742033 720683152 /nfs/dbraw/zinc/68/31/52/720683152.db2.gz VLTQBIZZYKXHFY-STQMWFEESA-N 1 1 417.300 3.069 20 0 HGADMO c1ccc(-c2nc(N3CC[N@@H+]4C[C@H](Oc5cncnc5)C[C@H]4C3)nc3ccccc32)cc1 ZINC001164739302 720689324 /nfs/dbraw/zinc/68/93/24/720689324.db2.gz MVZXXMKFDXWLKA-VQTJNVASSA-N 1 1 424.508 3.429 20 0 HGADMO CCOC(=O)c1c(C)ncnc1N1CCC2(C[C@H]([N@@H+](C)Cc3ccccc3)CO2)CC1 ZINC001164842684 720693612 /nfs/dbraw/zinc/69/36/12/720693612.db2.gz MOEBQUUOWWBCLC-FQEVSTJZSA-N 1 1 424.545 3.222 20 0 HGADMO C[N@@H+](Cc1ccccc1)[C@@H]1COC2(C1)CCN(c1cc(-c3nnco3)ccn1)CC2 ZINC001164840347 720718459 /nfs/dbraw/zinc/71/84/59/720718459.db2.gz PRASDNSXBXYCDJ-FQEVSTJZSA-N 1 1 405.502 3.392 20 0 HGADMO CCCCOc1cnc(N2CC[N@H+]3C[C@H](Oc4cncnc4)C[C@H]3C2)c(Cl)c1 ZINC001164739010 720745284 /nfs/dbraw/zinc/74/52/84/720745284.db2.gz HMFLRRJXFFTFGV-DOTOQJQBSA-N 1 1 403.914 3.046 20 0 HGADMO CCCCOc1cnc(N2CC[N@H+]3C[C@H](Oc4cncnc4)C[C@@H]3C2)c(Cl)c1 ZINC001164739011 720746109 /nfs/dbraw/zinc/74/61/09/720746109.db2.gz HMFLRRJXFFTFGV-NVXWUHKLSA-N 1 1 403.914 3.046 20 0 HGADMO FC(F)(c1cnc(Cl)c(C2CC2)c1)N1CC[N@@H+]2C[C@@H](Oc3cncnc3)C[C@H]2C1 ZINC001164751145 720806768 /nfs/dbraw/zinc/80/67/68/720806768.db2.gz WZNBKRUNMLKMQB-HOTGVXAUSA-N 1 1 421.879 3.289 20 0 HGADMO FC(F)(c1cnc(Cl)c(C2CC2)c1)N1CC[N@H+]2C[C@@H](Oc3cncnc3)C[C@H]2C1 ZINC001164751145 720806769 /nfs/dbraw/zinc/80/67/69/720806769.db2.gz WZNBKRUNMLKMQB-HOTGVXAUSA-N 1 1 421.879 3.289 20 0 HGADMO Clc1cnc(N2CC[C@@H]3[C@@H](C[C@@H](Cn4cncn4)[N@H+]3CC3CC3)C2)c(Cl)c1 ZINC001164748308 720811289 /nfs/dbraw/zinc/81/12/89/720811289.db2.gz QQGGKTVPXXGHHL-QILLFSRXSA-N 1 1 407.349 3.359 20 0 HGADMO c1ncn(C[C@H]2C[C@H]3CN(c4ccnc(-c5ccccc5)n4)CC[C@H]3[N@H+]2CC2CC2)n1 ZINC001164741254 720816191 /nfs/dbraw/zinc/81/61/91/720816191.db2.gz MSIQJITYWLUIRT-BHDDXSALSA-N 1 1 415.545 3.115 20 0 HGADMO Cc1nc2cc(F)ccc2c(N2CC[C@@H]3[C@@H](C[C@@H](Cn4cncn4)[N@H+]3CC3CC3)C2)n1 ZINC001164737654 720820247 /nfs/dbraw/zinc/82/02/47/720820247.db2.gz BHBAKFSPIQKXCJ-LQBOVUBWSA-N 1 1 421.524 3.048 20 0 HGADMO Clc1cc(N2CC[C@@H]3[C@@H](C[C@@H](Cn4cncn4)[N@H+]3CC3CC3)C2)c2c(n1)CCC2 ZINC001164740267 720820259 /nfs/dbraw/zinc/82/02/59/720820259.db2.gz JYMHCCIHLJUOHF-ABSDTBQOSA-N 1 1 412.969 3.195 20 0 HGADMO COc1ccc2nc(N3CC[C@@H]4[C@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)ccc2c1 ZINC001164743296 720822317 /nfs/dbraw/zinc/82/23/17/720822317.db2.gz RYCHOCSVWXXLHA-TXTKFYIRSA-N 1 1 418.545 3.214 20 0 HGADMO Clc1ccc2nc(N3CC[C@@H]4[C@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)cnc2c1 ZINC001164740695 720823198 /nfs/dbraw/zinc/82/31/98/720823198.db2.gz KRUFUBVFLXKJAA-HGHGUNKESA-N 1 1 423.952 3.254 20 0 HGADMO CCOc1cc(Cl)nc(N2CC[C@@H]3[C@H](C[C@H](Cn4cncn4)[N@H+]3CC3CC3)C2)c1 ZINC001164746108 720826975 /nfs/dbraw/zinc/82/69/75/720826975.db2.gz XYLVJYKYMNNOJR-ZHALLVOQSA-N 1 1 416.957 3.105 20 0 HGADMO F[C@H](c1ccnc(Cl)c1)N1CC[C@@H]2[C@@H](C[C@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164744637 720827697 /nfs/dbraw/zinc/82/76/97/720827697.db2.gz VPYSRWBOKQBMCC-XFKSJGNHSA-N 1 1 404.921 3.170 20 0 HGADMO Fc1cnc(N2CC[C@@H]3[C@H](C[C@H](Cn4cncn4)[N@H+]3CC3CC3)C2)c2ccccc12 ZINC001164738464 720830626 /nfs/dbraw/zinc/83/06/26/720830626.db2.gz FXDIEVDQHJQGQQ-JBYIUTFZSA-N 1 1 406.509 3.345 20 0 HGADMO Fc1ccc2ccnc(N3CC[C@@H]4[C@@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)c2c1 ZINC001164737368 720830807 /nfs/dbraw/zinc/83/08/07/720830807.db2.gz AKGXXJMTXDBSJY-RCZSKKKRSA-N 1 1 406.509 3.345 20 0 HGADMO Clc1ccc2cnc(N3CC[C@@H]4[C@@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)nc2c1 ZINC001164748753 720834110 /nfs/dbraw/zinc/83/41/10/720834110.db2.gz UVMFJQWIOLVYCN-HFSMHLIXSA-N 1 1 423.952 3.254 20 0 HGADMO COCC[N@H+]1CCO[C@@H]2CN(C(F)(F)c3cc(Cl)nc(Cl)c3)CC[C@H]2C1 ZINC001164857745 720835556 /nfs/dbraw/zinc/83/55/56/720835556.db2.gz YPEMSKRMVZJCSV-GXTWGEPZSA-N 1 1 410.292 3.107 20 0 HGADMO Clc1cc2cc[nH]c2nc1N1CC[C@@H]2[C@H](C[C@@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164741150 720835632 /nfs/dbraw/zinc/83/56/32/720835632.db2.gz DGUOBVABMMREBP-ZIFCJYIRSA-N 1 1 411.941 3.139 20 0 HGADMO Clc1cc2cc[nH]c2nc1N1CC[C@@H]2[C@@H](C[C@@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164741144 720835670 /nfs/dbraw/zinc/83/56/70/720835670.db2.gz DGUOBVABMMREBP-JENIJYKNSA-N 1 1 411.941 3.139 20 0 HGADMO COCC[N@H+]1CCO[C@H]2CN(C(F)(F)c3cc(Cl)ncc3Cl)CC[C@H]2C1 ZINC001164855176 720836011 /nfs/dbraw/zinc/83/60/11/720836011.db2.gz SVCHRITVJOKSDO-WFASDCNBSA-N 1 1 410.292 3.107 20 0 HGADMO c1ncn(C[C@H]2C[C@H]3CN(c4cnc(-c5ccccc5)cn4)CC[C@H]3[N@H+]2CC2CC2)n1 ZINC001164750374 720847006 /nfs/dbraw/zinc/84/70/06/720847006.db2.gz XJHXYWZBPPIXIZ-QZNHQXDQSA-N 1 1 415.545 3.115 20 0 HGADMO COCC[N@H+]1CCO[C@@H]2CN(c3nc4ccc(Cl)cc4nc3Cl)CC[C@H]2C1 ZINC001164851409 720848126 /nfs/dbraw/zinc/84/81/26/720848126.db2.gz GWZBQWJHLPYDRU-SUMWQHHRSA-N 1 1 411.333 3.110 20 0 HGADMO COCC[N@H+]1CCO[C@@H]2CN(c3nc4ccc(Cl)cc4nc3Cl)CC[C@@H]2C1 ZINC001164851403 720848132 /nfs/dbraw/zinc/84/81/32/720848132.db2.gz GWZBQWJHLPYDRU-CXAGYDPISA-N 1 1 411.333 3.110 20 0 HGADMO COCC[N@H+]1CCO[C@H]2CN(c3nc4cc(C)c(C)cc4nc3Cl)CC[C@@H]2C1 ZINC001164853514 720864170 /nfs/dbraw/zinc/86/41/70/720864170.db2.gz GVVPICRSWYSWTF-APWZRJJASA-N 1 1 404.942 3.074 20 0 HGADMO COCC[N@H+]1CCO[C@@H]2CN(c3cncc(Sc4cccc(C)c4)n3)CC[C@@H]2C1 ZINC001164860274 720869183 /nfs/dbraw/zinc/86/91/83/720869183.db2.gz WEFLGGXFHJEMCV-UYAOXDASSA-N 1 1 414.575 3.110 20 0 HGADMO COCC[N@H+]1CCO[C@H]2CN(C(F)(F)c3cc(SC)cnc3Cl)CC[C@@H]2C1 ZINC001164861377 720871499 /nfs/dbraw/zinc/87/14/99/720871499.db2.gz XTYSYISYVKRTIZ-CJNGLKHVSA-N 1 1 421.941 3.175 20 0 HGADMO COCC[N@H+]1CCO[C@@H]2CN(c3cc(C(C)(C)C)nc(C(C)(C)C)n3)CC[C@@H]2C1 ZINC001164863098 720873442 /nfs/dbraw/zinc/87/34/42/720873442.db2.gz SNJXKOPMMXYZBQ-QZTJIDSGSA-N 1 1 404.599 3.245 20 0 HGADMO COCC[N@H+]1CCO[C@H]2CN(c3nc(C)nc4sc5c(c43)CCCC5)CC[C@H]2C1 ZINC001164852950 720873757 /nfs/dbraw/zinc/87/37/57/720873757.db2.gz AREQQEACDCQVDM-WMZOPIPTSA-N 1 1 416.591 3.052 20 0 HGADMO COCC[N@H+]1CCO[C@@H]2CN(c3ccc(-c4cccc5ccccc54)nn3)CC[C@H]2C1 ZINC001164853902 720881872 /nfs/dbraw/zinc/88/18/72/720881872.db2.gz DSOMWAUEEZCXPL-GBXCKJPGSA-N 1 1 418.541 3.470 20 0 HGADMO Cc1cc(C)c(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COCc2cccnc2)nn1 ZINC001164757865 720881976 /nfs/dbraw/zinc/88/19/76/720881976.db2.gz VXUZAPCYIIWCGR-UPVQGACJSA-N 1 1 407.562 3.244 20 0 HGADMO CCc1nccnc1N1CC[C@]2(C1)C[N@@H+](CC1CC1)C[C@@H]2COCc1cccnc1 ZINC001164752568 720886803 /nfs/dbraw/zinc/88/68/03/720886803.db2.gz FDUQZEHPKDRMQZ-ZJSXRUAMSA-N 1 1 407.562 3.189 20 0 HGADMO COCC[N@H+]1CCO[C@H]2CN(C(F)(F)C3(c4ccc(Cl)nc4)CC3)CC[C@@H]2C1 ZINC001164853893 720890644 /nfs/dbraw/zinc/89/06/44/720890644.db2.gz DORVCCKVFIABPX-WBVHZDCISA-N 1 1 415.912 3.029 20 0 HGADMO CCc1cc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COCc2cccnc2)ncn1 ZINC001164750616 720915108 /nfs/dbraw/zinc/91/51/08/720915108.db2.gz JXXIHVKRMXBGEJ-QPPBQGQZSA-N 1 1 407.562 3.189 20 0 HGADMO c1cncc(COC[C@@H]2C[N@@H+](CC3CC3)C[C@@]23CCN(c2cc4c(nn2)CCC4)C3)c1 ZINC001164747949 720929219 /nfs/dbraw/zinc/92/92/19/720929219.db2.gz FAADHLXQEPNGCG-WIOPSUGQSA-N 1 1 419.573 3.115 20 0 HGADMO CCOC(=O)c1cnc(C2CC2)nc1N1CCn2c(C[N@@H+](C)C(C)C)cnc2[C@H]1C ZINC001164863438 720961226 /nfs/dbraw/zinc/96/12/26/720961226.db2.gz ZYOVWPNXRPSIQD-OAHLLOKOSA-N 1 1 412.538 3.149 20 0 HGADMO CCOC(=O)c1ccc2ncnc(N3CCn4c(C[N@@H+](C)C(C)C)cnc4[C@H]3C)c2c1 ZINC001164861473 720962377 /nfs/dbraw/zinc/96/23/77/720962377.db2.gz SQPRTTOGVGVHFW-MRXNPFEDSA-N 1 1 422.533 3.424 20 0 HGADMO CC(C)[N@@H+](C)Cc1cnc2n1CCN(c1nccc(C(=O)OC(C)(C)C)n1)[C@H]2C ZINC001164861737 720972898 /nfs/dbraw/zinc/97/28/98/720972898.db2.gz QOGQUOCUIAHRAH-HNNXBMFYSA-N 1 1 400.527 3.050 20 0 HGADMO CCOC(=O)c1cnc2cc(N3CCn4c(C[N@H+](C)C(C)C)cnc4[C@@H]3C)[nH]cc1-2 ZINC001164856358 720996941 /nfs/dbraw/zinc/99/69/41/720996941.db2.gz BWFHWKBSEBWUMP-HNNXBMFYSA-N 1 1 410.522 3.358 20 0 HGADMO CCOC(=O)c1cnc2cc(N3CCn4c(C[N@@H+](C)C(C)C)cnc4[C@@H]3C)[nH]cc1-2 ZINC001164856358 720996949 /nfs/dbraw/zinc/99/69/49/720996949.db2.gz BWFHWKBSEBWUMP-HNNXBMFYSA-N 1 1 410.522 3.358 20 0 HGADMO CCOC(=O)c1c[nH]c2cc(N3CCn4c(CN(C)C(C)C)cnc4[C@@H]3C)[nH+]cc21 ZINC001164856358 720996953 /nfs/dbraw/zinc/99/69/53/720996953.db2.gz BWFHWKBSEBWUMP-HNNXBMFYSA-N 1 1 410.522 3.358 20 0 HGADMO Clc1nnc(N2CC[N@H+]3C[C@H](OCc4cccnc4)C[C@H]3C2)c2sccc21 ZINC001164866043 721065049 /nfs/dbraw/zinc/06/50/49/721065049.db2.gz BXOAOACGAZETRB-LSDHHAIUSA-N 1 1 401.923 3.219 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4nc(Cl)nc5ccc(F)cc54)C[C@@H]3C2)cn1 ZINC001164771186 721083886 /nfs/dbraw/zinc/08/38/86/721083886.db2.gz ROEOECVOWDPORR-CABCVRRESA-N 1 1 400.889 3.114 20 0 HGADMO Cc1ccc2c(c1)nc(Cl)nc2N1CC[N@H+]2C[C@H](OCc3cccnc3)C[C@@H]2C1 ZINC001164867738 721091640 /nfs/dbraw/zinc/09/16/40/721091640.db2.gz ZUITZFORKIZSNK-QZTJIDSGSA-N 1 1 409.921 3.466 20 0 HGADMO CCc1c(Cl)nnc(N2CC[N@H+]3C[C@@H](OCc4cccnc4)C[C@H]3C2)c1CC ZINC001164865764 721093434 /nfs/dbraw/zinc/09/34/34/721093434.db2.gz PHDKRSVTTQTSCM-IRXDYDNUSA-N 1 1 401.942 3.130 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4nccnc4C4SCCCS4)C[C@H]3C2)cn1 ZINC001164770581 721104468 /nfs/dbraw/zinc/10/44/68/721104468.db2.gz RAJIKPMEZLJXLP-IAGOWNOFSA-N 1 1 416.620 3.037 20 0 HGADMO CCOC(=O)c1cc(N2C[C@@H]3CC[N@@H+](Cc4cnn(C)c4)C[C@H]3C2)nc2ccccc21 ZINC001164769011 721125066 /nfs/dbraw/zinc/12/50/66/721125066.db2.gz OTYGXKRIBRHWFM-OALUTQOASA-N 1 1 419.529 3.103 20 0 HGADMO COc1cccc(-c2ccc(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@H]4C3)nn2)c1 ZINC001164874454 721148264 /nfs/dbraw/zinc/14/82/64/721148264.db2.gz KAVLYCLGXKQUAQ-UNMCSNQZSA-N 1 1 417.513 3.027 20 0 HGADMO Cc1cc(N2CC[N@H+]3C[C@H](OCc4cccnc4)C[C@H]3C2)nc(-c2ccsc2)n1 ZINC001164875296 721160322 /nfs/dbraw/zinc/16/03/22/721160322.db2.gz KTQCVGRJUYTFEF-VQTJNVASSA-N 1 1 407.543 3.388 20 0 HGADMO Cc1cc(N2CC[N@H+]3C[C@@H](OCc4cccnc4)C[C@H]3C2)nc(-c2ccsc2)n1 ZINC001164875291 721160425 /nfs/dbraw/zinc/16/04/25/721160425.db2.gz KTQCVGRJUYTFEF-PMACEKPBSA-N 1 1 407.543 3.388 20 0 HGADMO Fc1cccc(F)c1-c1ccc(N2CC[N@H+]3C[C@H](OCc4cccnc4)C[C@H]3C2)nn1 ZINC001164879057 721163532 /nfs/dbraw/zinc/16/35/32/721163532.db2.gz ROTJYRKVKMHVOY-ZWKOTPCHSA-N 1 1 423.467 3.297 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(C(F)(F)c4cc5cc[nH]c5c(Cl)n4)C[C@@H]3C2)cn1 ZINC001164762667 721180590 /nfs/dbraw/zinc/18/05/90/721180590.db2.gz DDCWLNDHBACGHT-HOTGVXAUSA-N 1 1 420.895 3.453 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4cc(-c5nc(C(C)(C)C)no5)ccn4)C[C@H]3C2)cn1 ZINC001164774422 721183079 /nfs/dbraw/zinc/18/30/79/721183079.db2.gz ZAWZSNFKYYRHDO-RBUKOAKNSA-N 1 1 421.549 3.121 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4cc(-c5nc(C(C)(C)C)no5)ccn4)C[C@H]3C2)cn1 ZINC001164774424 721183881 /nfs/dbraw/zinc/18/38/81/721183881.db2.gz ZAWZSNFKYYRHDO-RTBURBONSA-N 1 1 421.549 3.121 20 0 HGADMO CCc1nc(Cl)nc(Cl)c1N1CC[N@H+]2C[C@H](OCc3cccnc3)C[C@@H]2C1 ZINC001164866460 721184037 /nfs/dbraw/zinc/18/40/37/721184037.db2.gz AXJJTHLDXBMCGQ-HUUCEWRRSA-N 1 1 408.333 3.221 20 0 HGADMO Fc1cnc(N2CC[N@H+]3C[C@@H](OCc4cccnc4)C[C@H]3C2)nc1-c1ccsc1 ZINC001164870288 721184138 /nfs/dbraw/zinc/18/41/38/721184138.db2.gz CJBNUGFBCGWHPA-ROUUACIJSA-N 1 1 411.506 3.219 20 0 HGADMO Fc1ccc2c(c1)[nH]c1ncnc(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@@H]4C3)c21 ZINC001164870841 721192383 /nfs/dbraw/zinc/19/23/83/721192383.db2.gz WOSAMWLMNYOFQO-MSOLQXFVSA-N 1 1 418.476 3.125 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4cc(-c5cccc(Cl)c5)ncn4)C[C@H]3C2)cn1 ZINC001164773856 721209668 /nfs/dbraw/zinc/20/96/68/721209668.db2.gz XMCHNJGYTSENCQ-RBUKOAKNSA-N 1 1 408.937 3.489 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4ncccc4OCc4ccc(F)cc4)C[C@@H]3C2)cn1 ZINC001164770884 721215961 /nfs/dbraw/zinc/21/59/61/721215961.db2.gz PALARRALXAMTLW-SFTDATJTSA-N 1 1 421.520 3.492 20 0 HGADMO CCc1ccc(-c2ccc(N3C[C@@H]4CC[N@@H+](Cc5cnn(C)c5)C[C@@H]4C3)nn2)cc1 ZINC001164769545 721216203 /nfs/dbraw/zinc/21/62/03/721216203.db2.gz MSZMVIRSZKXETF-FCHUYYIVSA-N 1 1 402.546 3.398 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4cc(SCc5ccccc5)ncn4)C[C@H]3C2)cn1 ZINC001164769134 721223737 /nfs/dbraw/zinc/22/37/37/721223737.db2.gz LTHOJZYGUHIPQB-NHCUHLMSSA-N 1 1 420.586 3.461 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4nc(C(F)F)nc5ccc(F)cc54)C[C@@H]3C2)cn1 ZINC001164766741 721230811 /nfs/dbraw/zinc/23/08/11/721230811.db2.gz VIGIBSHMTZSSDW-GJZGRUSLSA-N 1 1 416.451 3.398 20 0 HGADMO CC(C)(c1ccnc(Cl)c1)[NH+]1C[C@@H]2CN(S(=O)(=O)c3ccccc3)C[C@H]2C1 ZINC001164876900 721310184 /nfs/dbraw/zinc/31/01/84/721310184.db2.gz GZHMIKLHOKFRFX-HZPDHXFCSA-N 1 1 405.951 3.223 20 0 HGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@@]2(CCCN(c3nc(C)cc(Cl)n3)C2)C1 ZINC001164777978 721332913 /nfs/dbraw/zinc/33/29/13/721332913.db2.gz RSCVJHPFSBAGSK-FQEVSTJZSA-N 1 1 405.930 3.162 20 0 HGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@@]2(CCCN(c3nc(C)cc(Cl)n3)C2)C1 ZINC001164777978 721332914 /nfs/dbraw/zinc/33/29/14/721332914.db2.gz RSCVJHPFSBAGSK-FQEVSTJZSA-N 1 1 405.930 3.162 20 0 HGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@]2(CCCN(c3cc(-c4ncc[nH]4)ccn3)C2)C1 ZINC001164787077 721361064 /nfs/dbraw/zinc/36/10/64/721361064.db2.gz YLNJECGXVQMVAP-HSZRJFAPSA-N 1 1 422.533 3.196 20 0 HGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@]2(CCCN(c3cc(-c4ncc[nH]4)ccn3)C2)C1 ZINC001164787077 721361067 /nfs/dbraw/zinc/36/10/67/721361067.db2.gz YLNJECGXVQMVAP-HSZRJFAPSA-N 1 1 422.533 3.196 20 0 HGADMO COc1cc(C)cnc1N1CCC[C@]2(C1)COCC[N@H+](Cc1c(C)noc1C)C2 ZINC001164783021 721361470 /nfs/dbraw/zinc/36/14/70/721361470.db2.gz OWEVCTZFYSFBSE-QFIPXVFZSA-N 1 1 400.523 3.122 20 0 HGADMO COc1cc(C)cnc1N1CCC[C@]2(C1)COCC[N@@H+](Cc1c(C)noc1C)C2 ZINC001164783021 721361475 /nfs/dbraw/zinc/36/14/75/721361475.db2.gz OWEVCTZFYSFBSE-QFIPXVFZSA-N 1 1 400.523 3.122 20 0 HGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@]2(CCCN(c3cnc4c(n3)CCCC4)C2)C1 ZINC001164782307 721372177 /nfs/dbraw/zinc/37/21/77/721372177.db2.gz MVCQKXLXVLJMSZ-HSZRJFAPSA-N 1 1 411.550 3.079 20 0 HGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@]2(CCCN(c3cnc4c(n3)CCCC4)C2)C1 ZINC001164782307 721372180 /nfs/dbraw/zinc/37/21/80/721372180.db2.gz MVCQKXLXVLJMSZ-HSZRJFAPSA-N 1 1 411.550 3.079 20 0 HGADMO CCC[N@H+]1CCCC[C@@H]1c1ccc(N2CC[C@@]3(CC(=O)N(c4cnn(C)c4)C3)C2)nc1 ZINC001164886605 721373335 /nfs/dbraw/zinc/37/33/35/721373335.db2.gz MOEBWCDFPYGWAK-ZJSXRUAMSA-N 1 1 422.577 3.386 20 0 HGADMO CCc1cc(CC)nc(N2CCC[C@]3(C2)COCC[N@H+](Cc2c(C)noc2C)C3)n1 ZINC001164785365 721375469 /nfs/dbraw/zinc/37/54/69/721375469.db2.gz ROXDMTWAFWLBIF-QHCPKHFHSA-N 1 1 413.566 3.325 20 0 HGADMO CCc1cc(CC)nc(N2CCC[C@]3(C2)COCC[N@@H+](Cc2c(C)noc2C)C3)n1 ZINC001164785365 721375476 /nfs/dbraw/zinc/37/54/76/721375476.db2.gz ROXDMTWAFWLBIF-QHCPKHFHSA-N 1 1 413.566 3.325 20 0 HGADMO COc1ccc2nc(N3CC[C@@]4(C3)CCC[C@@H](CN3CC[NH+](C)CC3)O4)c(C)cc2c1 ZINC001164887129 721381203 /nfs/dbraw/zinc/38/12/03/721381203.db2.gz HAKMCMFAEIVXEN-WIOPSUGQSA-N 1 1 424.589 3.317 20 0 HGADMO COc1ccc2nc(N3CC[C@@]4(C3)CCC[C@H](CN3CC[NH+](C)CC3)O4)ccc2c1 ZINC001164890968 721401438 /nfs/dbraw/zinc/40/14/38/721401438.db2.gz UUGYKAGAZRSWAH-ZJSXRUAMSA-N 1 1 410.562 3.009 20 0 HGADMO CC(C)(C)NC(=O)c1cc(Cl)nc(N2C[C@@H]3C[N@@H+](Cc4nccs4)C[C@@H]3C2)c1 ZINC001164781749 721414908 /nfs/dbraw/zinc/41/49/08/721414908.db2.gz DSQQJMLPKFGWJC-GASCZTMLSA-N 1 1 419.982 3.288 20 0 HGADMO CC(C)(C)NC(=O)c1cc(Cl)nc(N2C[C@@H]3C[N@H+](Cc4nccs4)C[C@@H]3C2)c1 ZINC001164781749 721414912 /nfs/dbraw/zinc/41/49/12/721414912.db2.gz DSQQJMLPKFGWJC-GASCZTMLSA-N 1 1 419.982 3.288 20 0 HGADMO Cc1nc(N2CC[C@]3(C2)CCC[C@H](CN2CC[NH+](C)CC2)O3)c(Cl)cc1Cl ZINC001164893126 721428335 /nfs/dbraw/zinc/42/83/35/721428335.db2.gz JBWMCRYMTYXGMG-UZLBHIALSA-N 1 1 413.393 3.462 20 0 HGADMO Cc1c[nH]c2nc(Cl)cc(N3CC[C@]4(C3)CCC[C@H](CN3CC[NH+](C)CC3)O4)c12 ZINC001164896758 721431380 /nfs/dbraw/zinc/43/13/80/721431380.db2.gz RXABZOJGSYYLLE-VGSWGCGISA-N 1 1 417.985 3.290 20 0 HGADMO Cc1cccc(-c2ccc(N3CC[C@@]4(C3)CCC[C@H](CN3CC[NH+](C)CC3)O4)nn2)c1 ZINC001164898780 721434999 /nfs/dbraw/zinc/43/49/99/721434999.db2.gz WZIZBDBIDAOJSB-RCZVLFRGSA-N 1 1 421.589 3.217 20 0 HGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1cc(C)nc(SC)n1)CC2 ZINC001164790139 721448623 /nfs/dbraw/zinc/44/86/23/721448623.db2.gz WZTPTMYDBMHCDU-IBGZPJMESA-N 1 1 420.623 3.241 20 0 HGADMO CCCc1cncnc1N1CCC2(C[C@@H](COCC3CC3)[N@@H+](CCOC)C2)CC1 ZINC001164789837 721458387 /nfs/dbraw/zinc/45/83/87/721458387.db2.gz XQKHYJLPFSYGBI-NRFANRHFSA-N 1 1 402.583 3.163 20 0 HGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1ccc3cccnc3n1)CC2 ZINC001164784673 721458490 /nfs/dbraw/zinc/45/84/90/721458490.db2.gz JMDCGSUMTJWINJ-NRFANRHFSA-N 1 1 410.562 3.364 20 0 HGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1cc3ccccc3nn1)CC2 ZINC001164785486 721460465 /nfs/dbraw/zinc/46/04/65/721460465.db2.gz LMFGRULSMYQGGI-OAQYLSRUSA-N 1 1 410.562 3.364 20 0 HGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1ncnc3cc(C)[nH]c31)CC2 ZINC001164784639 721461762 /nfs/dbraw/zinc/46/17/62/721461762.db2.gz JBIXTNKDGBTAIV-LJQANCHMSA-N 1 1 413.566 3.000 20 0 HGADMO COC(=O)c1cnc(Cl)cc1N1CC[N@H+]2C[C@H](Oc3cccc(F)c3)C[C@@H]2C1 ZINC001164900259 721511067 /nfs/dbraw/zinc/51/10/67/721511067.db2.gz PGBGVPIUZUOMIM-GDBMZVCRSA-N 1 1 405.857 3.003 20 0 HGADMO Fc1cccc(O[C@H]2C[C@@H]3CN(c4nc(Cl)nc5c4CCCC5)CC[N@H+]3C2)c1 ZINC001164901348 721520623 /nfs/dbraw/zinc/52/06/23/721520623.db2.gz WPOSTCZNXGKJGG-WBVHZDCISA-N 1 1 402.901 3.490 20 0 HGADMO Fc1cccc(O[C@@H]2C[C@H]3CN(c4nnc(Cl)c5c4CCCC5)CC[N@H+]3C2)c1 ZINC001164903481 721530336 /nfs/dbraw/zinc/53/03/36/721530336.db2.gz CZPYLHOLKLCNHH-DOTOQJQBSA-N 1 1 402.901 3.490 20 0 HGADMO CC(C)(C)NC(=O)c1ccc(N2CC[N@H+]3C[C@@H](Oc4cccc(F)c4)C[C@@H]3C2)nc1 ZINC001164904723 721535365 /nfs/dbraw/zinc/53/53/65/721535365.db2.gz GBYGUXCSQMWERI-QUCCMNQESA-N 1 1 412.509 3.091 20 0 HGADMO Cc1nc2ccc(F)cc2c(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@@H]32)n1 ZINC001164806590 721541327 /nfs/dbraw/zinc/54/13/27/721541327.db2.gz OWHZGGUAIQPLPJ-FDFHNCONSA-N 1 1 407.493 3.341 20 0 HGADMO Cc1nc2cc(F)ccc2c(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@H]3OCCC[C@H]32)n1 ZINC001164805597 721541396 /nfs/dbraw/zinc/54/13/96/721541396.db2.gz MKVLHEXOWJHGKI-FSSWDIPSSA-N 1 1 407.493 3.341 20 0 HGADMO COc1cc2c(cc1F)ncnc2N1CC[N@H+]2C[C@H](Oc3cccc(F)c3)C[C@@H]2C1 ZINC001164903005 721544407 /nfs/dbraw/zinc/54/44/07/721544407.db2.gz BREFVRDQUUDLGG-NVXWUHKLSA-N 1 1 412.440 3.259 20 0 HGADMO COC(=O)/C=C\c1cc(C)cnc1N1CC[N@H+]2C[C@H](Oc3cccc(F)c3)C[C@@H]2C1 ZINC001164906909 721547647 /nfs/dbraw/zinc/54/76/47/721547647.db2.gz LTMREJWRDKQNLU-RTVDBWQISA-N 1 1 411.477 3.057 20 0 HGADMO C=Cc1nc(Cl)nc(N2CC[N@H+]3C[C@H](Oc4cccc(F)c4)C[C@@H]3C2)c1OC ZINC001164907200 721550804 /nfs/dbraw/zinc/55/08/04/721550804.db2.gz MQSSCENYHDSCIY-GDBMZVCRSA-N 1 1 404.873 3.263 20 0 HGADMO Nc1cc(C(F)(F)N2CC[N@H+]3C[C@H](Oc4cccc(F)c4)C[C@H]3C2)cnc1Cl ZINC001164911400 721551205 /nfs/dbraw/zinc/55/12/05/721551205.db2.gz WQVJDNVXPDLMSF-GOEBONIOSA-N 1 1 412.843 3.343 20 0 HGADMO Fc1cccc(O[C@@H]2C[C@H]3CN(c4ncnc(-c5cccc(F)c5)n4)CC[N@H+]3C2)c1 ZINC001164903522 721557646 /nfs/dbraw/zinc/55/76/46/721557646.db2.gz BZMQVKNGENSJJA-AZUAARDMSA-N 1 1 409.440 3.159 20 0 HGADMO Cc1nc(-c2ccncc2)cc(N2CC[N@H+]3C[C@@H](Oc4cccc(F)c4)C[C@@H]3C2)n1 ZINC001164909706 721558387 /nfs/dbraw/zinc/55/83/87/721558387.db2.gz UPMBTXSAPYDAQD-CTNGQTDRSA-N 1 1 405.477 3.328 20 0 HGADMO COc1cc(C)c2ncnc(N3CC[N@H+]4C[C@H](Oc5cccc(F)c5)C[C@H]4C3)c2c1 ZINC001164903497 721568681 /nfs/dbraw/zinc/56/86/81/721568681.db2.gz BODFJROYDKXBPS-FXAWDEMLSA-N 1 1 408.477 3.428 20 0 HGADMO Cc1cc(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@H]3OCCC[C@@H]32)nc(-c2ccccn2)n1 ZINC001164809837 721575836 /nfs/dbraw/zinc/57/58/36/721575836.db2.gz XMGDGDJFAFACQW-FUDKSRODSA-N 1 1 416.529 3.110 20 0 HGADMO Cc1cc(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@@H]32)nc(-c2ccccn2)n1 ZINC001164809840 721575842 /nfs/dbraw/zinc/57/58/42/721575842.db2.gz XMGDGDJFAFACQW-QNWVGRARSA-N 1 1 416.529 3.110 20 0 HGADMO Cc1cc(C(F)(F)N2C[C@H]([N@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@H]32)c(Cl)nn1 ZINC001164801902 721579976 /nfs/dbraw/zinc/57/99/76/721579976.db2.gz GEXKWNJWULEOHW-FGTMMUONSA-N 1 1 423.895 3.247 20 0 HGADMO Cc1cc(C(F)(F)N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@H]32)c(Cl)nn1 ZINC001164801902 721579978 /nfs/dbraw/zinc/57/99/78/721579978.db2.gz GEXKWNJWULEOHW-FGTMMUONSA-N 1 1 423.895 3.247 20 0 HGADMO CCN(CC)c1cncc(N2CCC(F)(F)[C@@]3(CC[N@@H+](Cc4ccccn4)C3)C2)n1 ZINC001164908546 721716370 /nfs/dbraw/zinc/71/63/70/721716370.db2.gz XSUXESGQJHXIIU-OAQYLSRUSA-N 1 1 416.520 3.456 20 0 HGADMO FC1(F)CCN(c2cc(-c3nnco3)ccn2)C[C@]12CC[N@@H+](Cc1ccccn1)C2 ZINC001164913437 721728598 /nfs/dbraw/zinc/72/85/98/721728598.db2.gz VUFQAXWDDVRTDX-HXUWFJFHSA-N 1 1 412.444 3.264 20 0 HGADMO C[C@H]1CC(=O)Nc2ncnc(N3CCc4c(C[N@H+](C)Cc5ccco5)cncc4C3)c21 ZINC001164909569 721755309 /nfs/dbraw/zinc/75/53/09/721755309.db2.gz IBYSIQQALNYAIJ-HNNXBMFYSA-N 1 1 418.501 3.105 20 0 HGADMO C[C@H]1CC(=O)Nc2ncnc(N3CCc4c(C[N@@H+](C)Cc5ccco5)cncc4C3)c21 ZINC001164909569 721755312 /nfs/dbraw/zinc/75/53/12/721755312.db2.gz IBYSIQQALNYAIJ-HNNXBMFYSA-N 1 1 418.501 3.105 20 0 HGADMO Cc1cn(-c2ccc(N3CCc4c(C[N@H+](C)Cc5ccco5)cncc4C3)nn2)cn1 ZINC001164911277 721758231 /nfs/dbraw/zinc/75/82/31/721758231.db2.gz VAJXNBAHRNECEO-UHFFFAOYSA-N 1 1 415.501 3.153 20 0 HGADMO Cc1cn(-c2ccc(N3CCc4c(C[N@@H+](C)Cc5ccco5)cncc4C3)nn2)cn1 ZINC001164911277 721758235 /nfs/dbraw/zinc/75/82/35/721758235.db2.gz VAJXNBAHRNECEO-UHFFFAOYSA-N 1 1 415.501 3.153 20 0 HGADMO CC[N@H+]1CCCC[C@H]1c1ccc(N2CCC[C@@]3(CCN(c4cncnc4)C3=O)C2)nc1 ZINC001165020198 721785325 /nfs/dbraw/zinc/78/53/25/721785325.db2.gz NJDVHRIQGCBFNH-XUZZJYLKSA-N 1 1 420.561 3.442 20 0 HGADMO C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@H]2CN(c3ncccc3C(=O)N3CCCC3)C[C@H]21 ZINC001165020569 721799091 /nfs/dbraw/zinc/79/90/91/721799091.db2.gz FZZDLOIARUMISI-WWPVKYPJSA-N 1 1 419.573 3.450 20 0 HGADMO CSc1nc(Cl)nc(N2C[C@@H]3CCC[C@@H]([N@@H+](C)Cc4ccccn4)[C@H]3C2)n1 ZINC001165026637 721806813 /nfs/dbraw/zinc/80/68/13/721806813.db2.gz RQKQYULUAKGGBA-CWRNSKLLSA-N 1 1 404.971 3.379 20 0 HGADMO CN(C)c1cc(Cl)nc(N2C[C@@H]3CCC[C@@H]([N@@H+](C)Cc4ccccn4)[C@H]3C2)n1 ZINC001165026862 721814655 /nfs/dbraw/zinc/81/46/55/721814655.db2.gz RUMHQRYCZMWCHB-RYQLBKOJSA-N 1 1 400.958 3.328 20 0 HGADMO COC(=O)c1cc2c[nH]c(N3C[C@@H]4CCC[C@H]([N@@H+](C)Cc5ccccn5)[C@@H]4C3)cc-2n1 ZINC001165025523 721820354 /nfs/dbraw/zinc/82/03/54/721820354.db2.gz NEBBWKQOTVVWCK-NBCNXNJRSA-N 1 1 419.529 3.481 20 0 HGADMO C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@@H]2CN([C@H](F)Oc3cncc(Cl)n3)C[C@H]21 ZINC001165027881 721829286 /nfs/dbraw/zinc/82/92/86/721829286.db2.gz USGXEVOUQMMWOB-OYRIPWCXSA-N 1 1 405.905 3.389 20 0 HGADMO CCS(=O)(=O)c1ccnc(N2C[C@@H]3CCC[C@H]([N@@H+](C)Cc4ccccn4)[C@H]3C2)c1 ZINC001165026107 721832191 /nfs/dbraw/zinc/83/21/91/721832191.db2.gz OEQHBUSWZLXTJG-YYWHXJBOSA-N 1 1 414.575 3.007 20 0 HGADMO CCS(=O)(=O)c1ccnc(N2C[C@@H]3CCC[C@@H]([N@@H+](C)Cc4ccccn4)[C@H]3C2)c1 ZINC001165026096 721832278 /nfs/dbraw/zinc/83/22/78/721832278.db2.gz OEQHBUSWZLXTJG-DZFGPLHGSA-N 1 1 414.575 3.007 20 0 HGADMO CN(C)CC[N@H+]1CC[C@@H]2[C@H]1CCN2c1ccc(-c2ccc(C3OCCCO3)cc2)cn1 ZINC001164923631 721874427 /nfs/dbraw/zinc/87/44/27/721874427.db2.gz JEVAMZGMYJGOPJ-DHIUTWEWSA-N 1 1 422.573 3.399 20 0 HGADMO C[NH+](C)CCN1CC[C@@H]2[C@H]1CCN2c1ccc(-c2ccc(C3OCCCO3)cc2)cn1 ZINC001164923631 721874428 /nfs/dbraw/zinc/87/44/28/721874428.db2.gz JEVAMZGMYJGOPJ-DHIUTWEWSA-N 1 1 422.573 3.399 20 0 HGADMO CN(C)CC[N@@H+]1CC[C@H]2[C@H]1CCN2c1cnc(Cl)nc1Oc1ccccc1F ZINC001164935559 721888361 /nfs/dbraw/zinc/88/83/61/721888361.db2.gz XSPPVCCOVIMWIU-CVEARBPZSA-N 1 1 405.905 3.276 20 0 HGADMO CN(C)CC[N@H+]1CC[C@H]2[C@H]1CCN2c1cnc(Cl)nc1Oc1ccccc1F ZINC001164935559 721888363 /nfs/dbraw/zinc/88/83/63/721888363.db2.gz XSPPVCCOVIMWIU-CVEARBPZSA-N 1 1 405.905 3.276 20 0 HGADMO CCOc1ccc(NS(=O)(=O)c2cccnc2N(C)CC2CC[NH+](C)CC2)cc1 ZINC001165043066 721935984 /nfs/dbraw/zinc/93/59/84/721935984.db2.gz NEYYEKSYWMFCKG-UHFFFAOYSA-N 1 1 418.563 3.059 20 0 HGADMO COc1ccc(OC)c(-c2ccc(N3CC[NH+](CCOc4ccccc4)CC3)nn2)c1 ZINC001165045548 721960546 /nfs/dbraw/zinc/96/05/46/721960546.db2.gz XSMWVGWZJWCBRR-UHFFFAOYSA-N 1 1 420.513 3.362 20 0 HGADMO CC[NH+](CC)Cc1nc2sc(C)c(C)c2c(N2C[C@@H]3COC[C@]3(COC)C2)n1 ZINC001164952351 721994948 /nfs/dbraw/zinc/99/49/48/721994948.db2.gz OQQWPVNMVCXDJW-IIBYNOLFSA-N 1 1 404.580 3.249 20 0 HGADMO COC(=O)c1cc(Cl)nc(N2CCC3(CC[N@@H+](Cc4cccnc4)C3)CC2)c1 ZINC001164954184 722013505 /nfs/dbraw/zinc/01/35/05/722013505.db2.gz JVBNVKJDBLFEAK-UHFFFAOYSA-N 1 1 400.910 3.409 20 0 HGADMO CC(C)(C)NC(=O)c1ccc(Cl)nc1N1CC[NH+](CCc2ccccn2)CC1 ZINC001165055132 722014337 /nfs/dbraw/zinc/01/43/37/722014337.db2.gz FBQDKOPUVMGHRT-UHFFFAOYSA-N 1 1 401.942 3.023 20 0 HGADMO Fc1ccc(Oc2nc(Cl)nc(N3CC[NH+](CCc4ccccn4)CC3)n2)cc1 ZINC001165056261 722014722 /nfs/dbraw/zinc/01/47/22/722014722.db2.gz QXFLGRVBYPOBQF-UHFFFAOYSA-N 1 1 414.872 3.216 20 0 HGADMO CC(C)(C)C(=O)Nc1ccc(N2CCC3(CC[N@@H+](Cc4cccnc4)C3)CC2)nn1 ZINC001164952166 722017852 /nfs/dbraw/zinc/01/78/52/722017852.db2.gz IMBUREFFHKNJFP-UHFFFAOYSA-N 1 1 408.550 3.349 20 0 HGADMO Cc1nc(Cl)nc(N2CCC3(CC2)COCC[N@@H+](Cc2ccncc2)C3)c1C ZINC001164958800 722051506 /nfs/dbraw/zinc/05/15/06/722051506.db2.gz GLJOGFOBBMEJJZ-UHFFFAOYSA-N 1 1 401.942 3.261 20 0 HGADMO Cc1cnc(N2CCC3(CC2)COCC[N@@H+](Cc2ccncc2)C3)nc1NC(C)C ZINC001164959435 722051948 /nfs/dbraw/zinc/05/19/48/722051948.db2.gz JGUVZNHBOUVZKO-UHFFFAOYSA-N 1 1 410.566 3.119 20 0 HGADMO COc1ccc2cnc(N3CCC4(CC3)COCC[N@@H+](Cc3ccncc3)C4)nc2c1 ZINC001164964211 722054276 /nfs/dbraw/zinc/05/42/76/722054276.db2.gz TUXAJEYHZMHJIX-UHFFFAOYSA-N 1 1 419.529 3.152 20 0 HGADMO CSc1cnc(Cl)nc1N1CCC2(CC1)COCC[N@@H+](Cc1ccncc1)C2 ZINC001164963826 722056590 /nfs/dbraw/zinc/05/65/90/722056590.db2.gz MRSXBLLCWZNUNE-UHFFFAOYSA-N 1 1 419.982 3.366 20 0 HGADMO CC(C)(C)OC(=O)c1ccnc(N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)c1 ZINC001164986628 722104423 /nfs/dbraw/zinc/10/44/23/722104423.db2.gz ZQRFUTZOTRQEHF-LEWJYISDSA-N 1 1 424.545 3.159 20 0 HGADMO Clc1ccnc2c1ccnc2N1CC[C@@H]2C[N@@H+](Cc3cccnc3)CCO[C@H]2C1 ZINC001164975479 722104615 /nfs/dbraw/zinc/10/46/15/722104615.db2.gz BZHNETSATLJWKM-XLIONFOSSA-N 1 1 409.921 3.406 20 0 HGADMO FC(F)(Oc1cccc(Cl)n1)N1CC[C@H]2C[N@@H+](Cc3cccnc3)CCO[C@H]2C1 ZINC001164982073 722108904 /nfs/dbraw/zinc/10/89/04/722108904.db2.gz VVPZVEQZUOYGIM-IRXDYDNUSA-N 1 1 424.879 3.282 20 0 HGADMO Clc1cccc2nc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)ncc12 ZINC001164975105 722123786 /nfs/dbraw/zinc/12/37/86/722123786.db2.gz JLCPAMYMXYSYAU-DYESRHJHSA-N 1 1 409.921 3.406 20 0 HGADMO COc1ccc2nc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)nc(C)c2c1 ZINC001164981110 722125619 /nfs/dbraw/zinc/12/56/19/722125619.db2.gz SQUMFKIFJJCENS-CVDCTZTESA-N 1 1 419.529 3.069 20 0 HGADMO COc1ccc2nc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)nc(C)c2c1 ZINC001164981112 722125791 /nfs/dbraw/zinc/12/57/91/722125791.db2.gz SQUMFKIFJJCENS-WMZHIEFXSA-N 1 1 419.529 3.069 20 0 HGADMO Clc1ccc2cnc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)nc2c1 ZINC001164981011 722125867 /nfs/dbraw/zinc/12/58/67/722125867.db2.gz RXZJGVYTNBTKFP-NQIIRXRSSA-N 1 1 409.921 3.406 20 0 HGADMO COc1cc(N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)nc2ccccc21 ZINC001164984644 722132155 /nfs/dbraw/zinc/13/21/55/722132155.db2.gz YEWRKXCHLXULCP-CVDCTZTESA-N 1 1 404.514 3.366 20 0 HGADMO c1ccc(-c2cc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)ncn2)cc1 ZINC001164975160 722138258 /nfs/dbraw/zinc/13/82/58/722138258.db2.gz DXOMFUUHWKYPQT-GMAHTHKFSA-N 1 1 401.514 3.266 20 0 HGADMO Fc1ccc(-c2cc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)ncn2)cc1 ZINC001164984623 722145016 /nfs/dbraw/zinc/14/50/16/722145016.db2.gz XXBFVXASIFJYAM-NFBKMPQASA-N 1 1 419.504 3.405 20 0 HGADMO c1cncc(C[N@H+]2CCO[C@@H]3CN(c4ccc(COC5CCC5)cn4)CC[C@@H]3C2)c1 ZINC001164974800 722151729 /nfs/dbraw/zinc/15/17/29/722151729.db2.gz QRLIEBRMWFLKFT-FYYLOGMGSA-N 1 1 408.546 3.273 20 0 HGADMO COC(=O)c1cc2c(N3CCC[C@@]4(CC[N@H+]4Cc4cccc(F)c4)C3)[nH]cnc-2n1 ZINC001164995313 722194359 /nfs/dbraw/zinc/19/43/59/722194359.db2.gz UILNSYUONKEKNT-JOCHJYFZSA-N 1 1 409.465 3.080 20 0 HGADMO COC(=O)c1cc2c(ncnc2N2CCC[C@@]3(CC[N@@H+]3Cc3cccc(F)c3)C2)[nH]1 ZINC001164995313 722194363 /nfs/dbraw/zinc/19/43/63/722194363.db2.gz UILNSYUONKEKNT-JOCHJYFZSA-N 1 1 409.465 3.080 20 0 HGADMO COC(=O)c1cc2c(ncnc2N2CCC[C@@]3(CC[N@H+]3Cc3cccc(F)c3)C2)[nH]1 ZINC001164995313 722194366 /nfs/dbraw/zinc/19/43/66/722194366.db2.gz UILNSYUONKEKNT-JOCHJYFZSA-N 1 1 409.465 3.080 20 0 HGADMO COc1ccccc1C[C@@](C)(CO)[NH2+]Cc1nc(-c2cc(F)c(F)c(F)c2)no1 ZINC001560102323 1126208116 /nfs/dbraw/zinc/20/81/16/1126208116.db2.gz LAFFMISWJNSEHH-FQEVSTJZSA-N 1 1 407.392 3.246 20 0 HGADMO NC(=O)[C@H](c1ccc(F)cc1)[N@@H+]1C[C@H]2CCC[C@@]2(c2nc(-c3cnccn3)no2)C1 ZINC000328603974 569417160 /nfs/dbraw/zinc/41/71/60/569417160.db2.gz HYTJSTMNHXBPFU-DAESXHAQSA-N 1 1 408.437 3.296 20 0 HGADMO NC(=O)[C@H](c1ccc(F)cc1)[N@H+]1C[C@H]2CCC[C@@]2(c2nc(-c3cnccn3)no2)C1 ZINC000328603974 569417162 /nfs/dbraw/zinc/41/71/62/569417162.db2.gz HYTJSTMNHXBPFU-DAESXHAQSA-N 1 1 408.437 3.296 20 0 HGADMO CC[NH+](CC)Cc1nc2sc(C)c(C)c2c(N2CCC3(CC(=O)CO3)CC2)n1 ZINC001164388645 718827809 /nfs/dbraw/zinc/82/78/09/718827809.db2.gz DAGJRHIIKQPQQZ-UHFFFAOYSA-N 1 1 402.564 3.478 20 0 HGADMO CCOC(=O)c1cnc(SC)nc1N1CCC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]21 ZINC001164620925 719054276 /nfs/dbraw/zinc/05/42/76/719054276.db2.gz HJFBVDNSOQFLMN-IEBWSBKVSA-N 1 1 412.559 3.476 20 0 HGADMO CCOC(=O)c1cc(Cl)nnc1N1CCC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]21 ZINC001164629651 719067009 /nfs/dbraw/zinc/06/70/09/719067009.db2.gz YKQPSIOHIPGYGL-SJLPKXTDSA-N 1 1 400.910 3.408 20 0 HGADMO CCOC(=O)Cc1nc(Cl)cc(N2CCC[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)n1 ZINC001164626806 719074263 /nfs/dbraw/zinc/07/42/63/719074263.db2.gz PJHCZANCBITQRX-ZWKOTPCHSA-N 1 1 414.937 3.336 20 0 HGADMO CCOC(=O)c1ncnc(Cl)c1N1CCC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21 ZINC001164625991 719093159 /nfs/dbraw/zinc/09/31/59/719093159.db2.gz HVOLGXXATQPDKE-SJORKVTESA-N 1 1 400.910 3.408 20 0 HGADMO O=C(NC1CCCC1)c1ccc(N2CCC[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)nn1 ZINC001164629601 719103227 /nfs/dbraw/zinc/10/32/27/719103227.db2.gz SUAZLCYBIQCOMB-SIKLNZKXSA-N 1 1 405.546 3.250 20 0 HGADMO C[C@@H]1C[N@H+](C)[C@H](C)CN1c1cc(NS(=O)(=O)c2ccc(Cl)nc2)ccc1F ZINC001164638427 719244911 /nfs/dbraw/zinc/24/49/11/719244911.db2.gz YVRRNYXBJPLHHK-CHWSQXEVSA-N 1 1 412.918 3.204 20 0 HGADMO C[C@@H]1C[N@@H+](C)[C@H](C)CN1c1cc(NS(=O)(=O)c2ccc(Cl)nc2)ccc1F ZINC001164638427 719244912 /nfs/dbraw/zinc/24/49/12/719244912.db2.gz YVRRNYXBJPLHHK-CHWSQXEVSA-N 1 1 412.918 3.204 20 0 HGADMO COc1cc2ncnc(N3CCc4c(C[NH+](C)C)nn(C(C)C)c4C3)c2cc1OC ZINC001164650112 719308525 /nfs/dbraw/zinc/30/85/25/719308525.db2.gz ZKKWCTCXUPNGLX-UHFFFAOYSA-N 1 1 410.522 3.049 20 0 HGADMO CC(C)n1nc(C[NH+](C)C)c2c1CN(c1cc(OCc3ccccc3)cnn1)CC2 ZINC001164648886 719312143 /nfs/dbraw/zinc/31/21/43/719312143.db2.gz MQXPWHUXGMXLLF-UHFFFAOYSA-N 1 1 406.534 3.457 20 0 HGADMO C[NH+]1CCC(Oc2ccnc(N3CCO[C@@H]4[C@H](OCC5CCCC5)CC[C@H]43)c2)CC1 ZINC001164662104 719344057 /nfs/dbraw/zinc/34/40/57/719344057.db2.gz NEDPXZALSQKJPU-AKFKNWHVSA-N 1 1 415.578 3.498 20 0 HGADMO CC[N@H+]1CCCC[C@H]1c1ccc(N2C[C@H](C(=O)N3CC=CC3)C3(C2)CCOCC3)nc1 ZINC001164678187 719561740 /nfs/dbraw/zinc/56/17/40/719561740.db2.gz VVKOSLJOMUPVES-YADHBBJMSA-N 1 1 424.589 3.260 20 0 HGADMO CNC(=O)C[N@H+]1CCCC12CCN(C(F)(F)c1ccnc(Cl)c1Cl)CC2 ZINC001164686336 719702694 /nfs/dbraw/zinc/70/26/94/719702694.db2.gz ZWHQYVLYDISQTN-UHFFFAOYSA-N 1 1 407.292 3.114 20 0 HGADMO CC(C)N(C)C(=O)c1noc2c1CN(c1nc(Cl)ccc1C[NH+]1CCCC1)CC2 ZINC001164695231 719786259 /nfs/dbraw/zinc/78/62/59/719786259.db2.gz KWEDLYWKFVJQFA-UHFFFAOYSA-N 1 1 417.941 3.362 20 0 HGADMO COC(=O)[C@@]1(C)C[C@@H]([NH+]2CCOCC2)CCN1c1cc(Cl)nc2sccc21 ZINC001164706739 719849517 /nfs/dbraw/zinc/84/95/17/719849517.db2.gz YJNXXPRBVAYPFQ-ORAYPTAESA-N 1 1 409.939 3.182 20 0 HGADMO COC(=O)[C@]1(C)C[C@H]([NH+]2CCOCC2)CCN1c1nccc2ccc(Cl)cc21 ZINC001164705846 719849519 /nfs/dbraw/zinc/84/95/19/719849519.db2.gz WDHGSHUOIFSAHC-UTKZUKDTSA-N 1 1 403.910 3.121 20 0 HGADMO COC(=O)[C@]1(C)C[C@H]([NH+]2CCOCC2)CCN1c1cc(Cl)nc2c(C)csc21 ZINC001164701589 719862414 /nfs/dbraw/zinc/86/24/14/719862414.db2.gz LFUYFFDOVHTCBX-VLIAUNLRSA-N 1 1 423.966 3.491 20 0 HGADMO COC(=O)[C@]1(C)C[C@@H]([NH+]2CCOCC2)CCN1c1nc(Cl)cc2cc(C)ccc21 ZINC001164705080 719862693 /nfs/dbraw/zinc/86/26/93/719862693.db2.gz SQWKRROJFXJNMM-JTSKRJEESA-N 1 1 417.937 3.429 20 0 HGADMO Cc1cc(N2CCCC2)nc(N2CCC3(CC2)CN(Cc2cccs2)CCO3)[nH+]1 ZINC001164698338 719886003 /nfs/dbraw/zinc/88/60/03/719886003.db2.gz FNELYCCWLXYUBM-UHFFFAOYSA-N 1 1 413.591 3.318 20 0 HGADMO COC(=O)c1cnc(N2CCC3(CC2)C[N@@H+](Cc2cccs2)CCO3)c(Cl)c1 ZINC001164702243 719886018 /nfs/dbraw/zinc/88/60/18/719886018.db2.gz PPWDFLBZFGEGCZ-UHFFFAOYSA-N 1 1 421.950 3.455 20 0 HGADMO c1csc(C[N@H+]2CCOC3(CCN(c4nccc(N5CCCCC5)n4)CC3)C2)c1 ZINC001164697517 719895087 /nfs/dbraw/zinc/89/50/87/719895087.db2.gz KMSZFTANWADNKV-UHFFFAOYSA-N 1 1 413.591 3.400 20 0 HGADMO CCOC(=O)c1cc(Cl)nc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COC)c1 ZINC001164815746 720068431 /nfs/dbraw/zinc/06/84/31/720068431.db2.gz ZJNIZJNLZDQCRP-UTKZUKDTSA-N 1 1 407.942 3.096 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(C(F)(F)c1cc(Cl)nc(OC)c1)C2 ZINC001164811400 720079579 /nfs/dbraw/zinc/07/95/79/720079579.db2.gz OGKGWXLTVCNLSA-APWZRJJASA-N 1 1 415.912 3.473 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(C(F)(F)c1cc(Cl)nc(C)n1)C2 ZINC001164808528 720085845 /nfs/dbraw/zinc/08/58/45/720085845.db2.gz HWDMRYAKEDOSMB-MAUKXSAKSA-N 1 1 400.901 3.168 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1ccnc(NC(=O)OC(C)(C)C)n1)C2 ZINC001164814803 720097711 /nfs/dbraw/zinc/09/77/11/720097711.db2.gz WVKFZKAVOWVRGL-VGOFRKELSA-N 1 1 417.554 3.008 20 0 HGADMO COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1nc(C)ccc1C(=O)OC)CC2 ZINC001164711619 720098926 /nfs/dbraw/zinc/09/89/26/720098926.db2.gz RSYZWPYZZWESGR-FQEVSTJZSA-N 1 1 424.545 3.079 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1nc(Cl)nc(-c3ccccc3)n1)C2 ZINC001164806448 720098927 /nfs/dbraw/zinc/09/89/27/720098927.db2.gz CYZWPPSGISUKJF-XMSQKQJNSA-N 1 1 413.953 3.377 20 0 HGADMO CCOC(=O)c1cc(Cl)nc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COC)c1C ZINC001164811584 720113331 /nfs/dbraw/zinc/11/33/31/720113331.db2.gz MOQTTZBEPWQGEY-VGSWGCGISA-N 1 1 421.969 3.405 20 0 HGADMO CCOC(=O)c1cc(Cl)nc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COC)c1C ZINC001164811582 720114161 /nfs/dbraw/zinc/11/41/61/720114161.db2.gz MOQTTZBEPWQGEY-JTSKRJEESA-N 1 1 421.969 3.405 20 0 HGADMO CCOC(=O)c1cnc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COC)c(Cl)c1 ZINC001164808513 720121855 /nfs/dbraw/zinc/12/18/55/720121855.db2.gz FKFOJGMULNEVJF-UWJYYQICSA-N 1 1 407.942 3.096 20 0 HGADMO CCOC(=O)c1cnc(Cl)c(C)c1N1CC[C@@]2(C1)C[N@@H+](CC1CC1)C[C@@H]2COC ZINC001164810593 720128304 /nfs/dbraw/zinc/12/83/04/720128304.db2.gz KGPPEDNHULYZOL-VGSWGCGISA-N 1 1 421.969 3.405 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(C(F)(F)c1ccc(OC)c(Cl)n1)C2 ZINC001164813333 720128374 /nfs/dbraw/zinc/12/83/74/720128374.db2.gz QGGKXGJLJAQRHW-KXBFYZLASA-N 1 1 415.912 3.473 20 0 HGADMO CCCN(CCC)c1cncc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COC)n1 ZINC001164813810 720145581 /nfs/dbraw/zinc/14/55/81/720145581.db2.gz QYQVPDPMMDPTJX-NFBKMPQASA-N 1 1 401.599 3.288 20 0 HGADMO CCCN(CCC)c1cncc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COC)n1 ZINC001164813816 720146333 /nfs/dbraw/zinc/14/63/33/720146333.db2.gz QYQVPDPMMDPTJX-REWPJTCUSA-N 1 1 401.599 3.288 20 0 HGADMO CCOC(=O)c1nc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COC)ccc1Cl ZINC001164815073 720151322 /nfs/dbraw/zinc/15/13/22/720151322.db2.gz HWCQOWSZGLJGGP-HRAATJIYSA-N 1 1 407.942 3.096 20 0 HGADMO COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1ccc(Cl)c(N)n1)CC2 ZINC001164715632 720156480 /nfs/dbraw/zinc/15/64/80/720156480.db2.gz VMCFAGPTIFIUSS-QGZVFWFLSA-N 1 1 401.942 3.220 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1ccc(-c3ccc(OC)cc3)nn1)C2 ZINC001164817197 720164613 /nfs/dbraw/zinc/16/46/13/720164613.db2.gz OTCRJFQTJMZFGJ-YKSBVNFPSA-N 1 1 408.546 3.337 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1nc(C(=O)OC)cc3ccccc31)C2 ZINC001164817829 720174330 /nfs/dbraw/zinc/17/43/30/720174330.db2.gz QIMZVQISFWHHCO-YADARESESA-N 1 1 409.530 3.206 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1nc(-c3cccnc3)nc3c1CCC3)C2 ZINC001164816581 720184751 /nfs/dbraw/zinc/18/47/51/720184751.db2.gz LOGUCLZTIJRCFX-NBGIEHNGSA-N 1 1 419.573 3.212 20 0 HGADMO CC(C)[N@@H+](C)Cc1cc(=O)n2c(n1)CN(C(F)(F)c1ccnc(Cl)c1)CCC2 ZINC001164810237 720211544 /nfs/dbraw/zinc/21/15/44/720211544.db2.gz AQCGWXIGKKFANE-UHFFFAOYSA-N 1 1 411.884 3.087 20 0 HGADMO CC(C)[N@@H+](C)Cc1cc(=O)n2c(n1)CN(c1ccc(-c3cccs3)nn1)CCC2 ZINC001164814550 720228875 /nfs/dbraw/zinc/22/88/75/720228875.db2.gz YALRISDDLUAOOA-UHFFFAOYSA-N 1 1 410.547 3.012 20 0 HGADMO CSc1ccnc(Cl)c1N1CCCn2c(=O)cc(C[N@@H+](C)C(C)C)nc2C1 ZINC001164812859 720229494 /nfs/dbraw/zinc/22/94/94/720229494.db2.gz JRYOIHFBVBZBTD-UHFFFAOYSA-N 1 1 407.971 3.264 20 0 HGADMO O=C(NC1CCCCC1)c1cccnc1N1CC[C@H]2[C@H]1CC[N@H+]2Cc1cccnc1 ZINC001164721716 720340915 /nfs/dbraw/zinc/34/09/15/720340915.db2.gz DBXPIXKMWKATFP-FCHUYYIVSA-N 1 1 405.546 3.392 20 0 HGADMO COC(=O)c1ccc(C(F)(F)N2CC[C@@H]3[C@@H]2CC[N@@H+]3Cc2cccnc2)c(Cl)n1 ZINC001164722116 720377282 /nfs/dbraw/zinc/37/72/82/720377282.db2.gz BXKPGAWBNQLPCN-SJORKVTESA-N 1 1 422.863 3.315 20 0 HGADMO COC(=O)c1ccc(C(F)(F)N2CC[C@@H]3[C@@H]2CC[N@H+]3Cc2cccnc2)c(Cl)n1 ZINC001164722116 720377288 /nfs/dbraw/zinc/37/72/88/720377288.db2.gz BXKPGAWBNQLPCN-SJORKVTESA-N 1 1 422.863 3.315 20 0 HGADMO COc1cc2nc(C)nc(N3CC[C@H]4[C@@H]3CC[N@H+]4Cc3cccnc3)c2cc1OC ZINC001164723735 720386879 /nfs/dbraw/zinc/38/68/79/720386879.db2.gz HDDFPGVWCFZPLG-PMACEKPBSA-N 1 1 405.502 3.204 20 0 HGADMO CCOC(=O)c1cnc(Cl)c(C)c1N1CC[C@@H]2[C@@H]1CC[N@H+]2Cc1cccnc1 ZINC001164725094 720396698 /nfs/dbraw/zinc/39/66/98/720396698.db2.gz LUOQWKBVQOCSIB-MSOLQXFVSA-N 1 1 400.910 3.468 20 0 HGADMO COC(=O)c1cc(Cl)nc(C(F)(F)N2CC[C@@H]3[C@@H]2CC[N@@H+]3Cc2cccnc2)c1 ZINC001164730396 720397393 /nfs/dbraw/zinc/39/73/93/720397393.db2.gz XHODZFVMTASPMG-CVEARBPZSA-N 1 1 422.863 3.315 20 0 HGADMO COC(=O)c1cc(Cl)nc(C(F)(F)N2CC[C@@H]3[C@@H]2CC[N@H+]3Cc2cccnc2)c1 ZINC001164730396 720397397 /nfs/dbraw/zinc/39/73/97/720397397.db2.gz XHODZFVMTASPMG-CVEARBPZSA-N 1 1 422.863 3.315 20 0 HGADMO FC(F)(c1ccc2ncnc(Cl)c2n1)N1CC[C@H]2[C@@H]1CC[N@@H+]2Cc1cccnc1 ZINC001164723948 720403566 /nfs/dbraw/zinc/40/35/66/720403566.db2.gz IGZOUXIWRODKIA-HOTGVXAUSA-N 1 1 416.863 3.471 20 0 HGADMO FC(F)(c1ccc2ncnc(Cl)c2n1)N1CC[C@H]2[C@@H]1CC[N@H+]2Cc1cccnc1 ZINC001164723948 720403582 /nfs/dbraw/zinc/40/35/82/720403582.db2.gz IGZOUXIWRODKIA-HOTGVXAUSA-N 1 1 416.863 3.471 20 0 HGADMO Cc1cc(N2CC[C@@H]3[C@@H]2CC[N@H+]3Cc2cccnc2)nc(NC(=O)c2ccccc2)n1 ZINC001164731657 720465718 /nfs/dbraw/zinc/46/57/18/720465718.db2.gz XGFJKJOPVVWBRA-RTWAWAEBSA-N 1 1 414.513 3.286 20 0 HGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@H]2CN(C(F)(F)c3cc(Cl)ncn3)CC[C@@H]21 ZINC001164838478 720505989 /nfs/dbraw/zinc/50/59/89/720505989.db2.gz RMAXFOWPEOCFRD-JYJNAYRXSA-N 1 1 410.900 3.249 20 0 HGADMO COC(=O)c1cnc(N2CC[C@@H]3[C@@H](C[C@@H](Cn4cccn4)[N@H+]3C(C)C)C2)c(Cl)c1 ZINC001164834739 720506772 /nfs/dbraw/zinc/50/67/72/720506772.db2.gz HKRRJDSDCFYEBB-JENIJYKNSA-N 1 1 417.941 3.096 20 0 HGADMO C[NH+](C)C[C@@H]1Cn2ccnc2CN(c2ccc3c(n2)CCN(Cc2ccccc2)C3)C1 ZINC001164729851 720511258 /nfs/dbraw/zinc/51/12/58/720511258.db2.gz JQSJJRSENXIJSR-OAQYLSRUSA-N 1 1 416.573 3.034 20 0 HGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@@H]2CN(c3nc(Cl)nc4c3CCC4)CC[C@@H]21 ZINC001164840784 720515800 /nfs/dbraw/zinc/51/58/00/720515800.db2.gz XNIQFOCJFAQDEV-GJYPPUQNSA-N 1 1 400.958 3.193 20 0 HGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@@H]2CN(c3nc(Cl)nc4ncccc43)CC[C@@H]21 ZINC001164839435 720517679 /nfs/dbraw/zinc/51/76/79/720517679.db2.gz UJIUINWAKBQVLD-RYRKJORJSA-N 1 1 411.941 3.253 20 0 HGADMO COc1ccc2ncnc(N3CC[C@@H]4[C@H](C[C@@H](Cn5cccn5)[N@H+]4C(C)C)C3)c2c1 ZINC001164837229 720521448 /nfs/dbraw/zinc/52/14/48/720521448.db2.gz OPIDRXWTELBMSF-KGVIQGDOSA-N 1 1 406.534 3.213 20 0 HGADMO CC(C)[N@@H+]1[C@@H]2CCN([C@@H](F)Oc3ccnc(Cl)c3)C[C@H]2C[C@H]1Cn1cccn1 ZINC001164835742 720524210 /nfs/dbraw/zinc/52/42/10/720524210.db2.gz KRIYHGNWVFWDDO-YNVMFWSZSA-N 1 1 407.921 3.437 20 0 HGADMO CC(C)[N@@H+]1[C@@H]2CCN(c3nc(Cl)nc4cnccc43)C[C@@H]2C[C@H]1Cn1cccn1 ZINC001164834914 720527561 /nfs/dbraw/zinc/52/75/61/720527561.db2.gz IFEAFYPKEXZQMK-TXPKVOOTSA-N 1 1 411.941 3.253 20 0 HGADMO COC(=O)c1c(C)cc(C)nc1N1CC[C@@H]2[C@H](C[C@@H](Cn3cccn3)[N@H+]2C(C)C)C1 ZINC001164833740 720540220 /nfs/dbraw/zinc/54/02/20/720540220.db2.gz BMNKJENTPZWOOL-HSALFYBXSA-N 1 1 411.550 3.059 20 0 HGADMO CC(C)[N@@H+]1[C@@H]2CCN([C@H](F)Oc3cccc(Cl)n3)C[C@H]2C[C@H]1Cn1cccn1 ZINC001164836386 720544570 /nfs/dbraw/zinc/54/45/70/720544570.db2.gz JTEQUSWTQGTXOQ-YZLZLFLDSA-N 1 1 407.921 3.437 20 0 HGADMO CC(C)[N@@H+]1[C@@H]2CCN([C@@H](F)Oc3cccc(Cl)n3)C[C@H]2C[C@H]1Cn1cccn1 ZINC001164836381 720544591 /nfs/dbraw/zinc/54/45/91/720544591.db2.gz JTEQUSWTQGTXOQ-AXVVYFOYSA-N 1 1 407.921 3.437 20 0 HGADMO CC(C)[N@@H+]1[C@@H]2CCN([C@@H](F)Oc3ccc(Cl)nc3)C[C@H]2C[C@H]1Cn1cccn1 ZINC001164839553 720544934 /nfs/dbraw/zinc/54/49/34/720544934.db2.gz QMROUIYSHDULJJ-YNVMFWSZSA-N 1 1 407.921 3.437 20 0 HGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@@H]2CN(C(F)(F)c3cnc(Cl)cc3N)CC[C@@H]21 ZINC001164840202 720549115 /nfs/dbraw/zinc/54/91/15/720549115.db2.gz SDGQDIZVPZFYRM-VKJFTORMSA-N 1 1 424.927 3.436 20 0 HGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@H]2CN(c3nnc(Cl)c4ccoc43)CC[C@@H]21 ZINC001164839120 720570594 /nfs/dbraw/zinc/57/05/94/720570594.db2.gz POJYBZMFKMSLNM-ZOBUZTSGSA-N 1 1 400.914 3.451 20 0 HGADMO CC(C)[N@@H+]1[C@@H]2CCN(c3nnc(Cl)c4ccoc43)C[C@@H]2C[C@H]1Cn1cccn1 ZINC001164839118 720570728 /nfs/dbraw/zinc/57/07/28/720570728.db2.gz POJYBZMFKMSLNM-YQQAZPJKSA-N 1 1 400.914 3.451 20 0 HGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@@H]2CN(C(F)(F)c3cncc(Cl)n3)CC[C@@H]21 ZINC001164842233 720581636 /nfs/dbraw/zinc/58/16/36/720581636.db2.gz UUZXTVAPUVNWGE-PMPSAXMXSA-N 1 1 410.900 3.249 20 0 HGADMO FC(F)(c1cnc(Cl)c(Cl)c1)N1CC[N@@H+]2C[C@H](Oc3cncnc3)C[C@@H]2C1 ZINC001164746981 720617269 /nfs/dbraw/zinc/61/72/69/720617269.db2.gz YUZOUNQHQREHBH-CHWSQXEVSA-N 1 1 416.259 3.065 20 0 HGADMO FC(F)(c1cnc(Cl)c(Cl)c1)N1CC[N@H+]2C[C@H](Oc3cncnc3)C[C@@H]2C1 ZINC001164746981 720617290 /nfs/dbraw/zinc/61/72/90/720617290.db2.gz YUZOUNQHQREHBH-CHWSQXEVSA-N 1 1 416.259 3.065 20 0 HGADMO FC(F)(c1cc(Cl)nc(Cl)c1)N1CC[N@@H+]2C[C@@H](Oc3cncnc3)C[C@@H]2C1 ZINC001164746286 720622554 /nfs/dbraw/zinc/62/25/54/720622554.db2.gz WXYFQJZNAZLETI-OLZOCXBDSA-N 1 1 416.259 3.065 20 0 HGADMO FC(F)(c1cc(Cl)nc(Cl)c1)N1CC[N@H+]2C[C@@H](Oc3cncnc3)C[C@@H]2C1 ZINC001164746286 720622561 /nfs/dbraw/zinc/62/25/61/720622561.db2.gz WXYFQJZNAZLETI-OLZOCXBDSA-N 1 1 416.259 3.065 20 0 HGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@H]2CN(c3ccnc(-c4nccs4)n3)CC[C@@H]21 ZINC001164843201 720648484 /nfs/dbraw/zinc/64/84/84/720648484.db2.gz VDZAAXFRFAMZDO-BZSNNMDCSA-N 1 1 409.563 3.174 20 0 HGADMO COc1nc(Cl)cc(N2CCC3(C[C@@H]([N@@H+](C)Cc4ccccc4)CO3)CC2)n1 ZINC001164841907 720662588 /nfs/dbraw/zinc/66/25/88/720662588.db2.gz QXMJBJKMWHGUKS-QGZVFWFLSA-N 1 1 402.926 3.399 20 0 HGADMO CCOC(=O)c1cc(C)nc(N2CCC3(C[C@H]([N@@H+](C)Cc4ccccc4)CO3)CC2)n1 ZINC001164845352 720676700 /nfs/dbraw/zinc/67/67/00/720676700.db2.gz YPGLOLYEPPBGPJ-FQEVSTJZSA-N 1 1 424.545 3.222 20 0 HGADMO Clc1cnc(Cl)c(N2CC[N@@H+]3C[C@@H](Oc4cncnc4)C[C@@H]3C2)c1Cl ZINC001164736830 720705434 /nfs/dbraw/zinc/70/54/34/720705434.db2.gz BKZRKMSQUFPIIC-MNOVXSKESA-N 1 1 400.697 3.174 20 0 HGADMO Clc1cnc(Cl)c(N2CC[N@H+]3C[C@@H](Oc4cncnc4)C[C@@H]3C2)c1Cl ZINC001164736830 720705441 /nfs/dbraw/zinc/70/54/41/720705441.db2.gz BKZRKMSQUFPIIC-MNOVXSKESA-N 1 1 400.697 3.174 20 0 HGADMO CCCNC(=O)c1ccc(N2CCC3(C[C@H]([N@@H+](C)Cc4ccccc4)CO3)CC2)nc1 ZINC001164841587 720713816 /nfs/dbraw/zinc/71/38/16/720713816.db2.gz USPPEXQUSYHHLL-QFIPXVFZSA-N 1 1 422.573 3.481 20 0 HGADMO CC(C)(C)c1cc(N2CC[N@H+]3C[C@@H](Oc4cncnc4)C[C@@H]3C2)nc(C(C)(C)C)n1 ZINC001164737241 720756957 /nfs/dbraw/zinc/75/69/57/720756957.db2.gz BGXXWHTZJITIKF-SJORKVTESA-N 1 1 410.566 3.204 20 0 HGADMO Cc1nc(-c2ccccc2)nc(Cl)c1N1CC[N@H+]2C[C@@H](Oc3cncnc3)C[C@@H]2C1 ZINC001164737158 720772152 /nfs/dbraw/zinc/77/21/52/720772152.db2.gz AEXDROJZAWSSMV-MSOLQXFVSA-N 1 1 422.920 3.237 20 0 HGADMO c1ncn(C[C@H]2C[C@H]3CN(c4ccc(-c5ccccc5)nn4)CC[C@H]3[N@H+]2CC2CC2)n1 ZINC001164738425 720816264 /nfs/dbraw/zinc/81/62/64/720816264.db2.gz FRDRKVKYWSKJSS-QZNHQXDQSA-N 1 1 415.545 3.115 20 0 HGADMO CCOc1cc(Cl)nc(N2CC[C@@H]3[C@@H](C[C@H](Cn4cncn4)[N@H+]3CC3CC3)C2)c1 ZINC001164746105 720826835 /nfs/dbraw/zinc/82/68/35/720826835.db2.gz XYLVJYKYMNNOJR-YQVWRLOYSA-N 1 1 416.957 3.105 20 0 HGADMO Cc1nc(Cl)cc(N2CC[C@@H]3[C@@H](C[C@H](Cn4cncn4)[N@H+]3CC3CC3)C2)c1C ZINC001164748808 720832113 /nfs/dbraw/zinc/83/21/13/720832113.db2.gz UYCDLQYMXYPZML-IPMKNSEASA-N 1 1 400.958 3.323 20 0 HGADMO COCC[N@H+]1CCO[C@@H]2CN(C(F)(F)c3cnc(Cl)c(Cl)c3)CC[C@@H]2C1 ZINC001164852912 720835461 /nfs/dbraw/zinc/83/54/61/720835461.db2.gz MIKTYJAEQXFWPD-IUODEOHRSA-N 1 1 410.292 3.107 20 0 HGADMO CSc1ccnc(Cl)c1N1CC[C@@H]2[C@@H](C[C@@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164746699 720835918 /nfs/dbraw/zinc/83/59/18/720835918.db2.gz PZDVADFMKWXSDM-YESZJQIVSA-N 1 1 418.998 3.428 20 0 HGADMO CC(C)COc1cccc(N2CC[C@@H]3[C@H](C[C@@H](Cn4cncn4)[N@H+]3CC3CC3)C2)n1 ZINC001164748925 720841846 /nfs/dbraw/zinc/84/18/46/720841846.db2.gz VCZCTHRGDJUCDR-QHAWAJNXSA-N 1 1 410.566 3.087 20 0 HGADMO Clc1ccnc2ccc(N3CC[C@@H]4[C@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)nc12 ZINC001164751084 720843031 /nfs/dbraw/zinc/84/30/31/720843031.db2.gz YKJZVVGTTTVZQO-MBOZVWFJSA-N 1 1 423.952 3.254 20 0 HGADMO COCC[N@H+]1CCO[C@H]2CN(c3nc(Cl)cc4c(Cl)ccnc43)CC[C@@H]2C1 ZINC001164854007 720852602 /nfs/dbraw/zinc/85/26/02/720852602.db2.gz HYHFMNMQVVQMFH-CJNGLKHVSA-N 1 1 411.333 3.110 20 0 HGADMO COCC[N@H+]1CCO[C@H]2CN(c3nc(Cl)cc4c(Cl)ccnc43)CC[C@H]2C1 ZINC001164854006 720853056 /nfs/dbraw/zinc/85/30/56/720853056.db2.gz HYHFMNMQVVQMFH-BBRMVZONSA-N 1 1 411.333 3.110 20 0 HGADMO COCC[N@H+]1CCO[C@H]2CN(c3nc(Cl)nc4cc(Cl)ccc43)CC[C@H]2C1 ZINC001164859606 720853892 /nfs/dbraw/zinc/85/38/92/720853892.db2.gz USUBELJHYOPBNQ-GUYCJALGSA-N 1 1 411.333 3.110 20 0 HGADMO COCC[N@H+]1CCO[C@H]2CN(c3nc(Cl)cc4cc(OC)ccc43)CC[C@H]2C1 ZINC001164851964 720865515 /nfs/dbraw/zinc/86/55/15/720865515.db2.gz BILLHZZNFIDPLS-KXBFYZLASA-N 1 1 405.926 3.070 20 0 HGADMO CCOc1cncc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COCc2cccnc2)n1 ZINC001164753932 720868817 /nfs/dbraw/zinc/86/88/17/720868817.db2.gz QKNSQKOWFOGBEN-XUZZJYLKSA-N 1 1 423.561 3.025 20 0 HGADMO COc1cccnc1N1CC[C@@]2(C1)C[N@@H+](CC1CC1)C[C@H]2COCc1cccnc1 ZINC001164747133 720877751 /nfs/dbraw/zinc/87/77/51/720877751.db2.gz ABSYKTWNNYCIFE-URXFXBBRSA-N 1 1 408.546 3.240 20 0 HGADMO COc1cccc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COCc2cccnc2)n1 ZINC001164753499 720877889 /nfs/dbraw/zinc/87/78/89/720877889.db2.gz PQVZCULIIHRDSL-ZJSXRUAMSA-N 1 1 408.546 3.240 20 0 HGADMO COCC[N@H+]1CCO[C@@H]2CN(c3cc(-c4ccc(Cl)nn4)ccc3F)CC[C@@H]2C1 ZINC001164859958 720881410 /nfs/dbraw/zinc/88/14/10/720881410.db2.gz NKKCNBDPBXPBAU-OXQOHEQNSA-N 1 1 420.916 3.110 20 0 HGADMO COCC[N@H+]1CCO[C@H]2CN(c3nc(Cl)cc4cc(F)c(OC)cc43)CC[C@@H]2C1 ZINC001164855959 720893212 /nfs/dbraw/zinc/89/32/12/720893212.db2.gz DSINOWCFLJBYTH-KUHUBIRLSA-N 1 1 423.916 3.209 20 0 HGADMO CCc1ccc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COCc2cccnc2)nn1 ZINC001164758438 720897946 /nfs/dbraw/zinc/89/79/46/720897946.db2.gz YCEWLAWMHUCHBN-ZJSXRUAMSA-N 1 1 407.562 3.189 20 0 HGADMO CC(C)[N@@H+](C)Cc1cnc2n1CCN(c1ncccc1C(=O)N1CCCCC1)[C@@H]2C ZINC001164859805 720928225 /nfs/dbraw/zinc/92/82/25/720928225.db2.gz QAWCNLSLRRAMRB-GOSISDBHSA-N 1 1 410.566 3.326 20 0 HGADMO CCOC(=O)c1nc2ccccc2c(N2CCn3c(C[N@@H+](C)C(C)C)cnc3[C@@H]2C)n1 ZINC001164855544 720930586 /nfs/dbraw/zinc/93/05/86/720930586.db2.gz IJFFNNPQAGKYEU-INIZCTEOSA-N 1 1 422.533 3.424 20 0 HGADMO CC(C)[N@@H+](C)Cc1cnc2n1CCN(c1ncnc3cc4c(cc31)OCCO4)[C@@H]2C ZINC001164860048 720935200 /nfs/dbraw/zinc/93/52/00/720935200.db2.gz PLKATVZPQCQCCW-OAHLLOKOSA-N 1 1 408.506 3.019 20 0 HGADMO FC(F)(c1c[nH]c2nc(Cl)ccc12)N1CCc2[nH+]cc(Cn3cccn3)n2CC1 ZINC001164861461 721032251 /nfs/dbraw/zinc/03/22/51/721032251.db2.gz HPAQSCBLYDAUCG-UHFFFAOYSA-N 1 1 417.851 3.265 20 0 HGADMO Fc1c(Cl)nccc1C(F)(F)N1CC[N@H+]2C[C@H](OCc3cccnc3)C[C@@H]2C1 ZINC001164866267 721050213 /nfs/dbraw/zinc/05/02/13/721050213.db2.gz DJPKINRHZFXSOA-HUUCEWRRSA-N 1 1 412.843 3.294 20 0 HGADMO Clc1nnc(N2CC[N@H+]3C[C@@H](OCc4cccnc4)C[C@H]3C2)c2sccc21 ZINC001164866041 721064688 /nfs/dbraw/zinc/06/46/88/721064688.db2.gz BXOAOACGAZETRB-GJZGRUSLSA-N 1 1 401.923 3.219 20 0 HGADMO Fc1cccc2nc(Cl)nc(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@H]4C3)c12 ZINC001164866859 721072923 /nfs/dbraw/zinc/07/29/23/721072923.db2.gz GJLYGNGPUBMWPE-HOTGVXAUSA-N 1 1 413.884 3.297 20 0 HGADMO Clc1ncnc2scc(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@H]4C3)c21 ZINC001164868925 721074724 /nfs/dbraw/zinc/07/47/24/721074724.db2.gz RFSMMRSLNQZIFH-GJZGRUSLSA-N 1 1 401.923 3.219 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(C(F)(F)c4cnc(Cl)nc4Cl)C[C@H]3C2)cn1 ZINC001164772614 721077793 /nfs/dbraw/zinc/07/77/93/721077793.db2.gz VFWJQXRZNREDML-QWHCGFSZSA-N 1 1 417.291 3.020 20 0 HGADMO Clc1nc2c(c(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@H]4C3)n1)CCCCC2 ZINC001164866968 721082322 /nfs/dbraw/zinc/08/23/22/721082322.db2.gz VRXLBUUMFSVPSS-ROUUACIJSA-N 1 1 413.953 3.274 20 0 HGADMO Cc1cccc2c(Cl)nnc(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@@H]4C3)c12 ZINC001164865999 721083002 /nfs/dbraw/zinc/08/30/02/721083002.db2.gz QXEGMOWBYNGUMF-QZTJIDSGSA-N 1 1 409.921 3.466 20 0 HGADMO Cc1cccc2c(Cl)nnc(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@H]4C3)c12 ZINC001164866000 721083330 /nfs/dbraw/zinc/08/33/30/721083330.db2.gz QXEGMOWBYNGUMF-ROUUACIJSA-N 1 1 409.921 3.466 20 0 HGADMO COc1ccc2nc(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@H]4C3)cc(C)c2c1 ZINC001164867656 721089232 /nfs/dbraw/zinc/08/92/32/721089232.db2.gz ZGMBZBGDLXGTNT-PZJWPPBQSA-N 1 1 404.514 3.427 20 0 HGADMO FC(F)(COc1cccc(Cl)n1)N1CC[N@H+]2C[C@@H](OCc3cccnc3)C[C@H]2C1 ZINC001164864891 721108879 /nfs/dbraw/zinc/10/88/79/721108879.db2.gz HFCUWDMNAFKGLL-IRXDYDNUSA-N 1 1 424.879 3.077 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4nc5cc(F)c(F)cc5nc4Cl)C[C@@H]3C2)cn1 ZINC001164769018 721114010 /nfs/dbraw/zinc/11/40/10/721114010.db2.gz OUCFRDLULAWAEN-KGLIPLIRSA-N 1 1 418.879 3.253 20 0 HGADMO CC(C)(C)c1nc2[nH]ccc2c(N2CC[N@H+]3C[C@@H](OCc4cccnc4)C[C@H]3C2)n1 ZINC001164871559 721127657 /nfs/dbraw/zinc/12/76/57/721127657.db2.gz FGUJSYXNQRRXGH-ROUUACIJSA-N 1 1 406.534 3.130 20 0 HGADMO Cc1ccc(-c2ccc(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@H]4C3)nn2)cc1 ZINC001164880444 721138484 /nfs/dbraw/zinc/13/84/84/721138484.db2.gz WRVPPKWPIFZYTK-VXKWHMMOSA-N 1 1 401.514 3.327 20 0 HGADMO Cc1nc2sc3c(c2c(N2CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@@H]4C2)n1)CCC3 ZINC001164874567 721140705 /nfs/dbraw/zinc/14/07/05/721140705.db2.gz KRRGRCFRGKRRHB-MSOLQXFVSA-N 1 1 421.570 3.363 20 0 HGADMO Fc1ccc(-c2ccc(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@H]4C3)nn2)cc1 ZINC001164874571 721157218 /nfs/dbraw/zinc/15/72/18/721157218.db2.gz KSTDSHGXTKLHFY-LEWJYISDSA-N 1 1 405.477 3.157 20 0 HGADMO Cc1cc(N2CC[N@H+]3C[C@H](OCc4cccnc4)C[C@@H]3C2)nc(-c2ccsc2)n1 ZINC001164875298 721160906 /nfs/dbraw/zinc/16/09/06/721160906.db2.gz KTQCVGRJUYTFEF-WOJBJXKFSA-N 1 1 407.543 3.388 20 0 HGADMO Fc1ccccc1-c1ccc(N2CC[N@H+]3C[C@H](OCc4cccnc4)C[C@@H]3C2)nn1 ZINC001164877636 721162275 /nfs/dbraw/zinc/16/22/75/721162275.db2.gz PJPGKZHWGYNQBH-RTBURBONSA-N 1 1 405.477 3.157 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4ccc(-c5ccccc5Cl)nn4)C[C@H]3C2)cn1 ZINC001164768538 721164203 /nfs/dbraw/zinc/16/42/03/721164203.db2.gz LHGRLKZCVHNGDI-ZWKOTPCHSA-N 1 1 408.937 3.489 20 0 HGADMO Cc1nc(-c2ccccn2)nc(N2CC[N@H+]3C[C@H](OCc4cccnc4)C[C@@H]3C2)c1C ZINC001164880343 721167383 /nfs/dbraw/zinc/16/73/83/721167383.db2.gz WAANWLNKPDVCSZ-NHCUHLMSSA-N 1 1 416.529 3.030 20 0 HGADMO Cc1nc(-c2ccncc2)nc(N2CC[N@H+]3C[C@@H](OCc4cccnc4)C[C@H]3C2)c1C ZINC001164872533 721167613 /nfs/dbraw/zinc/16/76/13/721167613.db2.gz HJYLABLMZMHGHP-VXKWHMMOSA-N 1 1 416.529 3.030 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4nccc(Oc5cccc(F)c5)n4)C[C@H]3C2)cn1 ZINC001164762627 721178811 /nfs/dbraw/zinc/17/88/11/721178811.db2.gz DBEKQAOSKQAYJM-ZWKOTPCHSA-N 1 1 408.481 3.100 20 0 HGADMO CCc1nc(Cl)nc(Cl)c1N1CC[N@H+]2C[C@H](OCc3cccnc3)C[C@H]2C1 ZINC001164866461 721185007 /nfs/dbraw/zinc/18/50/07/721185007.db2.gz AXJJTHLDXBMCGQ-LSDHHAIUSA-N 1 1 408.333 3.221 20 0 HGADMO Cc1cc(OCc2ccccc2)nc(N2C[C@@H]3CC[N@H+](Cc4cnn(C)c4)C[C@H]3C2)n1 ZINC001164767247 721230460 /nfs/dbraw/zinc/23/04/60/721230460.db2.gz WMDITDSAIXENFQ-VXKWHMMOSA-N 1 1 418.545 3.056 20 0 HGADMO CCN1C(=O)[C@]2(CC[C@@H]3CN(c4nc(Cl)ccc4C[NH+]4CCCC4)C[C@H]32)N=C1C ZINC001164875120 721230624 /nfs/dbraw/zinc/23/06/24/721230624.db2.gz WDUVCHXGNUFIGQ-RADWXHQJSA-N 1 1 415.969 3.196 20 0 HGADMO Cc1cc(-c2ccccc2F)nnc1N1C[C@@H]2C[N@@H+](Cc3cnn(C)c3)CC[C@@H]2C1 ZINC001164761541 721237413 /nfs/dbraw/zinc/23/74/13/721237413.db2.gz JJLGDCZRBKMTHT-MOPGFXCFSA-N 1 1 406.509 3.283 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4c(F)ccc5c(Cl)ncnc54)C[C@@H]3C2)cn1 ZINC001164764879 721243406 /nfs/dbraw/zinc/24/34/06/721243406.db2.gz QIIOSFGVGYSOLM-CABCVRRESA-N 1 1 400.889 3.114 20 0 HGADMO C[NH+]1CCC(Oc2ccnc(N3CC[C@@H]4O[C@@H](COc5cccnc5)CC[C@H]43)c2)CC1 ZINC001164872745 721251999 /nfs/dbraw/zinc/25/19/99/721251999.db2.gz FPVNHILDEMFTHC-ZLNRFVROSA-N 1 1 424.545 3.155 20 0 HGADMO CN(C)C1=[NH+]OC2(C1)CCN(C(F)(F)c1cc(Cl)nc(-c3ccccn3)n1)CC2 ZINC001164876315 721326677 /nfs/dbraw/zinc/32/66/77/721326677.db2.gz NYMRZQLEOICVBE-UHFFFAOYSA-N 1 1 422.867 3.371 20 0 HGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@]2(CCCN(c3ncnc4sccc43)C2)C1 ZINC001164778391 721331724 /nfs/dbraw/zinc/33/17/24/721331724.db2.gz VAYFDLGIZDDHAA-OAQYLSRUSA-N 1 1 413.547 3.415 20 0 HGADMO COc1cc(Cl)cnc1N1CCC[C@]2(C1)COCC[N@H+](Cc1c(C)noc1C)C2 ZINC001164776322 721336626 /nfs/dbraw/zinc/33/66/26/721336626.db2.gz DRZGDRVKXPNYIR-NRFANRHFSA-N 1 1 420.941 3.467 20 0 HGADMO COc1cc(Cl)cnc1N1CCC[C@]2(C1)COCC[N@@H+](Cc1c(C)noc1C)C2 ZINC001164776322 721336632 /nfs/dbraw/zinc/33/66/32/721336632.db2.gz DRZGDRVKXPNYIR-NRFANRHFSA-N 1 1 420.941 3.467 20 0 HGADMO COc1ccc(Cl)nc1N1CCC[C@@]2(C1)COCC[N@H+](Cc1c(C)noc1C)C2 ZINC001164779522 721353863 /nfs/dbraw/zinc/35/38/63/721353863.db2.gz UOFFYOUHUYCTCX-OAQYLSRUSA-N 1 1 420.941 3.467 20 0 HGADMO COc1ccc(Cl)nc1N1CCC[C@@]2(C1)COCC[N@@H+](Cc1c(C)noc1C)C2 ZINC001164779522 721353866 /nfs/dbraw/zinc/35/38/66/721353866.db2.gz UOFFYOUHUYCTCX-OAQYLSRUSA-N 1 1 420.941 3.467 20 0 HGADMO COc1ccnc(Cl)c1N1CCC[C@]2(C1)COCC[N@H+](Cc1c(C)noc1C)C2 ZINC001164781563 721372405 /nfs/dbraw/zinc/37/24/05/721372405.db2.gz JWLLKCNDEUSYJL-NRFANRHFSA-N 1 1 420.941 3.467 20 0 HGADMO COc1ccnc(Cl)c1N1CCC[C@]2(C1)COCC[N@@H+](Cc1c(C)noc1C)C2 ZINC001164781563 721372410 /nfs/dbraw/zinc/37/24/10/721372410.db2.gz JWLLKCNDEUSYJL-NRFANRHFSA-N 1 1 420.941 3.467 20 0 HGADMO C[NH+]1CCN(C[C@@H]2CCC[C@]3(CCN(c4cc5ccc(Cl)nc5cn4)C3)O2)CC1 ZINC001164886202 721415758 /nfs/dbraw/zinc/41/57/58/721415758.db2.gz ICYZEMWGZOKHPM-PGRDOPGGSA-N 1 1 415.969 3.049 20 0 HGADMO C[NH+]1CCN(C[C@@H]2CCC[C@]3(CCN(c4ncc5cc(Cl)ccc5n4)C3)O2)CC1 ZINC001164887200 721416559 /nfs/dbraw/zinc/41/65/59/721416559.db2.gz LJQWWMRZAJWMEC-SIKLNZKXSA-N 1 1 415.969 3.049 20 0 HGADMO C[NH+]1CCN(C[C@H]2CCC[C@]3(CCN(c4ncc5c(Cl)cccc5n4)C3)O2)CC1 ZINC001164888973 721417476 /nfs/dbraw/zinc/41/74/76/721417476.db2.gz PVXOBPDAQUMTGT-VGOFRKELSA-N 1 1 415.969 3.049 20 0 HGADMO C[NH+]1CCN(C[C@@H]2CCC[C@@]3(CCN(c4cc5c(Cl)ccnc5cn4)C3)O2)CC1 ZINC001164892996 721420984 /nfs/dbraw/zinc/42/09/84/721420984.db2.gz ZUXCSUANCPIBOW-JTSKRJEESA-N 1 1 415.969 3.049 20 0 HGADMO Clc1nc2c(Cl)nccc2c(N2C[C@H]3C[NH+](Cc4nccs4)C[C@@H]3C2)n1 ZINC001164781522 721424356 /nfs/dbraw/zinc/42/43/56/721424356.db2.gz DUUMSAPODOHYPG-GHMZBOCLSA-N 1 1 407.330 3.356 20 0 HGADMO Cc1nc(N2CC[C@]3(C2)CCC[C@@H](CN2CC[NH+](C)CC2)O3)c(Cl)cc1Cl ZINC001164893120 721428572 /nfs/dbraw/zinc/42/85/72/721428572.db2.gz JBWMCRYMTYXGMG-JXFKEZNVSA-N 1 1 413.393 3.462 20 0 HGADMO COc1ccc(-c2ccc(N3C[C@@H]4C[NH+](Cc5nccs5)C[C@H]4C3)nn2)c(OC)c1 ZINC001164790962 721431425 /nfs/dbraw/zinc/43/14/25/721431425.db2.gz YTKIFRWYFHWMBI-HOTGVXAUSA-N 1 1 423.542 3.186 20 0 HGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1cc(Cl)nc(C)n1)CC2 ZINC001164789419 721447928 /nfs/dbraw/zinc/44/79/28/721447928.db2.gz VVXQSLXYCXTTSY-GOSISDBHSA-N 1 1 408.974 3.172 20 0 HGADMO CCC[N@H+]1CCCC[C@@H]1c1ccc(N2CC[C@@H]3O[C@@H](C(=O)NCC4CC4)C[C@@H]32)nc1 ZINC001164890843 721459465 /nfs/dbraw/zinc/45/94/65/721459465.db2.gz SSUGUAFZTLFYPH-CLAROIROSA-N 1 1 412.578 3.281 20 0 HGADMO CCc1nc(C)cc(N2CCC3(C[C@H](COCC4CC4)[N@@H+](CCOC)C3)CC2)n1 ZINC001164791333 721467393 /nfs/dbraw/zinc/46/73/93/721467393.db2.gz XDANIAGEGBEWDS-HXUWFJFHSA-N 1 1 402.583 3.081 20 0 HGADMO Clc1ccc(C[NH+]2CCCC2)c(N2Cc3nccn3C[C@H](Cn3cccn3)C2)n1 ZINC001164897162 721486565 /nfs/dbraw/zinc/48/65/65/721486565.db2.gz RTKBFLZVUIACLI-KRWDZBQOSA-N 1 1 411.941 3.060 20 0 HGADMO Cc1cc(Cl)nc(N2CCC3(CC([N@@H+](C)Cc4ccncc4)C3)CC2)c1C(N)=O ZINC001164793196 721490878 /nfs/dbraw/zinc/49/08/78/721490878.db2.gz PDMHAZDSNRJTMJ-UHFFFAOYSA-N 1 1 413.953 3.418 20 0 HGADMO COC(=O)c1cc(Cl)cnc1N1CC[N@H+]2C[C@@H](Oc3cccc(F)c3)C[C@H]2C1 ZINC001164897065 721513746 /nfs/dbraw/zinc/51/37/46/721513746.db2.gz DMORBQPMIUKFQP-RDJZCZTQSA-N 1 1 405.857 3.003 20 0 HGADMO Cc1nc(Cl)cc(C(F)(F)N2CC[N@H+]3C[C@H](Oc4cccc(F)c4)C[C@@H]3C2)n1 ZINC001164900719 721519366 /nfs/dbraw/zinc/51/93/66/721519366.db2.gz UIIBTKRANSXKAN-GDBMZVCRSA-N 1 1 412.843 3.464 20 0 HGADMO Fc1cccc(O[C@@H]2C[C@H]3CN(c4nc(Cl)nc5c4CCCC5)CC[N@H+]3C2)c1 ZINC001164901342 721520633 /nfs/dbraw/zinc/52/06/33/721520633.db2.gz WPOSTCZNXGKJGG-DOTOQJQBSA-N 1 1 402.901 3.490 20 0 HGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(C(F)(F)Oc2ccc(Cl)nc2)[C@H]2CCCO[C@H]12 ZINC001164809541 721542799 /nfs/dbraw/zinc/54/27/99/721542799.db2.gz VIXWAWYCARLLMV-SCTDSRPQSA-N 1 1 424.879 3.423 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(C(F)(F)Oc2ccc(Cl)nc2)[C@H]2CCCO[C@H]12 ZINC001164809541 721542802 /nfs/dbraw/zinc/54/28/02/721542802.db2.gz VIXWAWYCARLLMV-SCTDSRPQSA-N 1 1 424.879 3.423 20 0 HGADMO Cc1c[nH]c2nc(Cl)nc(N3C[C@H]([N@H+](C)Cc4cccnc4)[C@H]4OCCC[C@@H]43)c12 ZINC001164801463 721544321 /nfs/dbraw/zinc/54/43/21/721544321.db2.gz FKZBGUZVDVKGNU-BQFCYCMXSA-N 1 1 412.925 3.183 20 0 HGADMO Cc1c[nH]c2nc(Cl)nc(N3C[C@H]([N@@H+](C)Cc4cccnc4)[C@H]4OCCC[C@@H]43)c12 ZINC001164801463 721544326 /nfs/dbraw/zinc/54/43/26/721544326.db2.gz FKZBGUZVDVKGNU-BQFCYCMXSA-N 1 1 412.925 3.183 20 0 HGADMO Fc1cccc(O[C@@H]2C[C@@H]3CN(c4nccc(-c5cccnc5F)n4)CC[N@H+]3C2)c1 ZINC001164911096 721545563 /nfs/dbraw/zinc/54/55/63/721545563.db2.gz VOIZYFCDMLNORM-SJLPKXTDSA-N 1 1 409.440 3.159 20 0 HGADMO CC(C)(C)NC(=O)c1ccnc(N2CC[N@H+]3C[C@@H](Oc4cccc(F)c4)C[C@H]3C2)c1 ZINC001164903473 721545977 /nfs/dbraw/zinc/54/59/77/721545977.db2.gz CWXFKZIINIJVAT-ICSRJNTNSA-N 1 1 412.509 3.091 20 0 HGADMO CCOC(=O)c1cnc2cc(N3CC[N@H+]4C[C@H](Oc5cccc(F)c5)C[C@@H]4C3)[nH]cc1-2 ZINC001164908715 721551092 /nfs/dbraw/zinc/55/10/92/721551092.db2.gz QGZZADVWTBGHRX-SJLPKXTDSA-N 1 1 424.476 3.221 20 0 HGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2ccc(C(=O)OC(C)(C)C)cn2)[C@H]2CCCO[C@@H]12 ZINC001164805710 721553344 /nfs/dbraw/zinc/55/33/44/721553344.db2.gz MYEGBJYVLXJDSX-TUNNFDKTSA-N 1 1 424.545 3.300 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2ccc(C(=O)OC(C)(C)C)cn2)[C@H]2CCCO[C@@H]12 ZINC001164805710 721553346 /nfs/dbraw/zinc/55/33/46/721553346.db2.gz MYEGBJYVLXJDSX-TUNNFDKTSA-N 1 1 424.545 3.300 20 0 HGADMO CCOc1ccc(Cl)nc1N1C[C@H]([N@H+](C)Cc2cccnc2)[C@H]2OCCC[C@@H]21 ZINC001164799728 721560863 /nfs/dbraw/zinc/56/08/63/721560863.db2.gz DIJDQERWRDMLLS-ZWOKBUDYSA-N 1 1 402.926 3.397 20 0 HGADMO CCOc1ccc(Cl)nc1N1C[C@H]([N@@H+](C)Cc2cccnc2)[C@H]2OCCC[C@@H]21 ZINC001164799728 721560867 /nfs/dbraw/zinc/56/08/67/721560867.db2.gz DIJDQERWRDMLLS-ZWOKBUDYSA-N 1 1 402.926 3.397 20 0 HGADMO COc1cc(OC)c2ncnc(N3CC[N@H+]4C[C@H](Oc5cccc(F)c5)C[C@H]4C3)c2c1 ZINC001164905452 721566090 /nfs/dbraw/zinc/56/60/90/721566090.db2.gz HNCOROBYWJLBAJ-QFBILLFUSA-N 1 1 424.476 3.128 20 0 HGADMO Cc1cnc(N2CCC(F)(F)[C@@]3(CC[N@@H+](Cc4ccccn4)C3)C2)nc1NC1CC1 ZINC001164906310 721582542 /nfs/dbraw/zinc/58/25/42/721582542.db2.gz ZXDZWESYJZVKLI-OAQYLSRUSA-N 1 1 414.504 3.492 20 0 HGADMO Cc1cc(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@@H]32)nc(-c2ccco2)n1 ZINC001164810803 721582735 /nfs/dbraw/zinc/58/27/35/721582735.db2.gz WFPJQSUCLXTHOI-CNNODRBYSA-N 1 1 405.502 3.308 20 0 HGADMO COc1ccc2nc(N3C[C@H]([N@@H+](C)Cc4cccnc4)[C@H]4OCCC[C@H]43)c(C)nc2c1 ZINC001164811882 721583113 /nfs/dbraw/zinc/58/31/13/721583113.db2.gz YUUMHQSVQGEFAW-VJBWXMMDSA-N 1 1 419.529 3.210 20 0 HGADMO Cc1ccc(-c2ccc(N3C[C@H]([N@H+](C)Cc4cccnc4)[C@@H]4OCCC[C@H]43)nn2)o1 ZINC001164810228 721583730 /nfs/dbraw/zinc/58/37/30/721583730.db2.gz VGNJLHUGTJENRA-ZRCGQRJVSA-N 1 1 405.502 3.308 20 0 HGADMO Cc1ccc(-c2ccc(N3C[C@H]([N@@H+](C)Cc4cccnc4)[C@@H]4OCCC[C@H]43)nn2)o1 ZINC001164810228 721583741 /nfs/dbraw/zinc/58/37/41/721583741.db2.gz VGNJLHUGTJENRA-ZRCGQRJVSA-N 1 1 405.502 3.308 20 0 HGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2ccc(-c3ccsc3)nn2)[C@H]2CCCO[C@@H]12 ZINC001164811296 721587242 /nfs/dbraw/zinc/58/72/42/721587242.db2.gz XDRNXKONYWWAKJ-TUNNFDKTSA-N 1 1 407.543 3.468 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2ccc(-c3ccsc3)nn2)[C@H]2CCCO[C@@H]12 ZINC001164811296 721587243 /nfs/dbraw/zinc/58/72/43/721587243.db2.gz XDRNXKONYWWAKJ-TUNNFDKTSA-N 1 1 407.543 3.468 20 0 HGADMO CCc1nc(N2C[C@H]([N@H+](C)Cc3cccnc3)[C@H]3OCCC[C@@H]32)c(Cl)nc1C ZINC001164806802 721590836 /nfs/dbraw/zinc/59/08/36/721590836.db2.gz MZJAZTWRJDNFLI-FHWLQOOXSA-N 1 1 401.942 3.264 20 0 HGADMO CCc1nc(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@H]3OCCC[C@@H]32)c(Cl)nc1C ZINC001164806802 721590839 /nfs/dbraw/zinc/59/08/39/721590839.db2.gz MZJAZTWRJDNFLI-FHWLQOOXSA-N 1 1 401.942 3.264 20 0 HGADMO COc1cc(C)c2ncnc(N3C[C@H]([N@@H+](C)Cc4cccnc4)[C@H]4OCCC[C@@H]43)c2c1 ZINC001164804098 721592049 /nfs/dbraw/zinc/59/20/49/721592049.db2.gz INMVVMJMZHGDBI-FUDKSRODSA-N 1 1 419.529 3.210 20 0 HGADMO FC1(F)CCN(c2nc(Cl)nc(Cl)n2)C[C@@]12CC[N@@H+](Cc1ccccn1)C2 ZINC001164907101 721695591 /nfs/dbraw/zinc/69/55/91/721695591.db2.gz RPSJOJJGYHXFAK-INIZCTEOSA-N 1 1 415.275 3.311 20 0 HGADMO CN(C)c1cc(Cl)nc(N2CCC(F)(F)[C@]3(CC[N@@H+](Cc4ccccn4)C3)C2)n1 ZINC001164906462 721708167 /nfs/dbraw/zinc/70/81/67/721708167.db2.gz MBWNJLYKOLLOJQ-IBGZPJMESA-N 1 1 422.911 3.329 20 0 HGADMO COC(=O)c1cc(N2CCC(F)(F)[C@@]3(CC[N@@H+](Cc4ccccn4)C3)C2)ncc1C ZINC001164905482 721711913 /nfs/dbraw/zinc/71/19/13/721711913.db2.gz GTQWSTYBVHLELA-OAQYLSRUSA-N 1 1 416.472 3.309 20 0 HGADMO CSc1nc(Cl)nc(N2CCc3c(C[N@H+](C)Cc4ccco4)cncc3C2)n1 ZINC001164909994 721749987 /nfs/dbraw/zinc/74/99/87/721749987.db2.gz WYVVZSCLFOJAMW-UHFFFAOYSA-N 1 1 416.938 3.430 20 0 HGADMO CSc1nc(Cl)nc(N2CCc3c(C[N@@H+](C)Cc4ccco4)cncc3C2)n1 ZINC001164909994 721749989 /nfs/dbraw/zinc/74/99/89/721749989.db2.gz WYVVZSCLFOJAMW-UHFFFAOYSA-N 1 1 416.938 3.430 20 0 HGADMO C[N@H+](Cc1ccco1)Cc1cncc2c1CCN(c1[nH]c3cc(=O)[nH]c-3cc1Cl)C2 ZINC001164910838 721755349 /nfs/dbraw/zinc/75/53/49/721755349.db2.gz SLFITJHCEWCKMC-UHFFFAOYSA-N 1 1 423.904 3.412 20 0 HGADMO C[N@@H+](Cc1ccco1)Cc1cncc2c1CCN(c1[nH]c3cc(=O)[nH]c-3cc1Cl)C2 ZINC001164910838 721755351 /nfs/dbraw/zinc/75/53/51/721755351.db2.gz SLFITJHCEWCKMC-UHFFFAOYSA-N 1 1 423.904 3.412 20 0 HGADMO CC[N@H+]1CCCC[C@H]1c1ccc(N2CCC[C@]3(CCN(c4cncnc4)C3=O)C2)nc1 ZINC001165020196 721785367 /nfs/dbraw/zinc/78/53/67/721785367.db2.gz NJDVHRIQGCBFNH-URXFXBBRSA-N 1 1 420.561 3.442 20 0 HGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2CCC[C@]3(CCN(c4cncnc4)C3=O)C2)nc1 ZINC001165020194 721785496 /nfs/dbraw/zinc/78/54/96/721785496.db2.gz NJDVHRIQGCBFNH-QPPBQGQZSA-N 1 1 420.561 3.442 20 0 HGADMO C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@@H]2CN(c3ccc(CN4CCOCC4)cn3)C[C@H]21 ZINC001165017741 721801986 /nfs/dbraw/zinc/80/19/86/721801986.db2.gz AINWXMRYDYSLKV-GMKZXUHWSA-N 1 1 421.589 3.046 20 0 HGADMO CCOC(=O)c1cnc(C)nc1N1C[C@@H]2CCC[C@H]([N@@H+](C)Cc3ccccn3)[C@H]2C1 ZINC001165025093 721807136 /nfs/dbraw/zinc/80/71/36/721807136.db2.gz NNIAAZKOOBOTMR-YYWHXJBOSA-N 1 1 409.534 3.094 20 0 HGADMO CCOC(=O)c1cnc(N2C[C@@H]3CCC[C@H]([N@@H+](C)Cc4ccccn4)[C@@H]3C2)nc1C ZINC001165025473 721810465 /nfs/dbraw/zinc/81/04/65/721810465.db2.gz MWVDNYQTEMUXPH-WMQCIHAUSA-N 1 1 409.534 3.094 20 0 HGADMO Cc1cn(-c2ccc(N3C[C@@H]4CCC[C@H]([N@@H+](C)Cc5ccccn5)[C@@H]4C3)nn2)cn1 ZINC001165027139 721818651 /nfs/dbraw/zinc/81/86/51/721818651.db2.gz SKJOLPHPLDKSLP-TYPHKJRUSA-N 1 1 403.534 3.103 20 0 HGADMO CCCNC(=O)c1ccc(N2C[C@@H]3CCC[C@@H]([N@@H+](C)Cc4ccccn4)[C@@H]3C2)nc1 ZINC001165030512 721824752 /nfs/dbraw/zinc/82/47/52/721824752.db2.gz ZNMKCWXXAHNPJH-KSEOMHKRSA-N 1 1 407.562 3.353 20 0 HGADMO C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@@H]2CN(c3cc(N4CCSCC4)ncn3)C[C@H]21 ZINC001165025655 721827881 /nfs/dbraw/zinc/82/78/81/721827881.db2.gz NFDIDNQRUIJKDH-HMXCVIKNSA-N 1 1 424.618 3.162 20 0 HGADMO CN(C)CC[N@@H+]1CC[C@H]2[C@H]1CCN2c1ccc(C(=O)Nc2cccc(Cl)c2)cn1 ZINC001164933343 721880048 /nfs/dbraw/zinc/88/00/48/721880048.db2.gz MICBUYXZXVUQEF-UXHICEINSA-N 1 1 413.953 3.202 20 0 HGADMO CN(C)CC[N@H+]1CC[C@H]2[C@H]1CCN2c1ccc(C(=O)Nc2cccc(Cl)c2)cn1 ZINC001164933343 721880050 /nfs/dbraw/zinc/88/00/50/721880050.db2.gz MICBUYXZXVUQEF-UXHICEINSA-N 1 1 413.953 3.202 20 0 HGADMO O=C1NCC[N@@H+](Cc2ccccc2)C12CCN(c1nccc3cc(Cl)ncc31)CC2 ZINC001164943792 721972088 /nfs/dbraw/zinc/97/20/88/721972088.db2.gz FJKSDONWTBVGJM-UHFFFAOYSA-N 1 1 421.932 3.254 20 0 HGADMO O=C1NCC[N@H+](Cc2ccccc2)C12CCN(c1nccc3cc(Cl)ncc31)CC2 ZINC001164943792 721972090 /nfs/dbraw/zinc/97/20/90/721972090.db2.gz FJKSDONWTBVGJM-UHFFFAOYSA-N 1 1 421.932 3.254 20 0 HGADMO CCN(CCC(N)=O)c1nc(C[NH+]2CCCC2)nc2sc3c(c21)CC[C@@H](C)C3 ZINC001165046748 721984313 /nfs/dbraw/zinc/98/43/13/721984313.db2.gz BYEJNZZMEGPAFY-CQSZACIVSA-N 1 1 401.580 3.114 20 0 HGADMO O=C(c1cc(Cl)nc(N2CC[NH+](CCc3ccccn3)CC2)c1)N1CCCCC1 ZINC001165054237 722009675 /nfs/dbraw/zinc/00/96/75/722009675.db2.gz TUHMOWUJOSVSQE-UHFFFAOYSA-N 1 1 413.953 3.121 20 0 HGADMO COC(=O)c1ccc2nc(N3CCC4(CC[N@@H+](Cc5cccnc5)C4)CC3)ncc2c1 ZINC001164955521 722014133 /nfs/dbraw/zinc/01/41/33/722014133.db2.gz VSSIPAUJVNTGQH-UHFFFAOYSA-N 1 1 417.513 3.304 20 0 HGADMO Fc1cccc(Oc2nc(Cl)nc(N3CC[NH+](CCc4ccccn4)CC3)n2)c1 ZINC001165056242 722015131 /nfs/dbraw/zinc/01/51/31/722015131.db2.gz QFSYZNASQHJSEN-UHFFFAOYSA-N 1 1 414.872 3.216 20 0 HGADMO FC(F)(COc1ccc(Cl)nn1)N1CCC2(CC[N@@H+](Cc3cccnc3)C2)CC1 ZINC001164955487 722021932 /nfs/dbraw/zinc/02/19/32/722021932.db2.gz JDNVPDJVRHTIOH-UHFFFAOYSA-N 1 1 423.895 3.485 20 0 HGADMO O=C(c1ccco1)N1CC[C@@H]2CN(c3nc(Cl)ccc3C[NH+]3CCCC3)C[C@@H]21 ZINC001164960816 722047363 /nfs/dbraw/zinc/04/73/63/722047363.db2.gz XHMJWMQRQUOTTB-WBVHZDCISA-N 1 1 400.910 3.275 20 0 HGADMO F[C@H](Oc1ccc(Cl)nc1)N1CCC2(CC1)COCC[N@@H+](Cc1ccncc1)C2 ZINC001164963805 722056395 /nfs/dbraw/zinc/05/63/95/722056395.db2.gz LVDBNIPCTHGLHW-FQEVSTJZSA-N 1 1 420.916 3.377 20 0 HGADMO Cc1ccc2nc(N3CCC4(CC3)COCC[N@@H+](Cc3ccncc3)C4)ncc2c1 ZINC001164964183 722056691 /nfs/dbraw/zinc/05/66/91/722056691.db2.gz SQBRLKATRHRXOC-UHFFFAOYSA-N 1 1 403.530 3.452 20 0 HGADMO Clc1cnc2c(c1)ncnc2N1CCC2(CC1)COCC[N@@H+](Cc1ccncc1)C2 ZINC001164964120 722057374 /nfs/dbraw/zinc/05/73/74/722057374.db2.gz RMNUDQUCBDIOBB-UHFFFAOYSA-N 1 1 424.936 3.192 20 0 HGADMO c1coc(-c2ccc(N3CCC4(CC3)COCC[N@H+](Cc3ccncc3)C4)nn2)c1 ZINC001164961588 722060530 /nfs/dbraw/zinc/06/05/30/722060530.db2.gz MIZVIAVCXOIHOY-UHFFFAOYSA-N 1 1 405.502 3.251 20 0 HGADMO O=C(c1cscn1)N1CC[C@H]2[C@@H]1CCN2c1nc(Cl)ccc1C[NH+]1CCCC1 ZINC001164964517 722064846 /nfs/dbraw/zinc/06/48/46/722064846.db2.gz HEWDDTAYNGJUMG-IRXDYDNUSA-N 1 1 417.966 3.281 20 0 HGADMO CC(C)CNC(=O)c1nc2c(s1)CCN(c1ccc(C[N@@H+](C)C3CC3)cn1)CC2 ZINC001164965252 722066693 /nfs/dbraw/zinc/06/66/93/722066693.db2.gz GQRJTWBPWZISKI-UHFFFAOYSA-N 1 1 413.591 3.123 20 0 HGADMO Cc1sc2ncnc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)c2c1C ZINC001164984129 722103648 /nfs/dbraw/zinc/10/36/48/722103648.db2.gz RSZQQNAZBIAHGO-MOPGFXCFSA-N 1 1 409.559 3.430 20 0 HGADMO c1ccc(-c2nccc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)n2)cc1 ZINC001164984720 722104906 /nfs/dbraw/zinc/10/49/06/722104906.db2.gz UEBFQJKJTJFHRQ-VXKWHMMOSA-N 1 1 401.514 3.266 20 0 HGADMO Clc1nnc(N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)c2c1CCCC2 ZINC001164970859 722113148 /nfs/dbraw/zinc/11/31/48/722113148.db2.gz AAQIZFWVPWVFFF-PXNSSMCTSA-N 1 1 413.953 3.131 20 0 HGADMO Fc1ccc(-c2ccnc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)n2)cc1 ZINC001164971887 722113353 /nfs/dbraw/zinc/11/33/53/722113353.db2.gz DAWSLIUCNQDMNH-NZQKXSOJSA-N 1 1 419.504 3.405 20 0 HGADMO c1ccc2c(c1)[nH]c1ncnc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)c21 ZINC001164976408 722122921 /nfs/dbraw/zinc/12/29/21/722122921.db2.gz LNTWVRFKXNLGLE-RXVVDRJESA-N 1 1 414.513 3.233 20 0 HGADMO COc1ccc2nc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)nc(C)c2c1 ZINC001164981108 722125923 /nfs/dbraw/zinc/12/59/23/722125923.db2.gz SQUMFKIFJJCENS-AUSIDOKSSA-N 1 1 419.529 3.069 20 0 HGADMO COc1ccc2ccc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)nc2c1 ZINC001164975120 722126175 /nfs/dbraw/zinc/12/61/75/722126175.db2.gz JSRICIXEIPKPEU-NZQKXSOJSA-N 1 1 404.514 3.366 20 0 HGADMO c1csc(-c2cc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)ncn2)c1 ZINC001164983333 722144777 /nfs/dbraw/zinc/14/47/77/722144777.db2.gz UGSLUEZKVLDYQW-QUCCMNQESA-N 1 1 407.543 3.327 20 0 HGADMO c1ccc(Cc2nccc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)n2)cc1 ZINC001164985058 722147098 /nfs/dbraw/zinc/14/70/98/722147098.db2.gz ZATCDMUFLIUBBL-PKTZIBPZSA-N 1 1 415.541 3.190 20 0 HGADMO Fc1ccccc1-c1ccc(N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)nn1 ZINC001164977040 722148143 /nfs/dbraw/zinc/14/81/43/722148143.db2.gz IAVBYYPFEVVSOE-CVDCTZTESA-N 1 1 419.504 3.405 20 0 HGADMO CCc1nc(N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)c(Cl)nc1C ZINC001164977116 722157297 /nfs/dbraw/zinc/15/72/97/722157297.db2.gz XDOOGRVXRNEYKK-IEBWSBKVSA-N 1 1 401.942 3.123 20 0 HGADMO Fc1cccc(CN2CC[C@]23CCCN(c2nc(Cl)nc4c2C[NH2+]CC4)C3)c1 ZINC001164995305 722191838 /nfs/dbraw/zinc/19/18/38/722191838.db2.gz UGAUZPTUYKXOGO-NRFANRHFSA-N 1 1 401.917 3.160 20 0 HGADMO NC(=O)c1cc(F)c(Cl)nc1N1CCC[C@@]2(CC[N@H+]2Cc2cccc(F)c2)C1 ZINC001164995606 722196247 /nfs/dbraw/zinc/19/62/47/722196247.db2.gz WBCSTPUGPRIDGU-HXUWFJFHSA-N 1 1 406.864 3.357 20 0 HGADMO COC(=O)CSc1cncc(N2CCC[C@@]3(CC[N@H+]3Cc3cccc(F)c3)C2)n1 ZINC001164993732 722210289 /nfs/dbraw/zinc/21/02/89/722210289.db2.gz AFZWXQYORQQWEA-OAQYLSRUSA-N 1 1 416.522 3.126 20 0 HGADMO Cc1ccc2nc(Cl)cc(N3CCc4ncnc(N5CC[NH+](C)CC5)c4CC3)c2c1 ZINC001164996478 722231701 /nfs/dbraw/zinc/23/17/01/722231701.db2.gz HZBYJPLLTUTBJT-UHFFFAOYSA-N 1 1 422.964 3.344 20 0 HGADMO C[NH+]1CCN(c2ncnc3c2CCN(c2ccc4ccc(Cl)cc4n2)CC3)CC1 ZINC001164996280 722235671 /nfs/dbraw/zinc/23/56/71/722235671.db2.gz ASYIHWNHWZLVBO-UHFFFAOYSA-N 1 1 408.937 3.035 20 0 HGADMO OC[C@@H](Cc1ccccc1)[NH2+]Cc1c(Br)cncc1Br ZINC000394535308 1126080062 /nfs/dbraw/zinc/08/00/62/1126080062.db2.gz RHIUWIFDNASGCD-GFCCVEGCSA-N 1 1 400.114 3.300 20 0 HGADMO C[C@@](CO)(Cc1ccc(Br)cc1)[NH2+]Cc1nc(CC(F)(F)F)no1 ZINC001473839302 1126199618 /nfs/dbraw/zinc/19/96/18/1126199618.db2.gz XKYADOAZMNEIGV-AWEZNQCLSA-N 1 1 408.218 3.020 20 0 HGADMO CCc1ccc(NC(=O)C[N@H+]2C[C@H]3CCC[C@@]3(c3nc(-c4cnccn4)no3)C2)cc1 ZINC000328604619 569417627 /nfs/dbraw/zinc/41/76/27/569417627.db2.gz KKIJWUQHADQBJK-UZUQRXQVSA-N 1 1 418.501 3.081 20 0 HGADMO O=C1Nc2ccccc2[C@H]2CN(c3ncnc4c3CC[N@H+](Cc3ccccc3)C4)C[C@@H]12 ZINC001164403209 718856558 /nfs/dbraw/zinc/85/65/58/718856558.db2.gz ICJILAXKQTZMQO-NHCUHLMSSA-N 1 1 411.509 3.207 20 0 HGADMO O=C1Nc2ccccc2[C@H]2CN(c3ncnc4c3CC[N@@H+](Cc3ccccc3)C4)C[C@@H]12 ZINC001164403209 718856561 /nfs/dbraw/zinc/85/65/61/718856561.db2.gz ICJILAXKQTZMQO-NHCUHLMSSA-N 1 1 411.509 3.207 20 0 HGADMO CCOC(=O)[C@]12CCO[C@@H]1CCN(c1ccc3c(n1)CC[N@H+](Cc1ccccc1)C3)C2 ZINC001164432024 718974528 /nfs/dbraw/zinc/97/45/28/718974528.db2.gz DUCBTJSQKPIJRF-RDGATRHJSA-N 1 1 421.541 3.188 20 0 HGADMO CCOC(=O)c1cnc(SC)nc1N1CCC[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21 ZINC001164620924 719053976 /nfs/dbraw/zinc/05/39/76/719053976.db2.gz HJFBVDNSOQFLMN-HKUYNNGSSA-N 1 1 412.559 3.476 20 0 HGADMO CCOC(=O)c1nnc(Cl)cc1N1CCC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]21 ZINC001164625809 719073827 /nfs/dbraw/zinc/07/38/27/719073827.db2.gz NHLSFVOGJMWHTC-SJLPKXTDSA-N 1 1 400.910 3.408 20 0 HGADMO NC(=O)c1cc(Cl)ncc1C(F)(F)N1CCC[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21 ZINC001164631696 719094636 /nfs/dbraw/zinc/09/46/36/719094636.db2.gz ZCRFENRSUBQYKN-YJBOKZPZSA-N 1 1 420.891 3.480 20 0 HGADMO Cc1oncc1C(=O)N[C@@H]1C[N@@H+](C(C)(C)c2ccnc(Cl)c2)C[C@H]2CCCO[C@H]21 ZINC001164654546 719321369 /nfs/dbraw/zinc/32/13/69/719321369.db2.gz RLSMWHVOWVMAIK-LSBZLQRGSA-N 1 1 418.925 3.176 20 0 HGADMO Cc1oncc1C(=O)N[C@@H]1C[N@H+](C(C)(C)c2ccnc(Cl)c2)C[C@H]2CCCO[C@H]21 ZINC001164654546 719321372 /nfs/dbraw/zinc/32/13/72/719321372.db2.gz RLSMWHVOWVMAIK-LSBZLQRGSA-N 1 1 418.925 3.176 20 0 HGADMO CCn1nnc2c1[C@H](COC)CN(c1ccc3c(n1)CC[N@H+](Cc1ccccc1)C3)C2 ZINC001164663069 719360576 /nfs/dbraw/zinc/36/05/76/719360576.db2.gz HUMJKXKGFIHIEX-FQEVSTJZSA-N 1 1 418.545 3.002 20 0 HGADMO Fc1ccc(C[N@@H+]2CCOCC23CCN(c2nc(Cl)nc4nc[nH]c42)CC3)cc1 ZINC001164668521 719492401 /nfs/dbraw/zinc/49/24/01/719492401.db2.gz QEYWJTSNUFVJRP-UHFFFAOYSA-N 1 1 416.888 3.017 20 0 HGADMO Fc1ccc(C[N@H+]2CCOCC23CCN(c2nc(Cl)nc4nc[nH]c42)CC3)cc1 ZINC001164668521 719492404 /nfs/dbraw/zinc/49/24/04/719492404.db2.gz QEYWJTSNUFVJRP-UHFFFAOYSA-N 1 1 416.888 3.017 20 0 HGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2CC[C@H]3[C@H]2CC(=O)N3Cc2cccnc2)nc1 ZINC001164690670 719774800 /nfs/dbraw/zinc/77/48/00/719774800.db2.gz GVYHETYTSDFZSO-BHIFYINESA-N 1 1 405.546 3.403 20 0 HGADMO Cc1nc(C[N@H+]2CCCC23CCN(c2cc(C(N)=O)c(Cl)cn2)CC3)cs1 ZINC001164692295 719804593 /nfs/dbraw/zinc/80/45/93/719804593.db2.gz MUGJEUXEIZYUHM-UHFFFAOYSA-N 1 1 405.955 3.234 20 0 HGADMO Cc1nc(C[N@H+]2CCCC23CCN(c2[nH+][n-]c(Cl)c4ncnc2-4)CC3)cs1 ZINC001164693061 719811359 /nfs/dbraw/zinc/81/13/59/719811359.db2.gz PKGAMAXQYYCGPC-UHFFFAOYSA-N 1 1 403.943 3.406 20 0 HGADMO Cc1nc(CN2CCCC23CCN(c2nccc(C4CC[NH2+]CC4)n2)CC3)cs1 ZINC001164692272 719812161 /nfs/dbraw/zinc/81/21/61/719812161.db2.gz PDOSDHSRGGDVKH-UHFFFAOYSA-N 1 1 412.607 3.344 20 0 HGADMO COC(=O)[C@@]1(C)C[C@H]([NH+]2CCOCC2)CCN1c1cc(Cl)nc2ccc(F)cc21 ZINC001164701086 719847156 /nfs/dbraw/zinc/84/71/56/719847156.db2.gz LXLHTVQTPFTHBQ-QVKFZJNVSA-N 1 1 421.900 3.260 20 0 HGADMO COC(=O)[C@@]1(C)C[C@@H]([NH+]2CCOCC2)CCN1c1cc(Cl)nc2ccsc21 ZINC001164703276 719849334 /nfs/dbraw/zinc/84/93/34/719849334.db2.gz PRENUNMBSLFZKY-ORAYPTAESA-N 1 1 409.939 3.182 20 0 HGADMO COC(=O)[C@@]1(C)C[C@@H]([NH+]2CCOCC2)CCN1c1nc(Cl)cc2cc(C)ccc21 ZINC001164705079 719862599 /nfs/dbraw/zinc/86/25/99/719862599.db2.gz SQWKRROJFXJNMM-HTAPYJJXSA-N 1 1 417.937 3.429 20 0 HGADMO COC(=O)[C@]1(C)C[C@@H]([NH+]2CCOCC2)CCN1c1nc(Cl)cc2cccc(C)c21 ZINC001164702273 719877257 /nfs/dbraw/zinc/87/72/57/719877257.db2.gz HUDDEVKZTFMZPE-JTSKRJEESA-N 1 1 417.937 3.429 20 0 HGADMO COCc1cc(N2CC[C@@]3(C2)C[N@H+](CC2CC2)C[C@H]3COC)nc(-c2ccccc2)n1 ZINC001164810390 720076493 /nfs/dbraw/zinc/07/64/93/720076493.db2.gz LMFCQEQRKIMCOL-OFVILXPXSA-N 1 1 422.573 3.475 20 0 HGADMO COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1cc(Cl)nc(C)n1)CC2 ZINC001164710236 720092171 /nfs/dbraw/zinc/09/21/71/720092171.db2.gz HRGIRLMPTUIHEP-SFHVURJKSA-N 1 1 401.942 3.341 20 0 HGADMO COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1cc(Cl)nc(C)n1)CC2 ZINC001164710234 720093281 /nfs/dbraw/zinc/09/32/81/720093281.db2.gz HRGIRLMPTUIHEP-GOSISDBHSA-N 1 1 401.942 3.341 20 0 HGADMO COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1nc(C)nc3ccoc31)CC2 ZINC001164710369 720094186 /nfs/dbraw/zinc/09/41/86/720094186.db2.gz JHNQNSJPCCOSOG-LJQANCHMSA-N 1 1 407.518 3.434 20 0 HGADMO CCOC(=O)c1c(C)nc(Cl)cc1N1CC[C@]2(C1)C[N@@H+](CC1CC1)C[C@H]2COC ZINC001164809753 720098251 /nfs/dbraw/zinc/09/82/51/720098251.db2.gz JXZIUWCJWLXVTA-HTAPYJJXSA-N 1 1 421.969 3.405 20 0 HGADMO CCOC(=O)c1c(C)cc(Cl)nc1N1CC[C@]2(C1)C[N@@H+](CC1CC1)C[C@H]2COC ZINC001164813577 720098369 /nfs/dbraw/zinc/09/83/69/720098369.db2.gz TXELZFTYAJFBAW-HTAPYJJXSA-N 1 1 421.969 3.405 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1nccc3cc(C(=O)OC)ccc31)C2 ZINC001164811115 720102708 /nfs/dbraw/zinc/10/27/08/720102708.db2.gz LKQZIQSLEWFUJS-YKSBVNFPSA-N 1 1 409.530 3.206 20 0 HGADMO COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1ncnc3[nH]c(C)cc31)CC2 ZINC001164716231 720109055 /nfs/dbraw/zinc/10/90/55/720109055.db2.gz JLSVBWNZDZRCTC-LJQANCHMSA-N 1 1 406.534 3.169 20 0 HGADMO CCOC(=O)c1cccc(N2CCC3(C[C@H](COC)[N@@H+](Cc4ccccn4)C3)CC2)n1 ZINC001164716383 720111034 /nfs/dbraw/zinc/11/10/34/720111034.db2.gz KPTQAONKYYZHNL-HXUWFJFHSA-N 1 1 424.545 3.161 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1nccc(OCc3ccccc3)n1)C2 ZINC001164808628 720114348 /nfs/dbraw/zinc/11/43/48/720114348.db2.gz FWDWISWXQAFTJD-ZJSXRUAMSA-N 1 1 408.546 3.240 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1cc(Cl)nc3ccc(OC)nc31)C2 ZINC001164814968 720122834 /nfs/dbraw/zinc/12/28/34/720122834.db2.gz UTUKHQPWVPPNDL-ZHRRBRCNSA-N 1 1 416.953 3.477 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(C(F)(F)c1ccc(OC)c(Cl)n1)C2 ZINC001164813330 720128066 /nfs/dbraw/zinc/12/80/66/720128066.db2.gz QGGKXGJLJAQRHW-HNAYVOBHSA-N 1 1 415.912 3.473 20 0 HGADMO COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1cc(-c3ncc[nH]3)ccn1)CC2 ZINC001164713864 720133421 /nfs/dbraw/zinc/13/34/21/720133421.db2.gz TWCJEYUTDNQUDZ-OAQYLSRUSA-N 1 1 418.545 3.374 20 0 HGADMO COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1c(F)nc(F)nc1Cl)CC2 ZINC001164714874 720139153 /nfs/dbraw/zinc/13/91/53/720139153.db2.gz ZZPWNNZDAHSPAQ-HNNXBMFYSA-N 1 1 423.895 3.311 20 0 HGADMO CCCN(CCC)c1cncc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COC)n1 ZINC001164813812 720147084 /nfs/dbraw/zinc/14/70/84/720147084.db2.gz QYQVPDPMMDPTJX-NZQKXSOJSA-N 1 1 401.599 3.288 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1ncc(C(N)=S)c3ccsc31)C2 ZINC001164814643 720202988 /nfs/dbraw/zinc/20/29/88/720202988.db2.gz VPALYQLZGVNIOY-VFNWGFHPSA-N 1 1 416.616 3.115 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1ncnc3[nH]c4cc(F)ccc4c31)C2 ZINC001164811729 720203108 /nfs/dbraw/zinc/20/31/08/720203108.db2.gz JYIYEHFASGZHJC-HJPURHCSSA-N 1 1 409.509 3.435 20 0 HGADMO CC(C)[N@@H+](C)Cc1cc(=O)n2c(n1)CN(c1cc(Cl)nc3c1CCC3)CCC2 ZINC001164812008 720218064 /nfs/dbraw/zinc/21/80/64/720218064.db2.gz CJSJOYGTKBEOQK-UHFFFAOYSA-N 1 1 401.942 3.031 20 0 HGADMO COc1ccc2nc(N3CCCn4c(=O)cc(C[N@@H+](C)C(C)C)nc4C3)ccc2c1 ZINC001164814720 720219068 /nfs/dbraw/zinc/21/90/68/720219068.db2.gz WQRDOOIDXPYDMO-UHFFFAOYSA-N 1 1 407.518 3.051 20 0 HGADMO COc1cc(N2CCCn3c(=O)cc(C[N@@H+](C)C(C)C)nc3C2)nc2ccccc21 ZINC001164813986 720231054 /nfs/dbraw/zinc/23/10/54/720231054.db2.gz SQCWDCUVDICGKR-UHFFFAOYSA-N 1 1 407.518 3.051 20 0 HGADMO CC(C)[N@@H+](C)Cc1cc(=O)n2c(n1)CN(c1cc(-c3ccc(F)cc3)ncn1)CCC2 ZINC001164812204 720238281 /nfs/dbraw/zinc/23/82/81/720238281.db2.gz DBPGQBLXBNUNKS-UHFFFAOYSA-N 1 1 422.508 3.090 20 0 HGADMO Cc1c(Cl)nc(C(C)C)nc1N1CCCn2c(=O)cc(C[N@H+](C)C(C)C)nc2C1 ZINC001164817676 720243669 /nfs/dbraw/zinc/24/36/69/720243669.db2.gz SOWFCRWBMGBXJQ-UHFFFAOYSA-N 1 1 418.973 3.369 20 0 HGADMO COC(=O)c1ccc2nc(Cl)c(N3CC[C@@H]4[C@H]3CC[N@@H+]4Cc3cccnc3)nc2c1 ZINC001164724494 720340431 /nfs/dbraw/zinc/34/04/31/720340431.db2.gz KJOFHJTZKZMZLP-RTBURBONSA-N 1 1 423.904 3.318 20 0 HGADMO COC(=O)c1ccc2nc(Cl)c(N3CC[C@@H]4[C@H]3CC[N@H+]4Cc3cccnc3)nc2c1 ZINC001164724494 720340437 /nfs/dbraw/zinc/34/04/37/720340437.db2.gz KJOFHJTZKZMZLP-RTBURBONSA-N 1 1 423.904 3.318 20 0 HGADMO COC(=O)c1ccc2nc(Cl)c(N3CC[C@@H]4[C@@H]3CC[N@@H+]4Cc3cccnc3)nc2c1 ZINC001164724488 720340741 /nfs/dbraw/zinc/34/07/41/720340741.db2.gz KJOFHJTZKZMZLP-MOPGFXCFSA-N 1 1 423.904 3.318 20 0 HGADMO COC(=O)c1ccc2nc(Cl)c(N3CC[C@@H]4[C@@H]3CC[N@H+]4Cc3cccnc3)nc2c1 ZINC001164724488 720340747 /nfs/dbraw/zinc/34/07/47/720340747.db2.gz KJOFHJTZKZMZLP-MOPGFXCFSA-N 1 1 423.904 3.318 20 0 HGADMO CCOC(=O)c1c(C)nc(Cl)cc1N1CC[C@H]2[C@@H]1CC[N@H+]2Cc1cccnc1 ZINC001164730328 720364115 /nfs/dbraw/zinc/36/41/15/720364115.db2.gz WSAJSNJLEXCPET-IRXDYDNUSA-N 1 1 400.910 3.468 20 0 HGADMO c1cncc(C[N@H+]2CC[C@H]3[C@@H]2CCN3c2ccc(-c3ccc4c(c3)OCCO4)nn2)c1 ZINC001164734744 720441960 /nfs/dbraw/zinc/44/19/60/720441960.db2.gz TZXBXDOVVJNCPI-SFTDATJTSA-N 1 1 415.497 3.163 20 0 HGADMO CCOC(=O)c1ccc(C)c(N2CC[C@@H]3[C@H](C[C@H](Cn4cccn4)[N@H+]3C(C)C)C2)n1 ZINC001164832842 720505389 /nfs/dbraw/zinc/50/53/89/720505389.db2.gz BNJNNOHRYYHSSS-SFHLNBCPSA-N 1 1 411.550 3.141 20 0 HGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@H]2CN(C(F)(F)c3cnc(Cl)cn3)CC[C@@H]21 ZINC001164832974 720514063 /nfs/dbraw/zinc/51/40/63/720514063.db2.gz CEWQGSAJTCUYOG-JYJNAYRXSA-N 1 1 410.900 3.249 20 0 HGADMO CSc1ncc(Cl)c(N2CC[C@@H]3[C@@H](C[C@H](Cn4cccn4)[N@H+]3C(C)C)C2)n1 ZINC001164833829 720518100 /nfs/dbraw/zinc/51/81/00/720518100.db2.gz DRKJNHOLUUGWDR-ZMSDIMECSA-N 1 1 406.987 3.426 20 0 HGADMO CCOC(=O)c1cc(C)cc(N2CC[C@@H]3[C@@H](C[C@H](Cn4cccn4)[N@H+]3C(C)C)C2)n1 ZINC001164834872 720519353 /nfs/dbraw/zinc/51/93/53/720519353.db2.gz HTSJFHCWLMRSAS-QKNQBKEWSA-N 1 1 411.550 3.141 20 0 HGADMO COc1ccc2c(c1)ncnc2N1CC[C@@H]2[C@@H](C[C@H](Cn3cccn3)[N@H+]2C(C)C)C1 ZINC001164834950 720544743 /nfs/dbraw/zinc/54/47/43/720544743.db2.gz GBBVRBIWDZQQKT-NJNPRVFISA-N 1 1 406.534 3.213 20 0 HGADMO CCOC(=O)c1cc(C)cnc1N1CC[C@@H]2[C@@H](C[C@H](Cn3cccn3)[N@H+]2C(C)C)C1 ZINC001164836336 720547252 /nfs/dbraw/zinc/54/72/52/720547252.db2.gz JOUUFMOOWKPKOS-QKNQBKEWSA-N 1 1 411.550 3.141 20 0 HGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@@H]2CN(c3ncnc4cc(Cl)cnc43)CC[C@@H]21 ZINC001164836600 720559093 /nfs/dbraw/zinc/55/90/93/720559093.db2.gz KFFDUNBSINZJBT-AYBZRNKSSA-N 1 1 411.941 3.253 20 0 HGADMO COC(OC)c1cc(C)cnc1N1CC[C@@H]2[C@@H](C[C@@H](Cn3cccn3)[N@H+]2C(C)C)C1 ZINC001164843524 720583795 /nfs/dbraw/zinc/58/37/95/720583795.db2.gz XSPNSLIFWXATEU-IRFCIJBXSA-N 1 1 413.566 3.256 20 0 HGADMO COc1cc2cnc(N3CCc4ncc(C[NH+]5CCCC5)n4CC3)cc2cc1OC ZINC001164736716 720586638 /nfs/dbraw/zinc/58/66/38/720586638.db2.gz ROVUBMPJBLYXHP-UHFFFAOYSA-N 1 1 407.518 3.107 20 0 HGADMO C=Cc1nc(Cl)nc(N2CC[C@@H]3[C@H](C[C@H](Cn4cccn4)[N@H+]3C(C)C)C2)c1OC ZINC001164841181 720595627 /nfs/dbraw/zinc/59/56/27/720595627.db2.gz RRFXBGUNBFFPPG-JFIYKMOQSA-N 1 1 416.957 3.356 20 0 HGADMO CCOC(=O)c1c(C)ncnc1N1CCC2(C[C@@H]([N@@H+](C)Cc3ccccc3)CO2)CC1 ZINC001164842686 720692982 /nfs/dbraw/zinc/69/29/82/720692982.db2.gz MOEBQUUOWWBCLC-HXUWFJFHSA-N 1 1 424.545 3.222 20 0 HGADMO C[C@@H]1CC(=O)Nc2ncnc(N3CCC4(C[C@H]([N@@H+](C)Cc5ccccc5)CO4)CC3)c21 ZINC001164844810 720693000 /nfs/dbraw/zinc/69/30/00/720693000.db2.gz UYWHCMMPNDCFPX-MJGOQNOKSA-N 1 1 421.545 3.182 20 0 HGADMO COC(=O)c1cc(N2CCC3(C[C@@H]([N@@H+](C)Cc4ccccc4)CO3)CC2)ncc1C ZINC001164844886 720697700 /nfs/dbraw/zinc/69/77/00/720697700.db2.gz VVISVMLAVHVYBW-HXUWFJFHSA-N 1 1 409.530 3.437 20 0 HGADMO Cc1cn(-c2ccc(N3CCC4(C[C@H]([N@@H+](C)Cc5ccccc5)CO4)CC3)nn2)cn1 ZINC001164839356 720703236 /nfs/dbraw/zinc/70/32/36/720703236.db2.gz LKOKGFTWRQBLBQ-NRFANRHFSA-N 1 1 418.545 3.231 20 0 HGADMO CCn1cnc2c1ncnc2N1CCC2(C[C@H]([N@@H+](C)Cc3ccccc3)CO2)CC1 ZINC001164840929 720713382 /nfs/dbraw/zinc/71/33/82/720713382.db2.gz SSGOHKLHOMRONM-IBGZPJMESA-N 1 1 406.534 3.106 20 0 HGADMO Clc1ccc2ncnc(N3CC[C@@H]4[C@@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)c2c1 ZINC001164743854 720816812 /nfs/dbraw/zinc/81/68/12/720816812.db2.gz SWDYZDOPVLPRBB-DJPFJPOOSA-N 1 1 423.952 3.254 20 0 HGADMO COC[C@@]12CCCO[C@H]1CCN(c1ncnc3c1CC[N@H+](Cc1ccccc1)C3)C2 ZINC001164851044 720825842 /nfs/dbraw/zinc/82/58/42/720825842.db2.gz WJADUFLBWFOKCT-UPVQGACJSA-N 1 1 408.546 3.057 20 0 HGADMO COC[C@@]12CCCO[C@H]1CCN(c1ncnc3c1CC[N@@H+](Cc1ccccc1)C3)C2 ZINC001164851044 720825845 /nfs/dbraw/zinc/82/58/45/720825845.db2.gz WJADUFLBWFOKCT-UPVQGACJSA-N 1 1 408.546 3.057 20 0 HGADMO COc1ccc2ccc(N3CC[C@@H]4[C@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)nc2c1 ZINC001164742973 720835428 /nfs/dbraw/zinc/83/54/28/720835428.db2.gz HPVADJSDDKSYCS-ZRCGQRJVSA-N 1 1 418.545 3.214 20 0 HGADMO COCC[N@H+]1CCO[C@H]2CN(C(F)(F)c3cnc(Cl)cc3Cl)CC[C@@H]2C1 ZINC001164857128 720837588 /nfs/dbraw/zinc/83/75/88/720837588.db2.gz XQOGRPJZOMLACV-DOMZBBRYSA-N 1 1 410.292 3.107 20 0 HGADMO COc1ccc2ccnc(N3CC[C@@H]4[C@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)c2c1 ZINC001164741155 720841135 /nfs/dbraw/zinc/84/11/35/720841135.db2.gz DLMMKNISAILCOA-TXTKFYIRSA-N 1 1 418.545 3.214 20 0 HGADMO Fc1cccc2ccc(N3CC[C@@H]4[C@@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)nc12 ZINC001164742383 720841719 /nfs/dbraw/zinc/84/17/19/720841719.db2.gz GEODDBNWWGOUSX-QKNQBKEWSA-N 1 1 406.509 3.345 20 0 HGADMO COc1cccc2c1ccnc2N1CC[C@@H]2[C@@H](C[C@@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164739542 720850832 /nfs/dbraw/zinc/85/08/32/720850832.db2.gz BATQEWWUBFFDRG-CNNODRBYSA-N 1 1 418.545 3.214 20 0 HGADMO Cc1cc(N2CC[C@@H]3[C@H](C[C@@H](Cn4cncn4)[N@H+]3CC3CC3)C2)nc(-c2ccco2)n1 ZINC001164751202 720851676 /nfs/dbraw/zinc/85/16/76/720851676.db2.gz QRLMAOUVEKKAED-HSALFYBXSA-N 1 1 419.533 3.016 20 0 HGADMO c1cc(-c2ccc(N3CC[C@H]4[C@@H](C[C@@H](Cn5cncn5)[N@@H+]4CC4CC4)C3)nn2)cs1 ZINC001164749691 720855352 /nfs/dbraw/zinc/85/53/52/720855352.db2.gz OAWZZMMJLBJXLD-ZJOUEHCJSA-N 1 1 421.574 3.176 20 0 HGADMO c1cncc(COC[C@H]2C[N@@H+](CC3CC3)C[C@@]23CCN(c2ncnc4c2CCC4)C3)c1 ZINC001164755317 720874733 /nfs/dbraw/zinc/87/47/33/720874733.db2.gz WMXKITJJPZKTOO-PXDATVDWSA-N 1 1 419.573 3.115 20 0 HGADMO c1cncc(COC[C@@H]2C[N@@H+](CC3CC3)C[C@]23CCN(c2ncnc4c2CCC4)C3)c1 ZINC001164755316 720875058 /nfs/dbraw/zinc/87/50/58/720875058.db2.gz WMXKITJJPZKTOO-OFVILXPXSA-N 1 1 419.573 3.115 20 0 HGADMO COCC[N@H+]1CCO[C@H]2CN(c3nnc(Cl)c4ccc(Cl)cc43)CC[C@@H]2C1 ZINC001164863771 720884010 /nfs/dbraw/zinc/88/40/10/720884010.db2.gz UDZKADSRGOVHDJ-DYVFJYSZSA-N 1 1 411.333 3.110 20 0 HGADMO C[N@@H+](Cc1ccc(N2CCC3(C2)CCN(C(=O)c2cccnc2)CC3)nc1)C1CC1 ZINC001164859386 720894951 /nfs/dbraw/zinc/89/49/51/720894951.db2.gz PGAVLHANJGHSJR-UHFFFAOYSA-N 1 1 405.546 3.204 20 0 HGADMO CCOc1cc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COCc2cccnc2)ncn1 ZINC001164748467 720911375 /nfs/dbraw/zinc/91/13/75/720911375.db2.gz GESKFSQEZZKDJW-XUZZJYLKSA-N 1 1 423.561 3.025 20 0 HGADMO COC(=O)c1ccc2cnc(N3CCn4c(C[N@@H+](C)C(C)C)cnc4[C@H]3C)nc2c1 ZINC001164853961 720932616 /nfs/dbraw/zinc/93/26/16/720932616.db2.gz CWIMQEURJLKUIR-OAHLLOKOSA-N 1 1 408.506 3.034 20 0 HGADMO CC(C)[N@@H+](C)Cc1cnc2n1CCN(c1nc(-c3ccccc3)nc(N(C)C)n1)[C@@H]2C ZINC001164860571 720975159 /nfs/dbraw/zinc/97/51/59/720975159.db2.gz OTFKXDOVQZBQPW-QGZVFWFLSA-N 1 1 420.565 3.223 20 0 HGADMO C[N@@H+](Cc1ccc(N2CCC[C@@]3(C[C@H](OCc4ccccn4)CO3)C2)nc1)C1CC1 ZINC001164765365 721030861 /nfs/dbraw/zinc/03/08/61/721030861.db2.gz OVGNMPLFJBDSBM-LADGPHEKSA-N 1 1 408.546 3.416 20 0 HGADMO Fc1c(Cl)nccc1C(F)(F)N1CC[N@H+]2C[C@@H](OCc3cccnc3)C[C@@H]2C1 ZINC001164866265 721050450 /nfs/dbraw/zinc/05/04/50/721050450.db2.gz DJPKINRHZFXSOA-CABCVRRESA-N 1 1 412.843 3.294 20 0 HGADMO CSc1nc2sccc2c(N2C[C@@H]3CC[N@@H+](Cc4cnn(C)c4)C[C@H]3C2)n1 ZINC001164765634 721082976 /nfs/dbraw/zinc/08/29/76/721082976.db2.gz JFEIPAWHINZPLE-GJZGRUSLSA-N 1 1 400.577 3.105 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4nc(Cl)nc5ccc(F)cc54)C[C@H]3C2)cn1 ZINC001164771199 721084582 /nfs/dbraw/zinc/08/45/82/721084582.db2.gz ROEOECVOWDPORR-LSDHHAIUSA-N 1 1 400.889 3.114 20 0 HGADMO Cc1ccc(C(F)(F)N2CC[N@H+]3C[C@H](OCc4cccnc4)C[C@@H]3C2)nc1Cl ZINC001164864864 721094539 /nfs/dbraw/zinc/09/45/39/721094539.db2.gz GYMICPDKXIIZHU-IAGOWNOFSA-N 1 1 408.880 3.463 20 0 HGADMO Cc1cccc(-c2ccc(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@@H]4C3)nn2)c1 ZINC001164878973 721146860 /nfs/dbraw/zinc/14/68/60/721146860.db2.gz RDGAAKFPKNMLNH-YADHBBJMSA-N 1 1 401.514 3.327 20 0 HGADMO COc1cccc(-c2ccc(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@H]4C3)nn2)c1 ZINC001164874453 721147789 /nfs/dbraw/zinc/14/77/89/721147789.db2.gz KAVLYCLGXKQUAQ-RBBKRZOGSA-N 1 1 417.513 3.027 20 0 HGADMO Fc1ccccc1-c1ccc(N2CC[N@H+]3C[C@H](OCc4cccnc4)C[C@H]3C2)nn1 ZINC001164877635 721162749 /nfs/dbraw/zinc/16/27/49/721162749.db2.gz PJPGKZHWGYNQBH-RBUKOAKNSA-N 1 1 405.477 3.157 20 0 HGADMO CCOC(=O)c1cc2ccccc2nc1N1C[C@@H]2CC[N@@H+](Cc3cnn(C)c3)C[C@@H]2C1 ZINC001164773904 721164010 /nfs/dbraw/zinc/16/40/10/721164010.db2.gz YFZLVEIGZGDTEG-VQTJNVASSA-N 1 1 419.529 3.103 20 0 HGADMO CCOC(=O)c1cc2ccccc2nc1N1C[C@@H]2CC[N@@H+](Cc3cnn(C)c3)C[C@H]2C1 ZINC001164773902 721165140 /nfs/dbraw/zinc/16/51/40/721165140.db2.gz YFZLVEIGZGDTEG-PMACEKPBSA-N 1 1 419.529 3.103 20 0 HGADMO CSc1ccc2ncnc(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@@H]4C3)c2c1 ZINC001164878635 721180322 /nfs/dbraw/zinc/18/03/22/721180322.db2.gz QTWPWRHSLOSFGB-MSOLQXFVSA-N 1 1 407.543 3.226 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4cc(F)cc5ncnc(Cl)c54)C[C@@H]3C2)cn1 ZINC001164772347 721181123 /nfs/dbraw/zinc/18/11/23/721181123.db2.gz SQBGDNAVBMXQDL-GJZGRUSLSA-N 1 1 400.889 3.114 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4cc(-c5cccc(Cl)c5)ncn4)C[C@@H]3C2)cn1 ZINC001164773855 721209146 /nfs/dbraw/zinc/20/91/46/721209146.db2.gz XMCHNJGYTSENCQ-OALUTQOASA-N 1 1 408.937 3.489 20 0 HGADMO Cc1c(Cl)nc(CC(C)C)nc1N1C[C@@H]2CC[N@@H+](Cc3cnn(C)c3)C[C@@H]2C1 ZINC001164763941 721234191 /nfs/dbraw/zinc/23/41/91/721234191.db2.gz OHBMFIUUECDXRR-ZWKOTPCHSA-N 1 1 402.974 3.329 20 0 HGADMO Cc1cc(-c2ccccc2F)nnc1N1C[C@H]2CC[N@H+](Cc3cnn(C)c3)C[C@@H]2C1 ZINC001164761545 721237105 /nfs/dbraw/zinc/23/71/05/721237105.db2.gz JJLGDCZRBKMTHT-RTBURBONSA-N 1 1 406.509 3.283 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4ccnc(CSc5ccccc5)n4)C[C@@H]3C2)cn1 ZINC001164769861 721238648 /nfs/dbraw/zinc/23/86/48/721238648.db2.gz ZWFPFABCCCHRLV-UXHICEINSA-N 1 1 420.586 3.461 20 0 HGADMO Cc1cnc(N2C[C@@H]3C[N@@H+](Cc4cnn(C)c4)CC[C@@H]3C2)nc1-c1ccccc1F ZINC001164762502 721239008 /nfs/dbraw/zinc/23/90/08/721239008.db2.gz LASHFJIZMPGZBA-MOPGFXCFSA-N 1 1 406.509 3.283 20 0 HGADMO CC(C)(c1ccnc(Cl)c1)[N@H+]1C[C@@H]2OCC[C@H]2[C@H](C(=O)NCc2cccnc2)C1 ZINC001164877438 721305798 /nfs/dbraw/zinc/30/57/98/721305798.db2.gz ITUKUPMWOJJDOR-OTWHNJEPSA-N 1 1 414.937 3.018 20 0 HGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@@]2(CCCN(c3c(C)nc(C)nc3Cl)C2)C1 ZINC001164776682 721346389 /nfs/dbraw/zinc/34/63/89/721346389.db2.gz CBOFZICPENQJAH-NRFANRHFSA-N 1 1 419.957 3.471 20 0 HGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@@]2(CCCN(c3c(C)nc(C)nc3Cl)C2)C1 ZINC001164776682 721346395 /nfs/dbraw/zinc/34/63/95/721346395.db2.gz CBOFZICPENQJAH-NRFANRHFSA-N 1 1 419.957 3.471 20 0 HGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@]2(CCCN(c3ccc4ncccc4n3)C2)C1 ZINC001164779046 721347286 /nfs/dbraw/zinc/34/72/86/721347286.db2.gz PNYFAVGLLAHRNR-HSZRJFAPSA-N 1 1 407.518 3.354 20 0 HGADMO CCSc1cncc(N2CCC[C@@]3(C2)COCC[N@H+](Cc2c(C)noc2C)C3)n1 ZINC001164780010 721368619 /nfs/dbraw/zinc/36/86/19/721368619.db2.gz BZCORFZLQWEGLH-OAQYLSRUSA-N 1 1 417.579 3.312 20 0 HGADMO CCSc1cncc(N2CCC[C@@]3(C2)COCC[N@@H+](Cc2c(C)noc2C)C3)n1 ZINC001164780010 721368621 /nfs/dbraw/zinc/36/86/21/721368621.db2.gz BZCORFZLQWEGLH-OAQYLSRUSA-N 1 1 417.579 3.312 20 0 HGADMO CCC[N@H+]1CCCC[C@H]1c1ccc(N2CC[C@]3(CC(=O)N(c4cnn(C)c4)C3)C2)nc1 ZINC001164886599 721373661 /nfs/dbraw/zinc/37/36/61/721373661.db2.gz MOEBWCDFPYGWAK-URXFXBBRSA-N 1 1 422.577 3.386 20 0 HGADMO COCc1cc(N2C[C@H]3C[NH+](Cc4nccs4)C[C@@H]3C2)nc(-c2ccccc2)n1 ZINC001164790714 721393352 /nfs/dbraw/zinc/39/33/52/721393352.db2.gz XMDJCLUJYVJHNU-QZTJIDSGSA-N 1 1 407.543 3.315 20 0 HGADMO C[NH+]1CCN(C[C@@H]2CCC[C@]3(CCN(c4cc(Cl)nc5ncccc45)C3)O2)CC1 ZINC001164883638 721405535 /nfs/dbraw/zinc/40/55/35/721405535.db2.gz BOVPFPHBAYSCDK-HTAPYJJXSA-N 1 1 415.969 3.049 20 0 HGADMO C[NH+]1CCN(C[C@@H]2CCC[C@@]3(CCN(c4cc(Cl)nc5ncccc45)C3)O2)CC1 ZINC001164883639 721406011 /nfs/dbraw/zinc/40/60/11/721406011.db2.gz BOVPFPHBAYSCDK-JTSKRJEESA-N 1 1 415.969 3.049 20 0 HGADMO C[NH+]1CCN(C[C@H]2CCC[C@@]3(CCN(c4nc(Cl)cc(C(C)(C)C)n4)C3)O2)CC1 ZINC001164891479 721428625 /nfs/dbraw/zinc/42/86/25/721428625.db2.gz GOFXMQANDFLIIK-VGSWGCGISA-N 1 1 422.017 3.193 20 0 HGADMO COc1cccc2c1ccnc2N1CC[C@@]2(C1)CCC[C@H](CN1CC[NH+](C)CC1)O2 ZINC001164896208 721439873 /nfs/dbraw/zinc/43/98/73/721439873.db2.gz RBYHSBRQSHEKSW-NTKDMRAZSA-N 1 1 410.562 3.009 20 0 HGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1ncnc3ccccc31)CC2 ZINC001164788677 721451400 /nfs/dbraw/zinc/45/14/00/721451400.db2.gz SMIIJBMUTNVQSH-FQEVSTJZSA-N 1 1 410.562 3.364 20 0 HGADMO CCC[N@H+]1CCCC[C@@H]1c1ccc(N2CC[C@@H]3O[C@@H](C(=O)NCC4CC4)C[C@H]32)nc1 ZINC001164890846 721459366 /nfs/dbraw/zinc/45/93/66/721459366.db2.gz SSUGUAFZTLFYPH-YUMYIRISSA-N 1 1 412.578 3.281 20 0 HGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1nc(C)cc(SC)n1)CC2 ZINC001164786865 721459820 /nfs/dbraw/zinc/45/98/20/721459820.db2.gz QBJRIGIJZOYHRP-LJQANCHMSA-N 1 1 420.623 3.241 20 0 HGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1nccc3ncsc31)CC2 ZINC001164785509 721464182 /nfs/dbraw/zinc/46/41/82/721464182.db2.gz LVRXORYLIBOGBW-GOSISDBHSA-N 1 1 416.591 3.425 20 0 HGADMO COC(=O)c1cc(OC)cnc1N1CCC2(CC([N@@H+](C)Cc3ccncc3)C2)CC1 ZINC001164793012 721493430 /nfs/dbraw/zinc/49/34/30/721493430.db2.gz ZCKZBFCGUFPZQO-UHFFFAOYSA-N 1 1 410.518 3.153 20 0 HGADMO COC(=O)c1cnc(Cl)cc1N1CC[N@H+]2C[C@@H](Oc3cccc(F)c3)C[C@@H]2C1 ZINC001164900262 721511166 /nfs/dbraw/zinc/51/11/66/721511166.db2.gz PGBGVPIUZUOMIM-ZBFHGGJFSA-N 1 1 405.857 3.003 20 0 HGADMO CCOC(=O)/C=C/c1cccnc1N1CC[N@H+]2C[C@H](Oc3cccc(F)c3)C[C@H]2C1 ZINC001164902234 721513904 /nfs/dbraw/zinc/51/39/04/721513904.db2.gz ZZNUCMNUTZVNKX-PYVMNZDGSA-N 1 1 411.477 3.139 20 0 HGADMO CC1(C)OCc2c1nc(Cl)nc2N1CC[N@H+]2C[C@@H](Oc3cccc(F)c3)C[C@H]2C1 ZINC001164901686 721524532 /nfs/dbraw/zinc/52/45/32/721524532.db2.gz XYJNBCYZAIHITI-HOCLYGCPSA-N 1 1 418.900 3.376 20 0 HGADMO Cc1cc(C(F)(F)N2CC[N@H+]3C[C@@H](Oc4cccc(F)c4)C[C@H]3C2)nc(Cl)n1 ZINC001164900061 721526378 /nfs/dbraw/zinc/52/63/78/721526378.db2.gz NQMQYYMTWWTZDC-HOCLYGCPSA-N 1 1 412.843 3.464 20 0 HGADMO Cc1cc(C(F)(F)N2C[C@H]([N@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@@H]32)nc(Cl)n1 ZINC001164799167 721545255 /nfs/dbraw/zinc/54/52/55/721545255.db2.gz BAIQMMTYKKIPHV-XYJFISCASA-N 1 1 423.895 3.247 20 0 HGADMO Cc1cc(C(F)(F)N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@@H]32)nc(Cl)n1 ZINC001164799167 721545258 /nfs/dbraw/zinc/54/52/58/721545258.db2.gz BAIQMMTYKKIPHV-XYJFISCASA-N 1 1 423.895 3.247 20 0 HGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2nc(Cl)nc3c2SCC3)[C@H]2CCCO[C@@H]12 ZINC001164807247 721545894 /nfs/dbraw/zinc/54/58/94/721545894.db2.gz QVYNOSFFBRVFOA-GVDBMIGSSA-N 1 1 417.966 3.041 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2nc(Cl)nc3c2SCC3)[C@H]2CCCO[C@@H]12 ZINC001164807247 721545899 /nfs/dbraw/zinc/54/58/99/721545899.db2.gz QVYNOSFFBRVFOA-GVDBMIGSSA-N 1 1 417.966 3.041 20 0 HGADMO CCOCc1cnc(Cl)nc1N1CC[N@H+]2C[C@H](Oc3cccc(F)c3)C[C@H]2C1 ZINC001164909834 721549077 /nfs/dbraw/zinc/54/90/77/721549077.db2.gz SBNRSBCRPUFTNZ-FUHWJXTLSA-N 1 1 406.889 3.148 20 0 HGADMO CCOCc1cnc(Cl)nc1N1CC[N@H+]2C[C@@H](Oc3cccc(F)c3)C[C@H]2C1 ZINC001164909837 721549261 /nfs/dbraw/zinc/54/92/61/721549261.db2.gz SBNRSBCRPUFTNZ-WMZOPIPTSA-N 1 1 406.889 3.148 20 0 HGADMO Nc1cc(C(F)(F)N2CC[N@H+]3C[C@@H](Oc4cccc(F)c4)C[C@@H]3C2)cnc1Cl ZINC001164911410 721550981 /nfs/dbraw/zinc/55/09/81/721550981.db2.gz WQVJDNVXPDLMSF-ZBFHGGJFSA-N 1 1 412.843 3.343 20 0 HGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN([C@H](F)Oc2cccc(Cl)n2)[C@@H]2CCCO[C@H]12 ZINC001164798543 721554411 /nfs/dbraw/zinc/55/44/11/721554411.db2.gz BGTYMGKSRIAWSM-YKCBXCCJSA-N 1 1 406.889 3.126 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN([C@H](F)Oc2cccc(Cl)n2)[C@@H]2CCCO[C@H]12 ZINC001164798543 721554415 /nfs/dbraw/zinc/55/44/15/721554415.db2.gz BGTYMGKSRIAWSM-YKCBXCCJSA-N 1 1 406.889 3.126 20 0 HGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(C(F)(F)c2cnc(Cl)cc2N)[C@H]2CCCO[C@@H]12 ZINC001164808640 721557540 /nfs/dbraw/zinc/55/75/40/721557540.db2.gz VGYANMZFGZPKFS-YQVWRLOYSA-N 1 1 423.895 3.125 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(C(F)(F)c2cnc(Cl)cc2N)[C@H]2CCCO[C@@H]12 ZINC001164808640 721557543 /nfs/dbraw/zinc/55/75/43/721557543.db2.gz VGYANMZFGZPKFS-YQVWRLOYSA-N 1 1 423.895 3.125 20 0 HGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(C(F)(F)c2cnc(Cl)cc2N)[C@H]2CCCO[C@H]12 ZINC001164808635 721557551 /nfs/dbraw/zinc/55/75/51/721557551.db2.gz VGYANMZFGZPKFS-SCTDSRPQSA-N 1 1 423.895 3.125 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(C(F)(F)c2cnc(Cl)cc2N)[C@H]2CCCO[C@H]12 ZINC001164808635 721557554 /nfs/dbraw/zinc/55/75/54/721557554.db2.gz VGYANMZFGZPKFS-SCTDSRPQSA-N 1 1 423.895 3.125 20 0 HGADMO CCCSc1ncnc(N2CC[N@H+]3C[C@@H](Oc4cccc(F)c4)C[C@@H]3C2)c1OC ZINC001164904207 721566651 /nfs/dbraw/zinc/56/66/51/721566651.db2.gz DJIZPNFNEZLRPQ-AEFFLSMTSA-N 1 1 418.538 3.468 20 0 HGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2CCO[C@@]3(CCCN(c4cnccn4)C3)C2)nc1 ZINC001164903414 721580838 /nfs/dbraw/zinc/58/08/38/721580838.db2.gz NENITASZZFGSGW-ZJSXRUAMSA-N 1 1 422.577 3.294 20 0 HGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2cc(-c3cccs3)ncn2)[C@H]2CCCO[C@@H]12 ZINC001164799247 721581920 /nfs/dbraw/zinc/58/19/20/721581920.db2.gz ABGJMNGRQVOBHA-NNMXDRDESA-N 1 1 407.543 3.468 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2cc(-c3cccs3)ncn2)[C@H]2CCCO[C@@H]12 ZINC001164799247 721581922 /nfs/dbraw/zinc/58/19/22/721581922.db2.gz ABGJMNGRQVOBHA-NNMXDRDESA-N 1 1 407.543 3.468 20 0 HGADMO CCN(C)c1ccnc(N2CCC(F)(F)[C@]3(CC[N@@H+](Cc4ccccn4)C3)C2)n1 ZINC001164902975 721582938 /nfs/dbraw/zinc/58/29/38/721582938.db2.gz KCXUCWILZLLYFU-FQEVSTJZSA-N 1 1 402.493 3.065 20 0 HGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2ccc(-c3ccsc3)nn2)[C@@H]2CCCO[C@H]12 ZINC001164811294 721587196 /nfs/dbraw/zinc/58/71/96/721587196.db2.gz XDRNXKONYWWAKJ-SJBKTWHCSA-N 1 1 407.543 3.468 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2ccc(-c3ccsc3)nn2)[C@@H]2CCCO[C@H]12 ZINC001164811294 721587198 /nfs/dbraw/zinc/58/71/98/721587198.db2.gz XDRNXKONYWWAKJ-SJBKTWHCSA-N 1 1 407.543 3.468 20 0 HGADMO COC(=O)c1ccnc(N2CCc3c(C[N@H+](C)Cc4ccco4)cncc3C2)c1C ZINC001164908853 721749808 /nfs/dbraw/zinc/74/98/08/721749808.db2.gz MDWFRTWCZFYRKR-UHFFFAOYSA-N 1 1 406.486 3.359 20 0 HGADMO COC(=O)c1ccnc(N2CCc3c(C[N@@H+](C)Cc4ccco4)cncc3C2)c1C ZINC001164908853 721749816 /nfs/dbraw/zinc/74/98/16/721749816.db2.gz MDWFRTWCZFYRKR-UHFFFAOYSA-N 1 1 406.486 3.359 20 0 HGADMO COC(=O)c1cc(OC)cnc1N1C[C@@H]2CCC[C@@H]([N@@H+](C)Cc3ccccn3)[C@H]2C1 ZINC001165024049 721807309 /nfs/dbraw/zinc/80/73/09/721807309.db2.gz KVVSHVDYPNKTGG-ORYQWCPZSA-N 1 1 410.518 3.009 20 0 HGADMO Cn1cnc2c1nc(Cl)nc2N1C[C@@H]2CCC[C@@H]([N@@H+](C)Cc3ccccn3)[C@@H]2C1 ZINC001165018581 721808585 /nfs/dbraw/zinc/80/85/85/721808585.db2.gz BJVLVNUMQUAHTK-USXIJHARSA-N 1 1 411.941 3.149 20 0 HGADMO C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@H]2CN(c3[nH]c4cc(=O)[nH]c-4cc3Cl)C[C@@H]21 ZINC001165022719 721813981 /nfs/dbraw/zinc/81/39/81/721813981.db2.gz GWBKJKNKYLBXIH-DKICVRJWSA-N 1 1 411.937 3.362 20 0 HGADMO COC(=O)c1cc2c[nH]c(N3C[C@@H]4CCC[C@@H]([N@@H+](C)Cc5ccccn5)[C@H]4C3)cc-2n1 ZINC001165025524 721820321 /nfs/dbraw/zinc/82/03/21/721820321.db2.gz NEBBWKQOTVVWCK-XWFZLUIHSA-N 1 1 419.529 3.481 20 0 HGADMO CCCNC(=O)c1ccc(N2C[C@@H]3CCC[C@@H]([N@@H+](C)Cc4ccccn4)[C@H]3C2)nc1 ZINC001165030510 721824610 /nfs/dbraw/zinc/82/46/10/721824610.db2.gz ZNMKCWXXAHNPJH-ILWGZMRPSA-N 1 1 407.562 3.353 20 0 HGADMO Cc1nc(CN2CCOC[C@]3(CN(c4[nH+]ccc5ccc(C)cc54)CCO3)C2)cs1 ZINC001164925522 721827499 /nfs/dbraw/zinc/82/74/99/721827499.db2.gz RSYQWCGBUZFSPS-HSZRJFAPSA-N 1 1 424.570 3.416 20 0 HGADMO CN(C)CC[N@H+]1CC[C@@H]2[C@@H]1CCN2c1nc(-c2ccccc2)nc(-c2ccccc2)n1 ZINC001164924074 721861401 /nfs/dbraw/zinc/86/14/01/721861401.db2.gz BSHYMQJXEVDRHB-FCHUYYIVSA-N 1 1 414.557 3.420 20 0 HGADMO C[NH+](C)CCN1CC[C@@H]2[C@@H]1CCN2c1nc(-c2ccccc2)nc(-c2ccccc2)n1 ZINC001164924074 721861403 /nfs/dbraw/zinc/86/14/03/721861403.db2.gz BSHYMQJXEVDRHB-FCHUYYIVSA-N 1 1 414.557 3.420 20 0 HGADMO COC(=O)c1cnc(N2CCC3(CC2)C[N@@H+](Cc2ccc(C)cc2)CCO3)c(F)c1 ZINC001164940925 721925157 /nfs/dbraw/zinc/92/51/57/721925157.db2.gz WRENMRIOZYKCIT-UHFFFAOYSA-N 1 1 413.493 3.187 20 0 HGADMO Cc1ccc(C[N@H+]2CCOC3(CCN(c4ncnc5c4[C@H](C)CC(=O)N5)CC3)C2)cc1 ZINC001164940429 721926585 /nfs/dbraw/zinc/92/65/85/721926585.db2.gz QFNZEBNPNYXGMA-GOSISDBHSA-N 1 1 421.545 3.102 20 0 HGADMO Cc1ccc(C[N@H+]2CCOC3(CCN(c4ccc5ccc(=O)n(C)c5n4)CC3)C2)cc1 ZINC001164940479 721926855 /nfs/dbraw/zinc/92/68/55/721926855.db2.gz RHZSQUXQYVHMQP-UHFFFAOYSA-N 1 1 418.541 3.113 20 0 HGADMO Cc1ccc(C[N@H+]2CCOC3(CCN(c4cncc(N5CCCC5)n4)CC3)C2)cc1 ZINC001164938596 721929084 /nfs/dbraw/zinc/92/90/84/721929084.db2.gz ADPGGDFLTKBNAZ-UHFFFAOYSA-N 1 1 407.562 3.257 20 0 HGADMO CCOc1ccc(NS(=O)(=O)c2cccnc2N2CCC(C[NH+](C)C)CC2)cc1 ZINC001165045253 721947700 /nfs/dbraw/zinc/94/77/00/721947700.db2.gz OXJZTYNEHFVJLG-UHFFFAOYSA-N 1 1 418.563 3.059 20 0 HGADMO Cc1nc2ccc(F)cc2c(N2CCC3(CC2)C(=O)NCC[N@H+]3Cc2ccccc2)n1 ZINC001164943668 721972108 /nfs/dbraw/zinc/97/21/08/721972108.db2.gz BGZSTFRPCANBLG-UHFFFAOYSA-N 1 1 419.504 3.048 20 0 HGADMO Cc1nc2ccc(F)cc2c(N2CCC3(CC2)C(=O)NCC[N@@H+]3Cc2ccccc2)n1 ZINC001164943668 721972109 /nfs/dbraw/zinc/97/21/09/721972109.db2.gz BGZSTFRPCANBLG-UHFFFAOYSA-N 1 1 419.504 3.048 20 0 HGADMO CCc1cc2c(ncnc2N2CCC3(CC2)C(=O)NCC[N@H+]3Cc2ccccc2)s1 ZINC001164943673 721973967 /nfs/dbraw/zinc/97/39/67/721973967.db2.gz BHILZUOAOGCRSB-UHFFFAOYSA-N 1 1 421.570 3.225 20 0 HGADMO CCc1cc2c(ncnc2N2CCC3(CC2)C(=O)NCC[N@@H+]3Cc2ccccc2)s1 ZINC001164943673 721973969 /nfs/dbraw/zinc/97/39/69/721973969.db2.gz BHILZUOAOGCRSB-UHFFFAOYSA-N 1 1 421.570 3.225 20 0 HGADMO CC1(C)C(=O)NCCN1c1nc(C[NH+]2CCCCC2)nc2sc3c(c21)CCCC3 ZINC001165052257 721994880 /nfs/dbraw/zinc/99/48/80/721994880.db2.gz WCGXWBRPIMOPNL-UHFFFAOYSA-N 1 1 413.591 3.271 20 0 HGADMO CSc1nc(Cl)ncc1N1CCC2(CC1)COCC[N@@H+](Cc1ccncc1)C2 ZINC001164964081 722055754 /nfs/dbraw/zinc/05/57/54/722055754.db2.gz RHMRMANJTWWGNI-UHFFFAOYSA-N 1 1 419.982 3.366 20 0 HGADMO CC(C)(c1ccnc(Cl)c1)[N@H+]1C[C@H]2CN(S(C)(=O)=O)c3ccccc3[C@H]2C1 ZINC001164975052 722090989 /nfs/dbraw/zinc/09/09/89/722090989.db2.gz QCMLIWHDHQQKHZ-YOEHRIQHSA-N 1 1 405.951 3.465 20 0 HGADMO FC(F)(c1cccc(Cl)n1)N1CC[C@H]2C[N@@H+](Cc3cccnc3)CCO[C@@H]2C1 ZINC001164983406 722100585 /nfs/dbraw/zinc/10/05/85/722100585.db2.gz PYVPYQKCSVHCAO-DLBZAZTESA-N 1 1 408.880 3.402 20 0 HGADMO Clc1cccc2ncc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)nc12 ZINC001164983502 722106718 /nfs/dbraw/zinc/10/67/18/722106718.db2.gz QNJNVRYHKZSXRX-PXNSSMCTSA-N 1 1 409.921 3.406 20 0 HGADMO COc1cccc2ccc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)nc21 ZINC001164980104 722106985 /nfs/dbraw/zinc/10/69/85/722106985.db2.gz JIRMJFIYVWCAKC-IRLDBZIGSA-N 1 1 404.514 3.366 20 0 HGADMO COc1cccc2ccc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)nc21 ZINC001164980110 722107062 /nfs/dbraw/zinc/10/70/62/722107062.db2.gz JIRMJFIYVWCAKC-UNMCSNQZSA-N 1 1 404.514 3.366 20 0 HGADMO c1csc(-c2ccc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)nn2)c1 ZINC001164982535 722128050 /nfs/dbraw/zinc/12/80/50/722128050.db2.gz WYVWJZFNFRZKMS-QUCCMNQESA-N 1 1 407.543 3.327 20 0 HGADMO c1csc(-c2ccc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)nn2)c1 ZINC001164982529 722128167 /nfs/dbraw/zinc/12/81/67/722128167.db2.gz WYVWJZFNFRZKMS-AZUAARDMSA-N 1 1 407.543 3.327 20 0 HGADMO CC(C)n1ccc2c1ncnc2N1CC[C@@H]2C[N@@H+](Cc3cccnc3)CCO[C@H]2C1 ZINC001164978882 722136437 /nfs/dbraw/zinc/13/64/37/722136437.db2.gz KHWUULDLYNDEBK-CTNGQTDRSA-N 1 1 406.534 3.135 20 0 HGADMO c1cncc(C[N@H+]2CCO[C@H]3CN(c4ccc(-c5ccncc5)cn4)CC[C@@H]3C2)c1 ZINC001164985474 722138173 /nfs/dbraw/zinc/13/81/73/722138173.db2.gz ZPGZUAMJQJUGRO-PKTZIBPZSA-N 1 1 401.514 3.266 20 0 HGADMO Fc1ccc(-c2ccc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)nn2)cc1 ZINC001164976123 722145709 /nfs/dbraw/zinc/14/57/09/722145709.db2.gz HGYTXDWOHLMPFG-OFNKIYASSA-N 1 1 419.504 3.405 20 0 HGADMO Cc1csc2nc(C)nc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)c12 ZINC001164984574 722148077 /nfs/dbraw/zinc/14/80/77/722148077.db2.gz XCVLXYQBZOZZEU-RTBURBONSA-N 1 1 409.559 3.430 20 0 HGADMO Fc1ccc(-c2cncc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)n2)cc1 ZINC001164971141 722154044 /nfs/dbraw/zinc/15/40/44/722154044.db2.gz AUDYYFGZWJBRDS-OFNKIYASSA-N 1 1 419.504 3.405 20 0 HGADMO COC(=O)c1cc(Cl)nc(N2CCC[C@]3(CC[N@H+]3Cc3cccc(F)c3)C2)n1 ZINC001164993607 722192405 /nfs/dbraw/zinc/19/24/05/722192405.db2.gz FHQFWGIWKZAHDY-FQEVSTJZSA-N 1 1 404.873 3.301 20 0 HGADMO O=C1NCc2c1cc(Cl)nc2N1CCC[C@@]2(CC[N@@H+]2Cc2cccc(F)c2)C1 ZINC001164995506 722203855 /nfs/dbraw/zinc/20/38/55/722203855.db2.gz NVYBQWXXQRVICE-OAQYLSRUSA-N 1 1 400.885 3.362 20 0 HGADMO O=c1ccccn1-c1nccc(N2CCC[C@]3(CC[N@@H+]3Cc3cccc(F)c3)C2)n1 ZINC001164996261 722209029 /nfs/dbraw/zinc/20/90/29/722209029.db2.gz SIIVTXRHRZKJHU-QHCPKHFHSA-N 1 1 405.477 3.012 20 0 HGADMO C[C@@](CO)(Cc1ccc(Cl)cc1)[NH2+]Cc1nc(-c2ccc3c(c2)OCO3)no1 ZINC001560183522 1126209295 /nfs/dbraw/zinc/20/92/95/1126209295.db2.gz RBYQQEQMRAASLK-FQEVSTJZSA-N 1 1 401.850 3.202 20 0 HGADMO CCCNC(=O)c1cc(Cl)nc(N2CCC[C@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)n1 ZINC001164621881 719114245 /nfs/dbraw/zinc/11/42/45/719114245.db2.gz BJZRICKTUAKMRS-HKUYNNGSSA-N 1 1 413.953 3.371 20 0 HGADMO CC(C)n1nc(C[NH+](C)C)c2c1CN(c1cnc(OCc3ccccc3)cn1)CC2 ZINC001164650031 719313699 /nfs/dbraw/zinc/31/36/99/719313699.db2.gz AHMZRYWSNQEZOP-UHFFFAOYSA-N 1 1 406.534 3.457 20 0 HGADMO C[N@H+]1CCO[C@H]2CN(c3cc(-c4ccc(Cl)nc4)ccc3C3OCCCO3)C[C@H]21 ZINC001164666473 719422093 /nfs/dbraw/zinc/42/20/93/719422093.db2.gz CVTLCPRRTIXQSD-UXHICEINSA-N 1 1 415.921 3.357 20 0 HGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2C[C@H](C(=O)N3CCCC3)C[C@@H]3OCC[C@@H]32)nc1 ZINC001164679414 719545567 /nfs/dbraw/zinc/54/55/67/719545567.db2.gz ZXSOFUJDVQGBFG-CZYKHXBRSA-N 1 1 412.578 3.235 20 0 HGADMO Cc1cnc(N2CCC3(C[C@@H](CC(=O)NCC[NH+](C)C)c4ccccc43)CC2)c(N)c1 ZINC001164683004 719675393 /nfs/dbraw/zinc/67/53/93/719675393.db2.gz QHLBSSFWWVNXJE-LJQANCHMSA-N 1 1 421.589 3.066 20 0 HGADMO O=C1C[C@@H]2[C@@H](CCN2c2nc(Cl)ccc2C[NH+]2CCCC2)N1Cc1cccnc1 ZINC001164691614 719769362 /nfs/dbraw/zinc/76/93/62/719769362.db2.gz PAZSLDBIWSTZSG-RTBURBONSA-N 1 1 411.937 3.106 20 0 HGADMO Cc1nc(CN2CCCC23CCN(c2nc(Cl)nc4c2C[NH2+]CC4)CC3)cs1 ZINC001164691116 719803116 /nfs/dbraw/zinc/80/31/16/719803116.db2.gz DSQXWUOEKIMXJH-UHFFFAOYSA-N 1 1 418.998 3.176 20 0 HGADMO Cc1nc(C[N@@H+]2CCCC23CCN(c2nc(Cl)nc4c2ncn4C)CC3)cs1 ZINC001164692565 719807441 /nfs/dbraw/zinc/80/74/41/719807441.db2.gz JILWIGGWBIBQQQ-UHFFFAOYSA-N 1 1 417.970 3.417 20 0 HGADMO COC(=O)[C@@]1(C)C[C@@H]([NH+]2CCOCC2)CCN1c1nc(Cl)cc2cc(F)ccc21 ZINC001164705776 719837906 /nfs/dbraw/zinc/83/79/06/719837906.db2.gz VOKYWGZPQHIUHD-HRAATJIYSA-N 1 1 421.900 3.260 20 0 HGADMO COC(=O)[C@@]1(C)C[C@H]([NH+]2CCOCC2)CCN1c1nc(Cl)cc2cc(F)ccc21 ZINC001164705778 719838022 /nfs/dbraw/zinc/83/80/22/719838022.db2.gz VOKYWGZPQHIUHD-IIBYNOLFSA-N 1 1 421.900 3.260 20 0 HGADMO COC(=O)[C@@]1(C)C[C@@H]([NH+]2CCOCC2)CCN1c1nccc2ccc(Cl)cc21 ZINC001164705845 719849598 /nfs/dbraw/zinc/84/95/98/719849598.db2.gz WDHGSHUOIFSAHC-LAUBAEHRSA-N 1 1 403.910 3.121 20 0 HGADMO COC(=O)c1cnc(Cl)cc1N1CCC2(CC1)C[N@@H+](Cc1cccs1)CCO2 ZINC001164697490 719886705 /nfs/dbraw/zinc/88/67/05/719886705.db2.gz CCBUIRWUZXOXBX-UHFFFAOYSA-N 1 1 421.950 3.455 20 0 HGADMO COC(=O)c1cc(Cl)cnc1N1CCC2(CC1)C[N@@H+](Cc1cccs1)CCO2 ZINC001164694997 719887693 /nfs/dbraw/zinc/88/76/93/719887693.db2.gz IXXAJDKYEOCBDD-UHFFFAOYSA-N 1 1 421.950 3.455 20 0 HGADMO CC1(C)OC(=O)c2c1ccnc2N1CCC2(CC1)C[N@@H+](Cc1cccs1)CCO2 ZINC001164694750 719891590 /nfs/dbraw/zinc/89/15/90/719891590.db2.gz FBLFUMIGVCVCNC-UHFFFAOYSA-N 1 1 413.543 3.420 20 0 HGADMO COC(=O)c1nc(N2CCC3(CC2)C[N@@H+](Cc2cccs2)CCO3)ccc1Cl ZINC001164695289 719892036 /nfs/dbraw/zinc/89/20/36/719892036.db2.gz LNYFXHGIHPEGQD-UHFFFAOYSA-N 1 1 421.950 3.455 20 0 HGADMO Clc1ncnc2cnc(N3CCC4(CC3)C[N@H+](Cc3cccs3)CCO4)nc12 ZINC001164696276 719895256 /nfs/dbraw/zinc/89/52/56/719895256.db2.gz FMSUNUCIVPJJSU-UHFFFAOYSA-N 1 1 416.938 3.006 20 0 HGADMO Clc1ncnc2cnc(N3CCC4(CC3)C[N@@H+](Cc3cccs3)CCO4)nc12 ZINC001164696276 719895258 /nfs/dbraw/zinc/89/52/58/719895258.db2.gz FMSUNUCIVPJJSU-UHFFFAOYSA-N 1 1 416.938 3.006 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1cc(NC(=O)OC(C)(C)C)ncn1)C2 ZINC001164811277 720085587 /nfs/dbraw/zinc/08/55/87/720085587.db2.gz NSHVRDXIHJHETB-VGSWGCGISA-N 1 1 417.554 3.008 20 0 HGADMO COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1nc(C)nc3[nH]ccc31)CC2 ZINC001164711034 720105114 /nfs/dbraw/zinc/10/51/14/720105114.db2.gz NISMWUXJJVUSRO-LJQANCHMSA-N 1 1 406.534 3.169 20 0 HGADMO COC[C@@H]1C[N@H+](CC2CC2)C[C@]12CCN(c1nccc3cc(OC)c(OC)cc31)C2 ZINC001164807062 720122649 /nfs/dbraw/zinc/12/26/49/720122649.db2.gz BHCUYVAMZVLHNF-CYFREDJKSA-N 1 1 411.546 3.437 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1nccc3cc(OC)c(OC)cc31)C2 ZINC001164807062 720122656 /nfs/dbraw/zinc/12/26/56/720122656.db2.gz BHCUYVAMZVLHNF-CYFREDJKSA-N 1 1 411.546 3.437 20 0 HGADMO COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1nccc(C)c1NC(C)=O)CC2 ZINC001164713937 720136988 /nfs/dbraw/zinc/13/69/88/720136988.db2.gz UGAXUGYFLIAHQJ-NRFANRHFSA-N 1 1 423.561 3.251 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(C(F)(F)c1cc(C)nnc1Cl)C2 ZINC001164817070 720173003 /nfs/dbraw/zinc/17/30/03/720173003.db2.gz NUQADMGMQPNIOU-YJBOKZPZSA-N 1 1 400.901 3.168 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1nc(C(=O)OC)cc3ccccc31)C2 ZINC001164817826 720173643 /nfs/dbraw/zinc/17/36/43/720173643.db2.gz QIMZVQISFWHHCO-NTKDMRAZSA-N 1 1 409.530 3.206 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1cc(-c3ccccc3OC)ncn1)C2 ZINC001164812421 720175678 /nfs/dbraw/zinc/17/56/78/720175678.db2.gz ANSUWJVSZXZLEZ-CYFREDJKSA-N 1 1 408.546 3.337 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1nc(-c3ccncc3)nc3c1CCC3)C2 ZINC001164816676 720185229 /nfs/dbraw/zinc/18/52/29/720185229.db2.gz MAXMQSMYMWRVPH-NLFFAJNJSA-N 1 1 419.573 3.212 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1ccc3c(cc(OC)cc3OC)n1)C2 ZINC001164815198 720194952 /nfs/dbraw/zinc/19/49/52/720194952.db2.gz WWCCQCFEMAOHKJ-UUOWRZLLSA-N 1 1 411.546 3.437 20 0 HGADMO CC(C)[N@@H+](C)Cc1cc(=O)n2c(n1)CN(c1cnc3cccc(Cl)c3n1)CCC2 ZINC001164814654 720215883 /nfs/dbraw/zinc/21/58/83/720215883.db2.gz VTLYLYHFUYNEAG-UHFFFAOYSA-N 1 1 412.925 3.090 20 0 HGADMO Cc1nc(CN2C(=O)CC[C@H]3[C@H]2CCN3c2ccc(C[N@H+](C)C3CC3)cn2)cs1 ZINC001164816039 720259881 /nfs/dbraw/zinc/25/98/81/720259881.db2.gz FOTVAYGUBNJJJB-VQTJNVASSA-N 1 1 411.575 3.211 20 0 HGADMO CCOC(=O)c1c(C)cc(Cl)nc1N1CC[C@H]2[C@@H]1CC[N@H+]2Cc1cccnc1 ZINC001164725925 720364237 /nfs/dbraw/zinc/36/42/37/720364237.db2.gz OEPBAFHQYGLFHE-IRXDYDNUSA-N 1 1 400.910 3.468 20 0 HGADMO COC(=O)c1cc(C(F)(F)N2CC[C@H]3[C@@H]2CC[N@@H+]3Cc2cccnc2)cnc1Cl ZINC001164726554 720364305 /nfs/dbraw/zinc/36/43/05/720364305.db2.gz PMPNYCKDZONQNY-IRXDYDNUSA-N 1 1 422.863 3.315 20 0 HGADMO COC(=O)c1cc(C(F)(F)N2CC[C@H]3[C@@H]2CC[N@H+]3Cc2cccnc2)cnc1Cl ZINC001164726554 720364307 /nfs/dbraw/zinc/36/43/07/720364307.db2.gz PMPNYCKDZONQNY-IRXDYDNUSA-N 1 1 422.863 3.315 20 0 HGADMO CCOC(=O)c1cc(Cl)nc(N2CC[C@@H]3[C@H]2CC[N@H+]3Cc2cccnc2)c1C ZINC001164724327 720379948 /nfs/dbraw/zinc/37/99/48/720379948.db2.gz JQVYYQVBSPPGHD-QZTJIDSGSA-N 1 1 400.910 3.468 20 0 HGADMO FC(F)(c1c2c(nnc1Cl)CCC2)N1CC[C@@H]2[C@@H]1CC[N@@H+]2Cc1cccnc1 ZINC001164732033 720444176 /nfs/dbraw/zinc/44/41/76/720444176.db2.gz MVNWVROQKWLVLH-SJORKVTESA-N 1 1 405.880 3.412 20 0 HGADMO FC(F)(c1c2c(nnc1Cl)CCC2)N1CC[C@@H]2[C@@H]1CC[N@H+]2Cc1cccnc1 ZINC001164732033 720444184 /nfs/dbraw/zinc/44/41/84/720444184.db2.gz MVNWVROQKWLVLH-SJORKVTESA-N 1 1 405.880 3.412 20 0 HGADMO O[C@H]1CCN(c2ncnc3c2CC[N@H+](Cc2ccccc2)C3)[C@@H]1Cc1ccccc1 ZINC001164835430 720487929 /nfs/dbraw/zinc/48/79/29/720487929.db2.gz XYJQKEXYGSOOGR-RPWUZVMVSA-N 1 1 400.526 3.217 20 0 HGADMO O[C@H]1CCN(c2ncnc3c2CC[N@@H+](Cc2ccccc2)C3)[C@@H]1Cc1ccccc1 ZINC001164835430 720487934 /nfs/dbraw/zinc/48/79/34/720487934.db2.gz XYJQKEXYGSOOGR-RPWUZVMVSA-N 1 1 400.526 3.217 20 0 HGADMO CC(C)[N@@H+]1[C@@H]2CCN(c3nnc(Cl)c4ccncc43)C[C@H]2C[C@H]1Cn1cccn1 ZINC001164841578 720516709 /nfs/dbraw/zinc/51/67/09/720516709.db2.gz YZEMEADUTLKVMX-JTDSTZFVSA-N 1 1 411.941 3.253 20 0 HGADMO COC(=O)c1cc(Cl)cc(N2CC[C@@H]3[C@@H](C[C@@H](Cn4cccn4)[N@H+]3C(C)C)C2)n1 ZINC001164834019 720520311 /nfs/dbraw/zinc/52/03/11/720520311.db2.gz FDYGIGISHSOWSQ-VDZJLULYSA-N 1 1 417.941 3.096 20 0 HGADMO CC(C)[N@@H+]1[C@@H]2CCN(c3nc(Cl)nc4cccnc43)C[C@H]2C[C@H]1Cn1cccn1 ZINC001164840060 720520975 /nfs/dbraw/zinc/52/09/75/720520975.db2.gz WFIIDIQKALAFKX-SOLBZPMBSA-N 1 1 411.941 3.253 20 0 HGADMO Cc1c[nH]c2nc(Cl)nc(N3CC[C@@H]4[C@@H](C[C@H](Cn5cccn5)[N@@H+]4C(C)C)C3)c12 ZINC001164834924 720525984 /nfs/dbraw/zinc/52/59/84/720525984.db2.gz IGCKLHJXBRHXMO-GVDBMIGSSA-N 1 1 413.957 3.494 20 0 HGADMO CCOc1nc(Cl)cc(N2CC[C@@H]3[C@@H](C[C@H](Cn4cccn4)[N@H+]3C(C)C)C2)n1 ZINC001164836568 720527637 /nfs/dbraw/zinc/52/76/37/720527637.db2.gz NGFAEHJFVORBAU-GVDBMIGSSA-N 1 1 404.946 3.103 20 0 HGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@@H]2CN(C(F)(F)c3cnnc(Cl)c3)CC[C@@H]21 ZINC001164841384 720545370 /nfs/dbraw/zinc/54/53/70/720545370.db2.gz URYVWIXXKKLUHC-PVAVHDDUSA-N 1 1 410.900 3.249 20 0 HGADMO COc1ccc2ncc(N3CC[C@@H]4[C@@H](C[C@H](Cn5cccn5)[N@H+]4C(C)C)C3)nc2c1 ZINC001164838087 720546465 /nfs/dbraw/zinc/54/64/65/720546465.db2.gz NUULEVMRVRDWOT-NJNPRVFISA-N 1 1 406.534 3.213 20 0 HGADMO CCOC(=O)c1cc(N2CC[C@@H]3[C@@H](C[C@H](Cn4cccn4)[N@H+]3C(C)C)C2)ncc1C ZINC001164842986 720552764 /nfs/dbraw/zinc/55/27/64/720552764.db2.gz ZKIACYLTHCTCNU-QKNQBKEWSA-N 1 1 411.550 3.141 20 0 HGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@@H]2CN(c3nnc(Cl)c4ccoc43)CC[C@@H]21 ZINC001164839116 720570118 /nfs/dbraw/zinc/57/01/18/720570118.db2.gz POJYBZMFKMSLNM-VYDXJSESSA-N 1 1 400.914 3.451 20 0 HGADMO CC(C)[N@@H+]1[C@@H]2CCN(C(F)(F)c3nccnc3Cl)C[C@@H]2C[C@H]1Cn1cccn1 ZINC001164835286 720587153 /nfs/dbraw/zinc/58/71/53/720587153.db2.gz AYVIBSNYLCAUSY-HRCADAONSA-N 1 1 410.900 3.249 20 0 HGADMO Cc1cc(N2CC[C@@H]3[C@H](C[C@H](Cn4cccn4)[N@@H+]3C(C)C)C2)nc(-c2ccccn2)n1 ZINC001164840083 720597287 /nfs/dbraw/zinc/59/72/87/720597287.db2.gz OYIPLXHYBHHWRZ-KCZVDYSFSA-N 1 1 417.561 3.421 20 0 HGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@H]2CN(c3cc(-c4ccncc4)ncn3)CC[C@@H]21 ZINC001164841335 720613973 /nfs/dbraw/zinc/61/39/73/720613973.db2.gz RWQLLDIHLCMWLS-ONTIZHBOSA-N 1 1 403.534 3.113 20 0 HGADMO C[N@@H+](Cc1ccccc1)[C@@H]1COC2(C1)CCN(c1nc(Cl)nc3nc[nH]c31)CC2 ZINC001164839196 720660514 /nfs/dbraw/zinc/66/05/14/720660514.db2.gz JGZUDJVNLSRBQS-INIZCTEOSA-N 1 1 412.925 3.266 20 0 HGADMO C[N@H+](Cc1ccccc1)[C@@H]1COC2(C1)CCN(c1nc(Cl)nc3[nH]cnc31)CC2 ZINC001164839196 720660521 /nfs/dbraw/zinc/66/05/21/720660521.db2.gz JGZUDJVNLSRBQS-INIZCTEOSA-N 1 1 412.925 3.266 20 0 HGADMO C[N@@H+](Cc1ccccc1)[C@@H]1COC2(C1)CCN(c1nc(Cl)nc3[nH]cnc31)CC2 ZINC001164839196 720660528 /nfs/dbraw/zinc/66/05/28/720660528.db2.gz JGZUDJVNLSRBQS-INIZCTEOSA-N 1 1 412.925 3.266 20 0 HGADMO COc1cnc(SC)nc1N1CCC2(C[C@@H]([N@@H+](C)Cc3ccccc3)CO2)CC1 ZINC001164838811 720664858 /nfs/dbraw/zinc/66/48/58/720664858.db2.gz HRCBAJSXCQQBNS-GOSISDBHSA-N 1 1 414.575 3.467 20 0 HGADMO c1ccc(-c2nc(N3CC[N@@H+]4C[C@@H](Oc5cncnc5)C[C@H]4C3)nc3ccccc32)cc1 ZINC001164739298 720689558 /nfs/dbraw/zinc/68/95/58/720689558.db2.gz MVZXXMKFDXWLKA-PMACEKPBSA-N 1 1 424.508 3.429 20 0 HGADMO C[C@H]1CC(=O)Nc2ncnc(N3CCC4(C[C@@H]([N@@H+](C)Cc5ccccc5)CO4)CC3)c21 ZINC001164844812 720693416 /nfs/dbraw/zinc/69/34/16/720693416.db2.gz UYWHCMMPNDCFPX-PKOBYXMFSA-N 1 1 421.545 3.182 20 0 HGADMO COc1ccc2c(c1)nc(Cl)cc2N1CC[N@H+]2C[C@H](Oc3cncnc3)C[C@@H]2C1 ZINC001164744331 720694154 /nfs/dbraw/zinc/69/41/54/720694154.db2.gz ZJVWJCMGFHRSCN-GDBMZVCRSA-N 1 1 411.893 3.029 20 0 HGADMO COc1ncc(Cl)c(N2CCC3(C[C@H]([N@@H+](C)Cc4ccccc4)CO3)CC2)n1 ZINC001164840357 720722896 /nfs/dbraw/zinc/72/28/96/720722896.db2.gz PYSNJLVZMPXDIE-KRWDZBQOSA-N 1 1 402.926 3.399 20 0 HGADMO Cc1nc(-c2ccccc2)nc(Cl)c1N1CC[N@H+]2C[C@H](Oc3cncnc3)C[C@H]2C1 ZINC001164737161 720773478 /nfs/dbraw/zinc/77/34/78/720773478.db2.gz AEXDROJZAWSSMV-ZWKOTPCHSA-N 1 1 422.920 3.237 20 0 HGADMO Cc1nc(-c2ccccc2)nc(Cl)c1N1CC[N@H+]2C[C@H](Oc3cncnc3)C[C@@H]2C1 ZINC001164737159 720773495 /nfs/dbraw/zinc/77/34/95/720773495.db2.gz AEXDROJZAWSSMV-QZTJIDSGSA-N 1 1 422.920 3.237 20 0 HGADMO Clc1ccc2c(Cl)ncnc2c1N1CC[N@H+]2C[C@H](Oc3cncnc3)C[C@@H]2C1 ZINC001164747339 720805289 /nfs/dbraw/zinc/80/52/89/720805289.db2.gz NIPYRCHBTONIRS-CHWSQXEVSA-N 1 1 417.300 3.069 20 0 HGADMO Clc1ccc2c(Cl)ncnc2c1N1CC[N@H+]2C[C@@H](Oc3cncnc3)C[C@H]2C1 ZINC001164747354 720805381 /nfs/dbraw/zinc/80/53/81/720805381.db2.gz NIPYRCHBTONIRS-STQMWFEESA-N 1 1 417.300 3.069 20 0 HGADMO Clc1cc(N2CC[C@@H]3[C@H](C[C@@H](Cn4cncn4)[N@H+]3CC3CC3)C2)c2c(n1)CCC2 ZINC001164740269 720820065 /nfs/dbraw/zinc/82/00/65/720820065.db2.gz JYMHCCIHLJUOHF-FUHIMQAGSA-N 1 1 412.969 3.195 20 0 HGADMO Clc1cccc2nc(N3CC[C@@H]4[C@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)cnc12 ZINC001164738840 720822803 /nfs/dbraw/zinc/82/28/03/720822803.db2.gz HCOWYEPWMTXXMS-MBOZVWFJSA-N 1 1 423.952 3.254 20 0 HGADMO Clc1ccnc(Cl)c1N1CC[C@@H]2[C@H](C[C@@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164745090 720826025 /nfs/dbraw/zinc/82/60/25/720826025.db2.gz WDOAWEQZFHQVEQ-HLLBOEOZSA-N 1 1 407.349 3.359 20 0 HGADMO CC(C)(C)Oc1cccc(N2CC[C@@H]3[C@H](C[C@@H](Cn4cncn4)[N@H+]3CC3CC3)C2)n1 ZINC001164740466 720834366 /nfs/dbraw/zinc/83/43/66/720834366.db2.gz BWRUSSPGIVIRKE-HSALFYBXSA-N 1 1 410.566 3.230 20 0 HGADMO COCC[N@H+]1CCO[C@H]2CN(C(F)(F)c3cnc(Cl)c(Cl)c3)CC[C@@H]2C1 ZINC001164852908 720834664 /nfs/dbraw/zinc/83/46/64/720834664.db2.gz MIKTYJAEQXFWPD-DOMZBBRYSA-N 1 1 410.292 3.107 20 0 HGADMO COCC[N@H+]1CCO[C@H]2CN(C(F)(F)c3ccnc(Cl)c3Cl)CC[C@@H]2C1 ZINC001164857879 720837526 /nfs/dbraw/zinc/83/75/26/720837526.db2.gz YVJWFXHGRDUPGC-OCCSQVGLSA-N 1 1 410.292 3.107 20 0 HGADMO COc1ccc2cnc(N3CC[C@@H]4[C@@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)cc2c1 ZINC001164741908 720839694 /nfs/dbraw/zinc/83/96/94/720839694.db2.gz FVJMECHVQATDTJ-QZNHQXDQSA-N 1 1 418.545 3.214 20 0 HGADMO c1ncn(C[C@H]2C[C@@H]3CN(c4cnc(-c5ccccc5)cn4)CC[C@H]3[N@H+]2CC2CC2)n1 ZINC001164750370 720847078 /nfs/dbraw/zinc/84/70/78/720847078.db2.gz XJHXYWZBPPIXIZ-MQSCRBSSSA-N 1 1 415.545 3.115 20 0 HGADMO COCC[N@H+]1CCO[C@@H]2CN(c3nc(-c4ccccc4)nc4ccccc43)CC[C@@H]2C1 ZINC001164853210 720849365 /nfs/dbraw/zinc/84/93/65/720849365.db2.gz NBONUUIWPCIXLP-NFBKMPQASA-N 1 1 418.541 3.470 20 0 HGADMO COCC[N@H+]1CCO[C@H]2CN(c3cc4nc(Cl)cnc4cc3Cl)CC[C@@H]2C1 ZINC001164856366 720851040 /nfs/dbraw/zinc/85/10/40/720851040.db2.gz VYFVPGJFQAWTID-ACJLOTCBSA-N 1 1 411.333 3.110 20 0 HGADMO c1cc2ncnc(N3CC[C@@]4(C3)C[N@H+](CC3CC3)C[C@@H]4COCc3cccnc3)c2[nH]1 ZINC001164752945 720870811 /nfs/dbraw/zinc/87/08/11/720870811.db2.gz NPFNJOMPFNEXQT-YKSBVNFPSA-N 1 1 418.545 3.108 20 0 HGADMO Clc1cncc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COCc2cccnc2)n1 ZINC001164747944 720871681 /nfs/dbraw/zinc/87/16/81/720871681.db2.gz CQPIJNXMTSQWRW-KNQAVFIVSA-N 1 1 413.953 3.280 20 0 HGADMO Clc1cncc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COCc2cccnc2)n1 ZINC001164747946 720871793 /nfs/dbraw/zinc/87/17/93/720871793.db2.gz CQPIJNXMTSQWRW-UGKGYDQZSA-N 1 1 413.953 3.280 20 0 HGADMO Clc1ccc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COCc2cccnc2)nn1 ZINC001164751579 720876703 /nfs/dbraw/zinc/87/67/03/720876703.db2.gz LBKCDQONUICTFU-UGKGYDQZSA-N 1 1 413.953 3.280 20 0 HGADMO COCc1ccnc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COCc2cccnc2)c1 ZINC001164757184 720882502 /nfs/dbraw/zinc/88/25/02/720882502.db2.gz UEVPINJZCKAJIR-NOZRDPDXSA-N 1 1 422.573 3.378 20 0 HGADMO CCc1cc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COCc2cccnc2)ncn1 ZINC001164750637 720914798 /nfs/dbraw/zinc/91/47/98/720914798.db2.gz JXXIHVKRMXBGEJ-ZJSXRUAMSA-N 1 1 407.562 3.189 20 0 HGADMO CCOC(=O)c1cc2ccnc(N3CCn4c(C[N@@H+](C)C(C)C)cnc4[C@H]3C)c2[nH]1 ZINC001164861836 720950671 /nfs/dbraw/zinc/95/06/71/720950671.db2.gz UKIIEZURLCPQAQ-OAHLLOKOSA-N 1 1 410.522 3.358 20 0 HGADMO COC(=O)c1c(Cl)cnc(N2CCn3c(C[N@@H+](C)C(C)C)cnc3[C@H]2C)c1OC ZINC001164856302 720993563 /nfs/dbraw/zinc/99/35/63/720993563.db2.gz AWUHPAJXFAIOCM-CYBMUJFWSA-N 1 1 421.929 3.148 20 0 HGADMO Cc1cccc2c1nc(Cl)nc2N1CC[N@H+]2C[C@@H](OCc3cccnc3)C[C@H]2C1 ZINC001164866576 721072593 /nfs/dbraw/zinc/07/25/93/721072593.db2.gz FRKOQZOTJDTGIV-ROUUACIJSA-N 1 1 409.921 3.466 20 0 HGADMO COc1ccc(C(F)(F)N2CC[N@H+]3C[C@@H](OCc4cccnc4)C[C@@H]3C2)c(Cl)n1 ZINC001164865402 721084353 /nfs/dbraw/zinc/08/43/53/721084353.db2.gz LBUVSBOMRHZPIB-CVEARBPZSA-N 1 1 424.879 3.163 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4ccc(-c5ccc(Cl)cc5)nn4)C[C@@H]3C2)cn1 ZINC001164766620 721087231 /nfs/dbraw/zinc/08/72/31/721087231.db2.gz KYSNERGQJCIDDL-OALUTQOASA-N 1 1 408.937 3.489 20 0 HGADMO Cc1ccc(C(F)(F)N2CC[N@H+]3C[C@@H](OCc4cccnc4)C[C@@H]3C2)nc1Cl ZINC001164864866 721095953 /nfs/dbraw/zinc/09/59/53/721095953.db2.gz GYMICPDKXIIZHU-SJORKVTESA-N 1 1 408.880 3.463 20 0 HGADMO COc1ccc2c(C)cc(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@H]4C3)nc2c1 ZINC001164867707 721109817 /nfs/dbraw/zinc/10/98/17/721109817.db2.gz ZSJCAQOPPZVOOX-PZJWPPBQSA-N 1 1 404.514 3.427 20 0 HGADMO Cc1nc2sc3c(c2c(N2CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@H]4C2)n1)CCC3 ZINC001164874569 721140401 /nfs/dbraw/zinc/14/04/01/721140401.db2.gz KRRGRCFRGKRRHB-ROUUACIJSA-N 1 1 421.570 3.363 20 0 HGADMO c1cncc(CO[C@@H]2C[C@@H]3CN(c4ncnc5sc6c(c54)CCC6)CC[N@H+]3C2)c1 ZINC001164876438 721140611 /nfs/dbraw/zinc/14/06/11/721140611.db2.gz MLDVJRXKMUXIGJ-IAGOWNOFSA-N 1 1 407.543 3.055 20 0 HGADMO COc1ccccc1-c1cc(N2CC[N@H+]3C[C@@H](OCc4cccnc4)C[C@@H]3C2)ncn1 ZINC001164879425 721153377 /nfs/dbraw/zinc/15/33/77/721153377.db2.gz SDHBCSLWXJAUEF-UXHICEINSA-N 1 1 417.513 3.027 20 0 HGADMO Fc1cc2ncc(Cl)nc2cc1N1CC[N@H+]2C[C@H](OCc3cccnc3)C[C@@H]2C1 ZINC001164877063 721159536 /nfs/dbraw/zinc/15/95/36/721159536.db2.gz OQTCUZQDXLRMBP-HZPDHXFCSA-N 1 1 413.884 3.297 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4nc(Cl)cc(Cc5ccccc5)n4)C[C@H]3C2)cn1 ZINC001164770848 721173773 /nfs/dbraw/zinc/17/37/73/721173773.db2.gz OXCXNGWPAXWWBJ-VQTJNVASSA-N 1 1 422.964 3.413 20 0 HGADMO Cc1cc(-c2cccc(F)c2)nnc1N1CC[N@H+]2C[C@@H](OCc3cccnc3)C[C@H]2C1 ZINC001164871662 721182491 /nfs/dbraw/zinc/18/24/91/721182491.db2.gz GDYUQSYLMTYNPP-VXKWHMMOSA-N 1 1 419.504 3.466 20 0 HGADMO Fc1ccc2c(Cl)ncnc2c1N1CC[N@H+]2C[C@H](OCc3cccnc3)C[C@@H]2C1 ZINC001164868052 721191479 /nfs/dbraw/zinc/19/14/79/721191479.db2.gz JQZVOHAFZIBLBN-HZPDHXFCSA-N 1 1 413.884 3.297 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4ncccc4OCc4ccc(F)cc4)C[C@@H]3C2)cn1 ZINC001164770883 721213209 /nfs/dbraw/zinc/21/32/09/721213209.db2.gz PALARRALXAMTLW-RTWAWAEBSA-N 1 1 421.520 3.492 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4cc5nc(Cl)cnc5cc4F)C[C@@H]3C2)cn1 ZINC001164768499 721213660 /nfs/dbraw/zinc/21/36/60/721213660.db2.gz LFCDNGSEJVJQBN-CABCVRRESA-N 1 1 400.889 3.114 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4nccc(SCc5ccccc5)n4)C[C@H]3C2)cn1 ZINC001164767202 721228279 /nfs/dbraw/zinc/22/82/79/721228279.db2.gz WFNDHPQQKNPDJH-LEWJYISDSA-N 1 1 420.586 3.461 20 0 HGADMO CCN1C(=O)[C@]2(CC[C@@H]3CN(c4ccc([C@H]5CCCC[N@H+]5CC)cn4)C[C@@H]32)N=C1C ZINC001164876237 721234324 /nfs/dbraw/zinc/23/43/24/721234324.db2.gz YWUFKWXJEXYYMQ-OOICKAIWSA-N 1 1 409.578 3.494 20 0 HGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@]2(CCCN(c3nc(C)nc4ccoc43)C2)C1 ZINC001164778067 721332290 /nfs/dbraw/zinc/33/22/90/721332290.db2.gz UGCNCYIRRXZIBJ-JOCHJYFZSA-N 1 1 411.506 3.255 20 0 HGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@]2(CCCN(c3nncc4ccccc43)C2)C1 ZINC001164776827 721342106 /nfs/dbraw/zinc/34/21/06/721342106.db2.gz DDSICLMHAVTURL-HSZRJFAPSA-N 1 1 407.518 3.354 20 0 HGADMO COc1cnc(N2CCC[C@@]3(C2)COCC[N@@H+](Cc2c(C)noc2C)C3)c(C)c1 ZINC001164779032 721349010 /nfs/dbraw/zinc/34/90/10/721349010.db2.gz PCELVPLBTSWXNG-JOCHJYFZSA-N 1 1 400.523 3.122 20 0 HGADMO CSc1cc(C)nc(N2CCC[C@@]3(C2)COCC[N@H+](Cc2c(C)noc2C)C3)n1 ZINC001164778309 721350849 /nfs/dbraw/zinc/35/08/49/721350849.db2.gz MGKKOOGPRNQGGH-OAQYLSRUSA-N 1 1 417.579 3.231 20 0 HGADMO CSc1cc(C)nc(N2CCC[C@@]3(C2)COCC[N@@H+](Cc2c(C)noc2C)C3)n1 ZINC001164778309 721350850 /nfs/dbraw/zinc/35/08/50/721350850.db2.gz MGKKOOGPRNQGGH-OAQYLSRUSA-N 1 1 417.579 3.231 20 0 HGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2C[C@H]3OCC(=O)N(c4cccc(F)c4)[C@@H]3C2)nc1 ZINC001164883227 721367118 /nfs/dbraw/zinc/36/71/18/721367118.db2.gz OINAEMDOLVWHND-YPAWHYETSA-N 1 1 424.520 3.388 20 0 HGADMO C[NH+]1CCN(C[C@H]2CCC[C@]3(CCN(C(F)(F)c4cccnc4Cl)C3)O2)CC1 ZINC001164892143 721381969 /nfs/dbraw/zinc/38/19/69/721381969.db2.gz RVSDXRGNBHZTAN-VQIMIIECSA-N 1 1 414.928 3.045 20 0 HGADMO C[NH+]1CCN(C[C@@H]2CCC[C@]3(CCN(C(F)(F)c4ccnc(Cl)c4)C3)O2)CC1 ZINC001164885632 721382662 /nfs/dbraw/zinc/38/26/62/721382662.db2.gz CVSHCMBBRZJAEI-PKOBYXMFSA-N 1 1 414.928 3.045 20 0 HGADMO C[NH+]1CCN(C[C@H]2CCC[C@@]3(CCN(c4cnc5cccc(Cl)c5n4)C3)O2)CC1 ZINC001164893561 721394669 /nfs/dbraw/zinc/39/46/69/721394669.db2.gz VCZMRRDXMXWMII-VGSWGCGISA-N 1 1 415.969 3.049 20 0 HGADMO C[NH+]1CCN(C[C@@H]2CCC[C@]3(CCN(c4nccc5cc(Cl)ncc54)C3)O2)CC1 ZINC001164885732 721400383 /nfs/dbraw/zinc/40/03/83/721400383.db2.gz HDBYXSODCAWIDO-PGRDOPGGSA-N 1 1 415.969 3.049 20 0 HGADMO c1csc(C[N@H+]2C[C@H]3CN(c4nccnc4C4SCCCS4)C[C@H]3C2)n1 ZINC001164787650 721402146 /nfs/dbraw/zinc/40/21/46/721402146.db2.gz QLSMUWLUKCGYJA-OKILXGFUSA-N 1 1 405.618 3.370 20 0 HGADMO c1csc(C[N@@H+]2C[C@H]3CN(c4nccnc4C4SCCCS4)C[C@H]3C2)n1 ZINC001164787650 721402151 /nfs/dbraw/zinc/40/21/51/721402151.db2.gz QLSMUWLUKCGYJA-OKILXGFUSA-N 1 1 405.618 3.370 20 0 HGADMO CSc1cc(Cl)ncc1N1CC[C@]2(C1)CCC[C@H](CN1CC[NH+](C)CC1)O2 ZINC001164885242 721404300 /nfs/dbraw/zinc/40/43/00/721404300.db2.gz GIUCPGWHHDAIRZ-UZLBHIALSA-N 1 1 411.015 3.222 20 0 HGADMO O=C(Nc1ccccc1)c1ccnc(N2C[C@H]3C[NH+](Cc4nccs4)C[C@@H]3C2)c1 ZINC001164789027 721411886 /nfs/dbraw/zinc/41/18/86/721411886.db2.gz UKFDOCIRIVRXJY-QZTJIDSGSA-N 1 1 405.527 3.359 20 0 HGADMO CCOC(=O)c1cc2ccccc2nc1N1C[C@H]2C[NH+](Cc3nccs3)C[C@@H]2C1 ZINC001164781760 721417706 /nfs/dbraw/zinc/41/77/06/721417706.db2.gz DTLIVUBIKIDINA-IAGOWNOFSA-N 1 1 408.527 3.436 20 0 HGADMO CN(C)c1ccc(-c2ccnc(N3C[C@H]4C[NH+](Cc5nccs5)C[C@@H]4C3)n2)cc1 ZINC001164791040 721421916 /nfs/dbraw/zinc/42/19/16/721421916.db2.gz YZLAVOYZRQMRBP-QZTJIDSGSA-N 1 1 406.559 3.234 20 0 HGADMO Cc1cc2ncnc(N3CC[C@@]4(C3)CCC[C@H](CN3CC[NH+](C)CC3)O4)c2cc1C ZINC001164890733 721445775 /nfs/dbraw/zinc/44/57/75/721445775.db2.gz DRFITGMZHOVLET-HYBUGGRVSA-N 1 1 409.578 3.012 20 0 HGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1nccc3ncccc31)CC2 ZINC001164785963 721452966 /nfs/dbraw/zinc/45/29/66/721452966.db2.gz KKKKOUHMHPPUQP-HXUWFJFHSA-N 1 1 410.562 3.364 20 0 HGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1ncc(Cl)c(C)n1)CC2 ZINC001164790356 721454744 /nfs/dbraw/zinc/45/47/44/721454744.db2.gz YNSHWDRJAXHRLF-SFHVURJKSA-N 1 1 408.974 3.172 20 0 HGADMO CCc1cc(N2CCC3(C[C@@H](COCC4CC4)[N@@H+](CCOC)C3)CC2)nc(C)n1 ZINC001164787797 721462839 /nfs/dbraw/zinc/46/28/39/721462839.db2.gz SKMVMLKMJNPCFP-NRFANRHFSA-N 1 1 402.583 3.081 20 0 HGADMO CCc1cc(N2CCC3(C[C@H](COCC4CC4)[N@@H+](CCOC)C3)CC2)nc(C)n1 ZINC001164787812 721462848 /nfs/dbraw/zinc/46/28/48/721462848.db2.gz SKMVMLKMJNPCFP-OAQYLSRUSA-N 1 1 402.583 3.081 20 0 HGADMO CCOc1cccnc1N1CCC2(C[C@H](COCC3CC3)[N@@H+](CCOC)C2)CC1 ZINC001164791655 721470963 /nfs/dbraw/zinc/47/09/63/721470963.db2.gz XIDRROUAESMBGR-HXUWFJFHSA-N 1 1 403.567 3.214 20 0 HGADMO CCOC(=O)c1cnc(C)nc1N1CCC2(CC([N@@H+](C)Cc3ccncc3)C2)CC1 ZINC001164791928 721493136 /nfs/dbraw/zinc/49/31/36/721493136.db2.gz FDKJPLHWZLGHSC-UHFFFAOYSA-N 1 1 409.534 3.238 20 0 HGADMO CCOC(=O)c1cc(Cl)nc(N2CC[N@H+]3C[C@@H](Oc4cccc(F)c4)C[C@H]3C2)c1 ZINC001164901057 721508981 /nfs/dbraw/zinc/50/89/81/721508981.db2.gz WFPFUHCKFXFWDS-WMZOPIPTSA-N 1 1 419.884 3.393 20 0 HGADMO COc1cc2ncnc(N3CC[N@H+]4C[C@H](Oc5cccc(F)c5)C[C@@H]4C3)c2cc1OC ZINC001164900992 721519536 /nfs/dbraw/zinc/51/95/36/721519536.db2.gz VLUKZVTXLUJMKL-SJLPKXTDSA-N 1 1 424.476 3.128 20 0 HGADMO COC(=O)c1cc(Cl)cc(N2CC[N@H+]3C[C@@H](Oc4cccc(F)c4)C[C@H]3C2)n1 ZINC001164901428 721520461 /nfs/dbraw/zinc/52/04/61/721520461.db2.gz XEWUYJGOTCXPSQ-RDJZCZTQSA-N 1 1 405.857 3.003 20 0 HGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2ccc(-c3ccccc3)nn2)[C@H]2CCCO[C@H]12 ZINC001164805556 721536863 /nfs/dbraw/zinc/53/68/63/721536863.db2.gz MHFCOCOUYDGTGS-ZDXQCDESSA-N 1 1 401.514 3.407 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2ccc(-c3ccccc3)nn2)[C@H]2CCCO[C@H]12 ZINC001164805556 721536869 /nfs/dbraw/zinc/53/68/69/721536869.db2.gz MHFCOCOUYDGTGS-ZDXQCDESSA-N 1 1 401.514 3.407 20 0 HGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN([C@H](F)Oc2ccnc(Cl)c2)[C@@H]2CCCO[C@H]12 ZINC001164802514 721541386 /nfs/dbraw/zinc/54/13/86/721541386.db2.gz GNQNAMAOEDWZDB-JYBIWHBTSA-N 1 1 406.889 3.126 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN([C@H](F)Oc2ccnc(Cl)c2)[C@@H]2CCCO[C@H]12 ZINC001164802514 721541389 /nfs/dbraw/zinc/54/13/89/721541389.db2.gz GNQNAMAOEDWZDB-JYBIWHBTSA-N 1 1 406.889 3.126 20 0 HGADMO CSc1nc2ncnc(N3CC[N@H+]4C[C@@H](Oc5cccc(F)c5)C[C@H]4C3)c2s1 ZINC001164909328 721545264 /nfs/dbraw/zinc/54/52/64/721545264.db2.gz RLAYZLUSALVLOV-ZFWWWQNUSA-N 1 1 417.535 3.289 20 0 HGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2nc(Cl)nc3c2SCC3)[C@@H]2CCCO[C@H]12 ZINC001164807248 721546085 /nfs/dbraw/zinc/54/60/85/721546085.db2.gz QVYNOSFFBRVFOA-ZACQAIPSSA-N 1 1 417.966 3.041 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2nc(Cl)nc3c2SCC3)[C@@H]2CCCO[C@H]12 ZINC001164807248 721546086 /nfs/dbraw/zinc/54/60/86/721546086.db2.gz QVYNOSFFBRVFOA-ZACQAIPSSA-N 1 1 417.966 3.041 20 0 HGADMO CCOC(=O)c1nc(N2CC[N@H+]3C[C@@H](Oc4cccc(F)c4)C[C@H]3C2)ccc1Cl ZINC001164902981 721547962 /nfs/dbraw/zinc/54/79/62/721547962.db2.gz BPDYEWRHLJPOAB-RDJZCZTQSA-N 1 1 419.884 3.393 20 0 HGADMO C=Cc1nc(Cl)nc(N2CC[N@H+]3C[C@@H](Oc4cccc(F)c4)C[C@@H]3C2)c1OC ZINC001164907204 721550716 /nfs/dbraw/zinc/55/07/16/721550716.db2.gz MQSSCENYHDSCIY-ZBFHGGJFSA-N 1 1 404.873 3.263 20 0 HGADMO CSc1cnc(Cl)nc1N1C[C@H]([N@H+](C)Cc2cccnc2)[C@H]2OCCC[C@@H]21 ZINC001164798651 721558695 /nfs/dbraw/zinc/55/86/95/721558695.db2.gz BUOOSSARRHICER-ZOBUZTSGSA-N 1 1 405.955 3.115 20 0 HGADMO CSc1cnc(Cl)nc1N1C[C@H]([N@@H+](C)Cc2cccnc2)[C@H]2OCCC[C@@H]21 ZINC001164798651 721558697 /nfs/dbraw/zinc/55/86/97/721558697.db2.gz BUOOSSARRHICER-ZOBUZTSGSA-N 1 1 405.955 3.115 20 0 HGADMO CCCSc1ncnc(N2CC[N@H+]3C[C@@H](Oc4cccc(F)c4)C[C@H]3C2)c1OC ZINC001164904214 721566573 /nfs/dbraw/zinc/56/65/73/721566573.db2.gz DJIZPNFNEZLRPQ-WMZOPIPTSA-N 1 1 418.538 3.468 20 0 HGADMO CSc1ncc(Cl)nc1N1C[C@H]([N@H+](C)Cc2cccnc2)[C@H]2OCCC[C@@H]21 ZINC001164798610 721573982 /nfs/dbraw/zinc/57/39/82/721573982.db2.gz BOXMYXBWEQVYID-ZOBUZTSGSA-N 1 1 405.955 3.115 20 0 HGADMO CSc1ncc(Cl)nc1N1C[C@H]([N@@H+](C)Cc2cccnc2)[C@H]2OCCC[C@@H]21 ZINC001164798610 721573983 /nfs/dbraw/zinc/57/39/83/721573983.db2.gz BOXMYXBWEQVYID-ZOBUZTSGSA-N 1 1 405.955 3.115 20 0 HGADMO COc1ccc2nc(N3C[C@H]([N@@H+](C)Cc4cccnc4)[C@@H]4OCCC[C@H]43)c(C)nc2c1 ZINC001164811883 721582692 /nfs/dbraw/zinc/58/26/92/721582692.db2.gz YUUMHQSVQGEFAW-XPWALMASSA-N 1 1 419.529 3.210 20 0 HGADMO CCN(C)c1cc(C)nc(N2CCC(F)(F)[C@@]3(CC[N@H+](Cc4ccccn4)C3)C2)n1 ZINC001164902217 721582783 /nfs/dbraw/zinc/58/27/83/721582783.db2.gz DEOCWQMMILXQNE-OAQYLSRUSA-N 1 1 416.520 3.374 20 0 HGADMO CCN(C)c1cc(C)nc(N2CCC(F)(F)[C@@]3(CC[N@@H+](Cc4ccccn4)C3)C2)n1 ZINC001164902217 721582785 /nfs/dbraw/zinc/58/27/85/721582785.db2.gz DEOCWQMMILXQNE-OAQYLSRUSA-N 1 1 416.520 3.374 20 0 HGADMO FC1(F)CCN(c2nc(Cl)nc3nc[nH]c32)C[C@]12CC[N@@H+](Cc1ccccn1)C2 ZINC001164906699 721584250 /nfs/dbraw/zinc/58/42/50/721584250.db2.gz OWZXOEPIMNKYIW-GOSISDBHSA-N 1 1 419.867 3.139 20 0 HGADMO COC(=O)c1cccnc1N1CCC(F)(F)[C@]2(CC[N@@H+](Cc3ccccn3)C2)C1 ZINC001164907989 721587401 /nfs/dbraw/zinc/58/74/01/721587401.db2.gz XTCGEHOAXGGWKE-FQEVSTJZSA-N 1 1 402.445 3.001 20 0 HGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(C(F)(F)Oc2ccnc(Cl)c2)[C@H]2CCCO[C@@H]12 ZINC001164805109 721588825 /nfs/dbraw/zinc/58/88/25/721588825.db2.gz KRERYWRDCDSFDT-YQVWRLOYSA-N 1 1 424.879 3.423 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(C(F)(F)Oc2ccnc(Cl)c2)[C@H]2CCCO[C@@H]12 ZINC001164805109 721588827 /nfs/dbraw/zinc/58/88/27/721588827.db2.gz KRERYWRDCDSFDT-YQVWRLOYSA-N 1 1 424.879 3.423 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2nccc3c4c([nH]c32)CCC4)[C@@H]2CCCO[C@@H]12 ZINC001164808282 721589476 /nfs/dbraw/zinc/58/94/76/721589476.db2.gz QGQQQYQTYPONKM-MQSCRBSSSA-N 1 1 403.530 3.315 20 0 HGADMO COc1cc(C)c2ncnc(N3C[C@H]([N@@H+](C)Cc4cccnc4)[C@@H]4OCCC[C@@H]43)c2c1 ZINC001164804101 721591942 /nfs/dbraw/zinc/59/19/42/721591942.db2.gz INMVVMJMZHGDBI-QNWVGRARSA-N 1 1 419.529 3.210 20 0 HGADMO COC(=O)c1ccc(N2CCC(F)(F)[C@]3(CC[N@@H+](Cc4ccccn4)C3)C2)nc1C ZINC001164908005 721700438 /nfs/dbraw/zinc/70/04/38/721700438.db2.gz XXQBRCXUMWFTIR-NRFANRHFSA-N 1 1 416.472 3.309 20 0 HGADMO Cc1noc2ncnc(N3CCC(F)(F)[C@@]4(CC[N@@H+](Cc5ccccn5)C4)C3)c12 ZINC001164913844 721732157 /nfs/dbraw/zinc/73/21/57/721732157.db2.gz YWRREVMKWRDXOL-LJQANCHMSA-N 1 1 400.433 3.059 20 0 HGADMO Cc1cc(Cl)ncc1C(F)(F)N1CCCC12CC[NH+](CC(=O)N(C)C)CC2 ZINC001165010684 721738428 /nfs/dbraw/zinc/73/84/28/721738428.db2.gz KMFHIBSZMVTIMD-UHFFFAOYSA-N 1 1 400.901 3.111 20 0 HGADMO Clc1cccc2ccnc(N3CCO[C@]4(C3)COCC[N@H+](Cc3cccnc3)C4)c12 ZINC001164916016 721784523 /nfs/dbraw/zinc/78/45/23/721784523.db2.gz NPVTYEDADIHKHE-HSZRJFAPSA-N 1 1 424.932 3.391 20 0 HGADMO Clc1cccc2ccnc(N3CCO[C@]4(C3)COCC[N@@H+](Cc3cccnc3)C4)c12 ZINC001164916016 721784525 /nfs/dbraw/zinc/78/45/25/721784525.db2.gz NPVTYEDADIHKHE-HSZRJFAPSA-N 1 1 424.932 3.391 20 0 HGADMO CN(C)c1nc(Cl)cc(N2C[C@@H]3CCC[C@@H]([N@@H+](C)Cc4ccccn4)[C@H]3C2)n1 ZINC001165028849 721799850 /nfs/dbraw/zinc/79/98/50/721799850.db2.gz ZXANTJRALVYHCV-RYQLBKOJSA-N 1 1 400.958 3.328 20 0 HGADMO COC(=O)c1cc(Cl)nc(N2C[C@@H]3CCC[C@H]([N@@H+](C)Cc4ccccn4)[C@@H]3C2)n1 ZINC001165028549 721800902 /nfs/dbraw/zinc/80/09/02/721800902.db2.gz ZGXJLTWEKZPDDF-LESCRADOSA-N 1 1 415.925 3.049 20 0 HGADMO CCCNC(=O)c1cccnc1N1C[C@@H]2CCC[C@@H]([N@@H+](C)Cc3ccccn3)[C@@H]2C1 ZINC001165023269 721823512 /nfs/dbraw/zinc/82/35/12/721823512.db2.gz IMXAZXIJSKTLAU-VLCRHTCISA-N 1 1 407.562 3.353 20 0 HGADMO CN(C)CC[N@H+]1CC[C@H]2[C@@H]1CCN2c1nnc(Cc2ccccc2)c2ccccc21 ZINC001164929406 721877119 /nfs/dbraw/zinc/87/71/19/721877119.db2.gz BGASTMWZDYQDSI-ZEQRLZLVSA-N 1 1 401.558 3.435 20 0 HGADMO C[NH+](C)CCN1CC[C@H]2[C@@H]1CCN2c1nnc(Cc2ccccc2)c2ccccc21 ZINC001164929406 721877120 /nfs/dbraw/zinc/87/71/20/721877120.db2.gz BGASTMWZDYQDSI-ZEQRLZLVSA-N 1 1 401.558 3.435 20 0 HGADMO CN(C)CC[N@@H+]1CC[C@@H]2[C@H]1CCN2c1cnc(Cl)nc1Oc1cccc(F)c1 ZINC001164931846 721888473 /nfs/dbraw/zinc/88/84/73/721888473.db2.gz GGYIWJVSYKWUKJ-IAGOWNOFSA-N 1 1 405.905 3.276 20 0 HGADMO CN(C)CC[N@H+]1CC[C@@H]2[C@H]1CCN2c1cnc(Cl)nc1Oc1cccc(F)c1 ZINC001164931846 721888475 /nfs/dbraw/zinc/88/84/75/721888475.db2.gz GGYIWJVSYKWUKJ-IAGOWNOFSA-N 1 1 405.905 3.276 20 0 HGADMO COc1ccc(Oc2nc(Cl)ncc2N2CC[C@H]3[C@H]2CC[N@@H+]3CCN(C)C)cc1 ZINC001164929651 721888611 /nfs/dbraw/zinc/88/86/11/721888611.db2.gz BXDWRBCPILXAAR-ZWKOTPCHSA-N 1 1 417.941 3.146 20 0 HGADMO COc1ccc(Oc2nc(Cl)ncc2N2CC[C@H]3[C@H]2CC[N@H+]3CCN(C)C)cc1 ZINC001164929651 721888612 /nfs/dbraw/zinc/88/86/12/721888612.db2.gz BXDWRBCPILXAAR-ZWKOTPCHSA-N 1 1 417.941 3.146 20 0 HGADMO COc1ccc(Oc2nc(Cl)ncc2N2CC[C@@H]3[C@@H]2CC[N@@H+]3CCN(C)C)cc1 ZINC001164929638 721888649 /nfs/dbraw/zinc/88/86/49/721888649.db2.gz BXDWRBCPILXAAR-MSOLQXFVSA-N 1 1 417.941 3.146 20 0 HGADMO COc1ccc(Oc2nc(Cl)ncc2N2CC[C@@H]3[C@@H]2CC[N@H+]3CCN(C)C)cc1 ZINC001164929638 721888650 /nfs/dbraw/zinc/88/86/50/721888650.db2.gz BXDWRBCPILXAAR-MSOLQXFVSA-N 1 1 417.941 3.146 20 0 HGADMO CC[NH+](CC)Cc1nc2sc(C)c(C)c2c(N2CC[C@@H]3[C@H]2CCC(=O)N3C)n1 ZINC001164932384 721893396 /nfs/dbraw/zinc/89/33/96/721893396.db2.gz HJGHZMZKCKJHDM-HZPDHXFCSA-N 1 1 401.580 3.349 20 0 HGADMO O=C(Nc1ccc(Cl)nc1)c1ccc(F)c(N2CC[NH+](C[C@H]3CCCO3)CC2)c1 ZINC001165038514 721909895 /nfs/dbraw/zinc/90/98/95/721909895.db2.gz LUJHDKHWRWGUKE-QGZVFWFLSA-N 1 1 418.900 3.427 20 0 HGADMO COc1cccc(Oc2cncc(N3CC[NH+](CCOc4ccccc4)CC3)n2)c1 ZINC001165044732 721958154 /nfs/dbraw/zinc/95/81/54/721958154.db2.gz NHVPSCLDEHGVPC-UHFFFAOYSA-N 1 1 406.486 3.479 20 0 HGADMO C[C@H]1CCCN(C(=O)c2ccc(N3CC[NH+](CCOc4ccccc4)CC3)nc2)C1 ZINC001165045445 721959688 /nfs/dbraw/zinc/95/96/88/721959688.db2.gz UKVXSYPUUAMTQB-FQEVSTJZSA-N 1 1 408.546 3.155 20 0 HGADMO Cc1ccc(Cl)c(O[C@H]2CCCN(c3ccnc(N4CC[NH+](C)CC4)n3)C2)c1 ZINC001165050492 721979762 /nfs/dbraw/zinc/97/97/62/721979762.db2.gz TUELFUFWTGNREI-KRWDZBQOSA-N 1 1 401.942 3.238 20 0 HGADMO COC[C@@]12COC[C@H]1CN(c1nc(C[NH+]3CCCC3)nc3sc(C)c(C)c31)C2 ZINC001164953916 721995099 /nfs/dbraw/zinc/99/50/99/721995099.db2.gz SNDGJFBLNBAZOZ-IERDGZPVSA-N 1 1 402.564 3.003 20 0 HGADMO COC(=O)c1cc(Cl)cnc1N1CCC2(CC[N@@H+](Cc3cccnc3)C2)CC1 ZINC001164954313 722013510 /nfs/dbraw/zinc/01/35/10/722013510.db2.gz KHTYTXQADVIIPV-UHFFFAOYSA-N 1 1 400.910 3.409 20 0 HGADMO FC(F)(c1cccnc1Cl)N1CC[C@H]2C[N@@H+](Cc3cccnc3)CCO[C@H]2C1 ZINC001164981254 722100231 /nfs/dbraw/zinc/10/02/31/722100231.db2.gz KSMZERJUJOJRAY-WMZOPIPTSA-N 1 1 408.880 3.402 20 0 HGADMO FC(F)(c1cccc(Cl)n1)N1CC[C@H]2C[N@@H+](Cc3cccnc3)CCO[C@H]2C1 ZINC001164983408 722100579 /nfs/dbraw/zinc/10/05/79/722100579.db2.gz PYVPYQKCSVHCAO-IRXDYDNUSA-N 1 1 408.880 3.402 20 0 HGADMO Cc1cc(Cl)nc(C(F)(F)N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)n1 ZINC001164977250 722101737 /nfs/dbraw/zinc/10/17/37/722101737.db2.gz FKEPTOAWBBMNOF-IRXDYDNUSA-N 1 1 423.895 3.106 20 0 HGADMO Cc1sc2ncnc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)c2c1C ZINC001164984132 722104009 /nfs/dbraw/zinc/10/40/09/722104009.db2.gz RSZQQNAZBIAHGO-RBUKOAKNSA-N 1 1 409.559 3.430 20 0 HGADMO Clc1nc2c(c(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)n1)CCCC2 ZINC001164977274 722106132 /nfs/dbraw/zinc/10/61/32/722106132.db2.gz FNLXKACDCJSQBV-YLJYHZDGSA-N 1 1 413.953 3.131 20 0 HGADMO Clc1nnc(N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)c2sccc21 ZINC001164979315 722107084 /nfs/dbraw/zinc/10/70/84/722107084.db2.gz IAEUIFVZASTYSY-RDJZCZTQSA-N 1 1 415.950 3.467 20 0 HGADMO FC(F)(Oc1cccnc1Cl)N1CC[C@@H]2C[N@@H+](Cc3cccnc3)CCO[C@H]2C1 ZINC001164986644 722107093 /nfs/dbraw/zinc/10/70/93/722107093.db2.gz ZYSVZHBNYWUGSX-AEFFLSMTSA-N 1 1 424.879 3.282 20 0 HGADMO FC(F)(Oc1cccc(Cl)n1)N1CC[C@@H]2C[N@@H+](Cc3cccnc3)CCO[C@@H]2C1 ZINC001164982069 722108776 /nfs/dbraw/zinc/10/87/76/722108776.db2.gz VVPZVEQZUOYGIM-IAGOWNOFSA-N 1 1 424.879 3.282 20 0 HGADMO Clc1ccc2c(c1)ncnc2N1CC[C@H]2C[N@@H+](Cc3cccnc3)CCO[C@H]2C1 ZINC001164982144 722110259 /nfs/dbraw/zinc/11/02/59/722110259.db2.gz WCEXXTCXCGMNLJ-UWJYYQICSA-N 1 1 409.921 3.406 20 0 HGADMO CCc1c(Cl)nnc(N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)c1CC ZINC001164980412 722120051 /nfs/dbraw/zinc/12/00/51/722120051.db2.gz RDBQBYGFHZKXFF-PXNSSMCTSA-N 1 1 415.969 3.377 20 0 HGADMO CSc1nc2ccccc2c(N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)n1 ZINC001164980579 722123588 /nfs/dbraw/zinc/12/35/88/722123588.db2.gz RWFXNBCZRWHGTK-RXVVDRJESA-N 1 1 421.570 3.474 20 0 HGADMO c1ccc2c(c1)[nH]c1ncnc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)c21 ZINC001164976403 722123596 /nfs/dbraw/zinc/12/35/96/722123596.db2.gz LNTWVRFKXNLGLE-NQIIRXRSSA-N 1 1 414.513 3.233 20 0 HGADMO Clc1ccnc2cnc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)cc12 ZINC001164978367 722127180 /nfs/dbraw/zinc/12/71/80/722127180.db2.gz OMNLZPWNSWMVHC-LAUBAEHRSA-N 1 1 409.921 3.406 20 0 HGADMO CC(C)(C)c1nc2[nH]ccc2c(N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)n1 ZINC001164975198 722135783 /nfs/dbraw/zinc/13/57/83/722135783.db2.gz FQVPZPGWTKNJKV-AZUAARDMSA-N 1 1 420.561 3.378 20 0 HGADMO c1cncc(C[N@H+]2CCO[C@H]3CN(c4cncc(OCC5CCCC5)n4)CC[C@H]3C2)c1 ZINC001164971078 722154415 /nfs/dbraw/zinc/15/44/15/722154415.db2.gz ALJRQKOBIMEPRI-VXKWHMMOSA-N 1 1 423.561 3.168 20 0 HGADMO c1cncc(C[N@H+]2CCO[C@@H]3CN(c4cncc(OCC5CCCC5)n4)CC[C@H]3C2)c1 ZINC001164971074 722154637 /nfs/dbraw/zinc/15/46/37/722154637.db2.gz ALJRQKOBIMEPRI-FCHUYYIVSA-N 1 1 423.561 3.168 20 0 HGADMO Clc1nc2c(nc1N1CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C1)CCCC2 ZINC001164975277 722156825 /nfs/dbraw/zinc/15/68/25/722156825.db2.gz QUKISTNIOSXOIB-FXAWDEMLSA-N 1 1 413.953 3.131 20 0 HGADMO COC(=O)c1nc2cnccc2c(N2CCC[C@@]3(CC[N@H+]3Cc3cccc(F)c3)C2)n1 ZINC001164996694 722202986 /nfs/dbraw/zinc/20/29/86/722202986.db2.gz VNMWPYLZJHNOMO-HSZRJFAPSA-N 1 1 421.476 3.195 20 0 HGADMO CCC[N@H+]1CCCC[C@H]1c1ccc(N2CCCn3cnc(CNC(C)=O)c3C2)nc1 ZINC001164999751 722228395 /nfs/dbraw/zinc/22/83/95/722228395.db2.gz OVMKAFNFNZCARH-NRFANRHFSA-N 1 1 410.566 3.262 20 0 HGADMO C[NH+]1CCN(c2ncnc3c2CCN(c2cc(Cl)nc4ccccc42)CC3)CC1 ZINC001164997712 722229056 /nfs/dbraw/zinc/22/90/56/722229056.db2.gz UCPSLYDXVLSUBJ-UHFFFAOYSA-N 1 1 408.937 3.035 20 0 HGADMO O=c1cc(C[N@H+]2C[C@H]3CCC[C@@]3(c3nc(-c4ccccc4)no3)C2)nc2sccn21 ZINC000328602223 569416493 /nfs/dbraw/zinc/41/64/93/569416493.db2.gz AWGCHNWGXAXLMX-OPAMFIHVSA-N 1 1 419.510 3.360 20 0 HGADMO CCOC(=O)Cc1c(Cl)ncnc1N1CCC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21 ZINC001164623602 719079732 /nfs/dbraw/zinc/07/97/32/719079732.db2.gz JWPLDNVHRDBNBA-MJGOQNOKSA-N 1 1 414.937 3.336 20 0 HGADMO CON(C)C(=O)c1cc(Cl)nc(N2CCC[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)c1 ZINC001164620428 719080902 /nfs/dbraw/zinc/08/09/02/719080902.db2.gz DXPATNRNIPTXCG-PKOBYXMFSA-N 1 1 414.937 3.469 20 0 HGADMO CON(C)C(=O)c1cc(Cl)nc(N2CCC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)c1 ZINC001164620426 719081028 /nfs/dbraw/zinc/08/10/28/719081028.db2.gz DXPATNRNIPTXCG-IEBWSBKVSA-N 1 1 414.937 3.469 20 0 HGADMO O=C1NCc2c1c(N1CCC[C@H]3C[N@@H+](Cc4ccccc4)C[C@@H]31)nc(Cl)c2F ZINC001164628947 719082457 /nfs/dbraw/zinc/08/24/57/719082457.db2.gz VDGQHSCHZLZOMW-HOCLYGCPSA-N 1 1 400.885 3.218 20 0 HGADMO O=C(NC1CCCC1)c1ccc(N2CCC[C@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)nn1 ZINC001164629603 719103602 /nfs/dbraw/zinc/10/36/02/719103602.db2.gz SUAZLCYBIQCOMB-UGKGYDQZSA-N 1 1 405.546 3.250 20 0 HGADMO COc1cc(C(F)(F)N2CCc3c(C[NH+](C)C)nn(C(C)C)c3C2)nc(Cl)n1 ZINC001164654168 719317953 /nfs/dbraw/zinc/31/79/53/719317953.db2.gz PSFIYEJGFJQXEK-UHFFFAOYSA-N 1 1 414.888 3.085 20 0 HGADMO C[NH+]1CCC(Oc2ccnc(N3CCO[C@H]4[C@H]3CC[C@@H]4OCC3CCCC3)c2)CC1 ZINC001164662110 719344135 /nfs/dbraw/zinc/34/41/35/719344135.db2.gz NEDPXZALSQKJPU-GPXNEJASSA-N 1 1 415.578 3.498 20 0 HGADMO CNC(=O)C[N@H+]1CCCC12CCN(c1nc(Cl)cc(C3CCCCC3)n1)CC2 ZINC001164690017 719752411 /nfs/dbraw/zinc/75/24/11/719752411.db2.gz OUEWFHBWRRJAHB-UHFFFAOYSA-N 1 1 405.974 3.359 20 0 HGADMO Cc1nc(C[N@H+]2CCCC23CCN(c2ncc(Cl)cc2C(N)=O)CC3)cs1 ZINC001164693289 719804710 /nfs/dbraw/zinc/80/47/10/719804710.db2.gz RTCFSQYTRNDTLZ-UHFFFAOYSA-N 1 1 405.955 3.234 20 0 HGADMO COC(=O)[C@]1(C)C[C@@H]([NH+]2CCOCC2)CCN1c1ncnc2sc(C(C)C)cc21 ZINC001164707032 719838219 /nfs/dbraw/zinc/83/82/19/719838219.db2.gz YXCYYGQGOVUGOL-BTYIYWSLSA-N 1 1 418.563 3.047 20 0 HGADMO COC(=O)[C@]1(C)C[C@H]([NH+]2CCOCC2)CCN1c1cc(Cl)nc2sccc21 ZINC001164706743 719849561 /nfs/dbraw/zinc/84/95/61/719849561.db2.gz YJNXXPRBVAYPFQ-YJYMSZOUSA-N 1 1 409.939 3.182 20 0 HGADMO COC(=O)[C@]1(C)C[C@@H]([NH+]2CCOCC2)CCN1c1cc(Cl)nc2c(F)cccc12 ZINC001164705370 719878195 /nfs/dbraw/zinc/87/81/95/719878195.db2.gz YKLSPHPAILEOTE-QKKBWIMNSA-N 1 1 421.900 3.260 20 0 HGADMO COC(=O)[C@]1(C)C[C@@H]([NH+]2CCOCC2)CCN1c1nc(Cl)cc2cccc(F)c21 ZINC001164700828 719880404 /nfs/dbraw/zinc/88/04/04/719880404.db2.gz MJKGSIPLIMVSSK-BTYIYWSLSA-N 1 1 421.900 3.260 20 0 HGADMO CCOC(=O)c1cccnc1N1CCC2(CC1)C[N@@H+](Cc1cccs1)CCO2 ZINC001164694651 719886658 /nfs/dbraw/zinc/88/66/58/719886658.db2.gz BRFHBPIQEKBENP-UHFFFAOYSA-N 1 1 401.532 3.191 20 0 HGADMO CCOC(=O)Cc1cccnc1N1CCC2(CC1)C[N@@H+](Cc1cccs1)CCO2 ZINC001164694712 719887996 /nfs/dbraw/zinc/88/79/96/719887996.db2.gz CWTJZXPDAAMSSA-UHFFFAOYSA-N 1 1 415.559 3.120 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(C(F)(F)c1nc(C)cc(Cl)n1)C2 ZINC001164808467 720073912 /nfs/dbraw/zinc/07/39/12/720073912.db2.gz HNKACJFYGKLUHU-QAPCUYQASA-N 1 1 400.901 3.168 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1nnc(Cl)cc1-c1ccncc1)C2 ZINC001164810861 720081748 /nfs/dbraw/zinc/08/17/48/720081748.db2.gz MBYIYYKWACPODY-PGRDOPGGSA-N 1 1 413.953 3.377 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1cc(C(=O)OC(C)(C)C)ccn1)C2 ZINC001164811289 720082344 /nfs/dbraw/zinc/08/23/44/720082344.db2.gz NSLSEFQSRJTTHA-CVDCTZTESA-N 1 1 401.551 3.222 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1cc(NC(=O)OC(C)(C)C)ncn1)C2 ZINC001164811271 720086062 /nfs/dbraw/zinc/08/60/62/720086062.db2.gz NSHVRDXIHJHETB-HTAPYJJXSA-N 1 1 417.554 3.008 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1cc(NC(=O)OC(C)(C)C)ncn1)C2 ZINC001164811275 720086624 /nfs/dbraw/zinc/08/66/24/720086624.db2.gz NSHVRDXIHJHETB-VGOFRKELSA-N 1 1 417.554 3.008 20 0 HGADMO COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1nc(C)cc(Cl)n1)CC2 ZINC001164712695 720095521 /nfs/dbraw/zinc/09/55/21/720095521.db2.gz YCWGOMZSWSISJJ-SFHVURJKSA-N 1 1 401.942 3.341 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1nccc3cc(C(=O)OC)ccc31)C2 ZINC001164811112 720102802 /nfs/dbraw/zinc/10/28/02/720102802.db2.gz LKQZIQSLEWFUJS-HYBUGGRVSA-N 1 1 409.530 3.206 20 0 HGADMO COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1cc(Cl)nnc1C)CC2 ZINC001164710658 720106175 /nfs/dbraw/zinc/10/61/75/720106175.db2.gz KOTWINGKIUXGCF-GOSISDBHSA-N 1 1 401.942 3.341 20 0 HGADMO COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1cc(Cl)nnc1C)CC2 ZINC001164710659 720106527 /nfs/dbraw/zinc/10/65/27/720106527.db2.gz KOTWINGKIUXGCF-SFHVURJKSA-N 1 1 401.942 3.341 20 0 HGADMO COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1nc(Cl)nc(Cl)n1)CC2 ZINC001164717415 720107059 /nfs/dbraw/zinc/10/70/59/720107059.db2.gz ORSXJAQFWGHATK-HNNXBMFYSA-N 1 1 423.348 3.081 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1cc(Cl)nc3ccc(OC)nc31)C2 ZINC001164814966 720123175 /nfs/dbraw/zinc/12/31/75/720123175.db2.gz UTUKHQPWVPPNDL-KSFYIVLOSA-N 1 1 416.953 3.477 20 0 HGADMO CCN(CC)c1cc(N2CCC3(C[C@@H](COC)[N@@H+](Cc4ccccn4)C3)CC2)ncn1 ZINC001164712258 720129644 /nfs/dbraw/zinc/12/96/44/720129644.db2.gz LZAXOWXZLUYQDK-NRFANRHFSA-N 1 1 424.593 3.225 20 0 HGADMO COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1nc(C)nc3c1CCC3)CC2 ZINC001164711200 720134224 /nfs/dbraw/zinc/13/42/24/720134224.db2.gz FZPRZMMZHCTBBS-FQEVSTJZSA-N 1 1 407.562 3.176 20 0 HGADMO COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1cnc(Cl)cc1N)CC2 ZINC001164710473 720136900 /nfs/dbraw/zinc/13/69/00/720136900.db2.gz BREUBIHGSMTENT-QGZVFWFLSA-N 1 1 401.942 3.220 20 0 HGADMO COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1nccc(C)c1NC(C)=O)CC2 ZINC001164713940 720136969 /nfs/dbraw/zinc/13/69/69/720136969.db2.gz UGAXUGYFLIAHQJ-OAQYLSRUSA-N 1 1 423.561 3.251 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1nc3ccccc3cc1C(=O)OC)C2 ZINC001164815422 720141455 /nfs/dbraw/zinc/14/14/55/720141455.db2.gz VNVKHJGKHNPUGO-DVECYGJZSA-N 1 1 409.530 3.206 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1nc(Cl)nc3c1ncn3C(C)C)C2 ZINC001164813855 720147450 /nfs/dbraw/zinc/14/74/50/720147450.db2.gz RGHDMHFAQPNVAV-HRAATJIYSA-N 1 1 418.973 3.245 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1cnc(OCc3ccccc3)cn1)C2 ZINC001164816721 720149728 /nfs/dbraw/zinc/14/97/28/720149728.db2.gz MGJIFPAVCBPGHB-ZJSXRUAMSA-N 1 1 408.546 3.240 20 0 HGADMO COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1nc(OC)ncc1Cl)CC2 ZINC001164710838 720151457 /nfs/dbraw/zinc/15/14/57/720151457.db2.gz DOEBHMLKLYBITC-KRWDZBQOSA-N 1 1 417.941 3.041 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1cc(-c3ccccc3OC)ncn1)C2 ZINC001164812423 720175493 /nfs/dbraw/zinc/17/54/93/720175493.db2.gz ANSUWJVSZXZLEZ-NTKDMRAZSA-N 1 1 408.546 3.337 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1nc(-c3ccncc3)nc(C)c1C)C2 ZINC001164816244 720183188 /nfs/dbraw/zinc/18/31/88/720183188.db2.gz KJHHZIMPOWJVLX-ZJSXRUAMSA-N 1 1 407.562 3.340 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1nc(-c3ccccn3)nc(C)c1C)C2 ZINC001164818683 720183834 /nfs/dbraw/zinc/18/38/34/720183834.db2.gz TZHDHGWBLMUKQO-YKSBVNFPSA-N 1 1 407.562 3.340 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1cc(-c3nc(C4CC4)no3)ccn1)C2 ZINC001164817548 720190392 /nfs/dbraw/zinc/19/03/92/720190392.db2.gz PUXZSBWBHZITLM-WMZHIEFXSA-N 1 1 409.534 3.194 20 0 HGADMO CC(C)[N@@H+](C)Cc1cc(=O)n2c(n1)CN(c1ncnc3ccc(Cl)cc31)CCC2 ZINC001164810314 720214383 /nfs/dbraw/zinc/21/43/83/720214383.db2.gz BZCRVXCWESTRMH-UHFFFAOYSA-N 1 1 412.925 3.090 20 0 HGADMO Cc1cc(N2CCCn3c(=O)cc(C[N@H+](C)C(C)C)nc3C2)nc(-c2ccsc2)n1 ZINC001164813914 720239869 /nfs/dbraw/zinc/23/98/69/720239869.db2.gz RUFSRIQCKIFNMF-UHFFFAOYSA-N 1 1 424.574 3.321 20 0 HGADMO COC(=O)c1cc(Cl)ncc1C(F)(F)N1CC[C@H]2[C@H]1CC[N@@H+]2Cc1cccnc1 ZINC001164731027 720368853 /nfs/dbraw/zinc/36/88/53/720368853.db2.gz YEEFQVQFKRHHHK-DLBZAZTESA-N 1 1 422.863 3.315 20 0 HGADMO COC(=O)c1cc(Cl)ncc1C(F)(F)N1CC[C@H]2[C@H]1CC[N@H+]2Cc1cccnc1 ZINC001164731027 720368861 /nfs/dbraw/zinc/36/88/61/720368861.db2.gz YEEFQVQFKRHHHK-DLBZAZTESA-N 1 1 422.863 3.315 20 0 HGADMO COc1cc2nc(C)nc(N3CC[C@@H]4[C@H]3CC[N@H+]4Cc3cccnc3)c2cc1OC ZINC001164723748 720386896 /nfs/dbraw/zinc/38/68/96/720386896.db2.gz HDDFPGVWCFZPLG-WOJBJXKFSA-N 1 1 405.502 3.204 20 0 HGADMO Cc1nc(CO[C@@H]2CN(c3ccc(C[N@H+](C)C4CC4)cn3)[C@@H]3CCCO[C@H]23)cs1 ZINC001164825786 720392268 /nfs/dbraw/zinc/39/22/68/720392268.db2.gz VIGJJECOEFKKEN-SJBKTWHCSA-N 1 1 414.575 3.394 20 0 HGADMO CCOC(=O)c1nc(Cl)nc(Cl)c1N1CC[C@H]2[C@H]1CC[N@@H+]2Cc1cccnc1 ZINC001164729061 720396267 /nfs/dbraw/zinc/39/62/67/720396267.db2.gz UWPIDCINDBWIQH-UONOGXRCSA-N 1 1 422.316 3.208 20 0 HGADMO CCOC(=O)c1nc(Cl)nc(Cl)c1N1CC[C@H]2[C@H]1CC[N@H+]2Cc1cccnc1 ZINC001164729061 720396275 /nfs/dbraw/zinc/39/62/75/720396275.db2.gz UWPIDCINDBWIQH-UONOGXRCSA-N 1 1 422.316 3.208 20 0 HGADMO CCOC(=O)c1cc2ncnc(N3CC[C@@H]4[C@@H]3CC[N@H+]4Cc3cccnc3)c2s1 ZINC001164734259 720410717 /nfs/dbraw/zinc/41/07/17/720410717.db2.gz RHIZQKCUCXNJIA-SJORKVTESA-N 1 1 409.515 3.116 20 0 HGADMO Cc1cc(N2CC[C@@H]3[C@H]2CC[N@H+]3Cc2cccnc2)nc(NC(=O)c2ccccc2)n1 ZINC001164731656 720466520 /nfs/dbraw/zinc/46/65/20/720466520.db2.gz XGFJKJOPVVWBRA-NHCUHLMSSA-N 1 1 414.513 3.286 20 0 HGADMO C[NH+](C)C[C@H]1Cn2ccnc2CN(c2ccc3c(n2)CCN(Cc2ccccc2)C3)C1 ZINC001164729849 720511455 /nfs/dbraw/zinc/51/14/55/720511455.db2.gz JQSJJRSENXIJSR-NRFANRHFSA-N 1 1 416.573 3.034 20 0 HGADMO CCOC(=O)/C=C/c1cccnc1N1CC[C@@H]2[C@H](C[C@H](Cn3cccn3)[N@H+]2C(C)C)C1 ZINC001164832350 720512481 /nfs/dbraw/zinc/51/24/81/720512481.db2.gz ACAZYTDGOPHQRA-GFPYTHISSA-N 1 1 423.561 3.232 20 0 HGADMO COC(=O)c1c(Cl)ccnc1N1CC[C@@H]2[C@@H](C[C@H](Cn3cccn3)[N@H+]2C(C)C)C1 ZINC001164840071 720513398 /nfs/dbraw/zinc/51/33/98/720513398.db2.gz WHBXIDSVFSPAQO-LZLYRXPVSA-N 1 1 417.941 3.096 20 0 HGADMO CC(C)[N@@H+]1[C@@H]2CCN(c3nc(Cl)nc4c3CCC4)C[C@H]2C[C@H]1Cn1cccn1 ZINC001164840787 720516024 /nfs/dbraw/zinc/51/60/24/720516024.db2.gz XNIQFOCJFAQDEV-JTDSTZFVSA-N 1 1 400.958 3.193 20 0 HGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@@H]2CN(C(F)(F)c3cnc(Cl)nc3)CC[C@@H]21 ZINC001164834857 720518800 /nfs/dbraw/zinc/51/88/00/720518800.db2.gz HMNPGUOJXGOSTD-PVAVHDDUSA-N 1 1 410.900 3.249 20 0 HGADMO CC(C)[N@@H+]1[C@@H]2CCN(C(F)(F)c3cnc(Cl)nc3)C[C@H]2C[C@H]1Cn1cccn1 ZINC001164834856 720519035 /nfs/dbraw/zinc/51/90/35/720519035.db2.gz HMNPGUOJXGOSTD-HYVNUMGLSA-N 1 1 410.900 3.249 20 0 HGADMO CC(C)[N@@H+]1[C@@H]2CCN(C(F)(F)c3ccc(Cl)nn3)C[C@@H]2C[C@H]1Cn1cccn1 ZINC001164835275 720519300 /nfs/dbraw/zinc/51/93/00/720519300.db2.gz JNBHGXSXFYJDNV-HRCADAONSA-N 1 1 410.900 3.249 20 0 HGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@@H]2CN([C@H](F)Oc3ccnc(Cl)c3)CC[C@@H]21 ZINC001164835740 720523801 /nfs/dbraw/zinc/52/38/01/720523801.db2.gz KRIYHGNWVFWDDO-JMVFIXPQSA-N 1 1 407.921 3.437 20 0 HGADMO COc1nc(Cl)nc(C)c1N1CC[C@@H]2[C@@H](C[C@H](Cn3cccn3)[N@H+]2C(C)C)C1 ZINC001164841467 720544755 /nfs/dbraw/zinc/54/47/55/720544755.db2.gz WAMKGHAHTPPYQX-GVDBMIGSSA-N 1 1 404.946 3.021 20 0 HGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@@H]2CN(c3nnc(Cl)c4cccnc43)CC[C@@H]21 ZINC001164841447 720546713 /nfs/dbraw/zinc/54/67/13/720546713.db2.gz VXRKUHMPJAEGQP-RYRKJORJSA-N 1 1 411.941 3.253 20 0 HGADMO COc1cccc2cnc(N3CC[C@@H]4[C@H](C[C@@H](Cn5cccn5)[N@H+]4C(C)C)C3)nc21 ZINC001164833643 720551367 /nfs/dbraw/zinc/55/13/67/720551367.db2.gz BBPCGFDVXOCHKL-HSALFYBXSA-N 1 1 406.534 3.213 20 0 HGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@H]2CN(c3nccc(-c4cccnc4F)n3)CC[C@@H]21 ZINC001164841417 720573491 /nfs/dbraw/zinc/57/34/91/720573491.db2.gz VFGUEUQLABXACX-WFXMLNOXSA-N 1 1 421.524 3.252 20 0 HGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@H]2CN(c3cncc(N4CCCCC4)n3)CC[C@@H]21 ZINC001164839283 720574305 /nfs/dbraw/zinc/57/43/05/720574305.db2.gz PTSHBNKTPAFZRV-ACRUOGEOSA-N 1 1 409.582 3.041 20 0 HGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@@H]2CN(c3cncc(N4CCCCC4)n3)CC[C@@H]21 ZINC001164839284 720574623 /nfs/dbraw/zinc/57/46/23/720574623.db2.gz PTSHBNKTPAFZRV-HKBOAZHASA-N 1 1 409.582 3.041 20 0 HGADMO CSc1cnc(Cl)c(N2CC[C@@H]3[C@@H](C[C@@H](Cn4cccn4)[N@H+]3C(C)C)C2)n1 ZINC001164842220 720589790 /nfs/dbraw/zinc/58/97/90/720589790.db2.gz UQLISTGOSGLSKW-HRCADAONSA-N 1 1 406.987 3.426 20 0 HGADMO CC(C)[N@@H+]1[C@@H]2CCN(c3cc(N4CCCCC4)ncn3)C[C@@H]2C[C@H]1Cn1cccn1 ZINC001164842809 720599997 /nfs/dbraw/zinc/59/99/97/720599997.db2.gz VQIQWWVXDKKQRN-PCCBWWKXSA-N 1 1 409.582 3.041 20 0 HGADMO COc1nnc(N2CC[C@@H]3[C@H](C[C@@H](Cn4cccn4)[N@H+]3C(C)C)C2)c2ccccc21 ZINC001164839224 720600522 /nfs/dbraw/zinc/60/05/22/720600522.db2.gz MLGZURKGPKKVQF-LVCYWYKZSA-N 1 1 406.534 3.213 20 0 HGADMO Cc1noc(-c2ccnc(N3CC[C@@H]4[C@H](C[C@H](Cn5cccn5)[N@@H+]4C(C)C)C3)c2)n1 ZINC001164842902 720613643 /nfs/dbraw/zinc/61/36/43/720613643.db2.gz WGDBCWBMIFAXAN-VAMGGRTRSA-N 1 1 407.522 3.014 20 0 HGADMO Cc1noc(-c2ccc(N3CC[C@@H]4[C@@H](C[C@H](Cn5cccn5)[N@@H+]4C(C)C)C3)nc2)n1 ZINC001164838381 720614696 /nfs/dbraw/zinc/61/46/96/720614696.db2.gz KVRSXOOETXUVJT-XUVXKRRUSA-N 1 1 407.522 3.014 20 0 HGADMO FC(F)(c1ccnc(Cl)c1Cl)N1CC[N@@H+]2C[C@@H](Oc3cncnc3)C[C@@H]2C1 ZINC001164740311 720631229 /nfs/dbraw/zinc/63/12/29/720631229.db2.gz IMROQZFXLIMGRN-NEPJUHHUSA-N 1 1 416.259 3.065 20 0 HGADMO FC(F)(c1ccnc(Cl)c1Cl)N1CC[N@H+]2C[C@@H](Oc3cncnc3)C[C@@H]2C1 ZINC001164740311 720631238 /nfs/dbraw/zinc/63/12/38/720631238.db2.gz IMROQZFXLIMGRN-NEPJUHHUSA-N 1 1 416.259 3.065 20 0 HGADMO C[N@@H+](Cc1ccccc1)[C@@H]1COC2(C1)CCN(c1cc(C(N)=O)c(Cl)cn1)CC2 ZINC001164843195 720666412 /nfs/dbraw/zinc/66/64/12/720666412.db2.gz UVTRNJHOIKVNSX-KRWDZBQOSA-N 1 1 414.937 3.094 20 0 HGADMO c1ccc(-c2nc3ccccc3c(N3CC[N@@H+]4C[C@@H](Oc5cncnc5)C[C@@H]4C3)n2)cc1 ZINC001164737563 720676370 /nfs/dbraw/zinc/67/63/70/720676370.db2.gz GECIPGOTGKGKCR-UXHICEINSA-N 1 1 424.508 3.429 20 0 HGADMO FC(F)(c1ccc(Cl)c(Cl)n1)N1CC[N@@H+]2C[C@@H](Oc3cncnc3)C[C@H]2C1 ZINC001164738987 720692979 /nfs/dbraw/zinc/69/29/79/720692979.db2.gz LVMFKITUDQNXFK-RYUDHWBXSA-N 1 1 416.259 3.065 20 0 HGADMO FC(F)(c1ccc(Cl)c(Cl)n1)N1CC[N@H+]2C[C@@H](Oc3cncnc3)C[C@H]2C1 ZINC001164738987 720692981 /nfs/dbraw/zinc/69/29/81/720692981.db2.gz LVMFKITUDQNXFK-RYUDHWBXSA-N 1 1 416.259 3.065 20 0 HGADMO C[C@@H]1CC(=O)Nc2ncnc(N3CCC4(C[C@@H]([N@@H+](C)Cc5ccccc5)CO4)CC3)c21 ZINC001164844808 720693646 /nfs/dbraw/zinc/69/36/46/720693646.db2.gz UYWHCMMPNDCFPX-IEBWSBKVSA-N 1 1 421.545 3.182 20 0 HGADMO C[N@@H+](Cc1ccccc1)[C@@H]1COC2(C1)CCN(c1ccc(C(=O)NC3CC3)cn1)CC2 ZINC001164843403 720694024 /nfs/dbraw/zinc/69/40/24/720694024.db2.gz PPGMMMLKDLOOLH-QFIPXVFZSA-N 1 1 420.557 3.234 20 0 HGADMO COC(=O)c1cc(N2CCC3(C[C@H]([N@@H+](C)Cc4ccccc4)CO3)CC2)ncc1C ZINC001164844884 720698264 /nfs/dbraw/zinc/69/82/64/720698264.db2.gz VVISVMLAVHVYBW-FQEVSTJZSA-N 1 1 409.530 3.437 20 0 HGADMO Cc1cccc(Sc2cncc(N3CC[N@H+]4C[C@H](Oc5cncnc5)C[C@@H]4C3)n2)c1 ZINC001164739899 720741325 /nfs/dbraw/zinc/74/13/25/720741325.db2.gz JLSZRIOXIDBJJG-QZTJIDSGSA-N 1 1 420.542 3.068 20 0 HGADMO Cc1cccc(Sc2cncc(N3CC[N@H+]4C[C@@H](Oc5cncnc5)C[C@@H]4C3)n2)c1 ZINC001164739898 720742098 /nfs/dbraw/zinc/74/20/98/720742098.db2.gz JLSZRIOXIDBJJG-MSOLQXFVSA-N 1 1 420.542 3.068 20 0 HGADMO Clc1cc(C2CCCCC2)nc(N2CC[N@H+]3C[C@@H](Oc4cncnc4)C[C@H]3C2)n1 ZINC001164752830 720802523 /nfs/dbraw/zinc/80/25/23/720802523.db2.gz ZZZIKJIITDDGBR-IRXDYDNUSA-N 1 1 414.941 3.310 20 0 HGADMO FC(F)(Sc1ccc(Cl)nc1)N1CC[N@@H+]2C[C@H](Oc3cncnc3)C[C@@H]2C1 ZINC001164748339 720803618 /nfs/dbraw/zinc/80/36/18/720803618.db2.gz QTOKFSAMLVLWKP-CHWSQXEVSA-N 1 1 413.881 3.005 20 0 HGADMO FC(F)(Sc1ccc(Cl)nc1)N1CC[N@H+]2C[C@H](Oc3cncnc3)C[C@@H]2C1 ZINC001164748339 720803623 /nfs/dbraw/zinc/80/36/23/720803623.db2.gz QTOKFSAMLVLWKP-CHWSQXEVSA-N 1 1 413.881 3.005 20 0 HGADMO COc1cc2cnc(Cl)cc2cc1N1CC[N@H+]2C[C@@H](Oc3cncnc3)C[C@@H]2C1 ZINC001164749833 720807235 /nfs/dbraw/zinc/80/72/35/720807235.db2.gz UPKWFEQHBRGWQG-SJORKVTESA-N 1 1 411.893 3.029 20 0 HGADMO Clc1cccc2ncc(N3CC[C@@H]4[C@@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)nc12 ZINC001164738354 720817936 /nfs/dbraw/zinc/81/79/36/720817936.db2.gz DYXVBISEDQOITJ-ABSDTBQOSA-N 1 1 423.952 3.254 20 0 HGADMO COc1ccc2c(ccnc2N2CC[C@@H]3[C@H](C[C@@H](Cn4cncn4)[N@H+]3CC3CC3)C2)c1 ZINC001164745613 720818440 /nfs/dbraw/zinc/81/84/40/720818440.db2.gz XFAYDYCHIPTMFT-ZRCGQRJVSA-N 1 1 418.545 3.214 20 0 HGADMO COc1cccc2ccc(N3CC[C@@H]4[C@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)nc21 ZINC001164745095 720819254 /nfs/dbraw/zinc/81/92/54/720819254.db2.gz WFDIWMILOGYTAT-NJDAHSKKSA-N 1 1 418.545 3.214 20 0 HGADMO Clc1cc2ccnc(N3CC[C@@H]4[C@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)c2cn1 ZINC001164738451 720821297 /nfs/dbraw/zinc/82/12/97/720821297.db2.gz FWHHSZVUHFEUTJ-QWFCFKBJSA-N 1 1 423.952 3.254 20 0 HGADMO COc1ccc2nc(N3CC[C@@H]4[C@@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)ccc2c1 ZINC001164743294 720821950 /nfs/dbraw/zinc/82/19/50/720821950.db2.gz RYCHOCSVWXXLHA-MIZPHKNDSA-N 1 1 418.545 3.214 20 0 HGADMO CCc1cc2c(ncnc2N2CC[C@@H]3[C@@H](C[C@@H](Cn4cncn4)[N@H+]3CC3CC3)C2)s1 ZINC001164743800 720827320 /nfs/dbraw/zinc/82/73/20/720827320.db2.gz SKLUWRKWOTVOAH-ABSDTBQOSA-N 1 1 423.590 3.225 20 0 HGADMO Clc1ccc2cc(N3CC[C@@H]4[C@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)ncc2n1 ZINC001164741189 720831407 /nfs/dbraw/zinc/83/14/07/720831407.db2.gz MAJVJDJBWFDXLT-QWFCFKBJSA-N 1 1 423.952 3.254 20 0 HGADMO COc1ccc2ccnc(N3CC[C@@H]4[C@@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)c2c1 ZINC001164741154 720840908 /nfs/dbraw/zinc/84/09/08/720840908.db2.gz DLMMKNISAILCOA-SXWKCWPCSA-N 1 1 418.545 3.214 20 0 HGADMO COc1cccc2c1ccnc2N1CC[C@@H]2[C@H](C[C@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164739544 720851119 /nfs/dbraw/zinc/85/11/19/720851119.db2.gz BATQEWWUBFFDRG-WOIUINJBSA-N 1 1 418.545 3.214 20 0 HGADMO COCC[N@H+]1CCO[C@@H]2CN(C(F)(F)c3ccc(Cl)c(Cl)n3)CC[C@H]2C1 ZINC001164854967 720854196 /nfs/dbraw/zinc/85/41/96/720854196.db2.gz LWGHDIUZHPWPGH-GXTWGEPZSA-N 1 1 410.292 3.107 20 0 HGADMO COCC[N@H+]1CCO[C@@H]2CN(c3ncc(OC)c4ccc(Cl)cc43)CC[C@H]2C1 ZINC001164853123 720855318 /nfs/dbraw/zinc/85/53/18/720855318.db2.gz GNDAZGGNGDGEAD-MGPUTAFESA-N 1 1 405.926 3.070 20 0 HGADMO Cc1cc2ncnc(N3CC[C@@H]4[C@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)c2cc1C ZINC001164751127 720856256 /nfs/dbraw/zinc/85/62/56/720856256.db2.gz QCCOEQUCZKRYGY-ZRCGQRJVSA-N 1 1 417.561 3.218 20 0 HGADMO CC(C)c1c(Cl)ncnc1N1CC[C@@H]2[C@H](C[C@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164751054 720856557 /nfs/dbraw/zinc/85/65/57/720856557.db2.gz PXZWLWUXLMSNCA-KZNAEPCWSA-N 1 1 415.973 3.224 20 0 HGADMO CC(C)c1c(Cl)ncnc1N1CC[C@@H]2[C@@H](C[C@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164751056 720857039 /nfs/dbraw/zinc/85/70/39/720857039.db2.gz PXZWLWUXLMSNCA-RCCFBDPRSA-N 1 1 415.973 3.224 20 0 HGADMO COCC[N@H+]1CCO[C@@H]2CN(c3ncnc4cc(Cl)c(Cl)cc43)CC[C@@H]2C1 ZINC001164854373 720867074 /nfs/dbraw/zinc/86/70/74/720867074.db2.gz JOYJTNRHQSMSKW-FZKQIMNGSA-N 1 1 411.333 3.110 20 0 HGADMO CCc1cnc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COCc2cccnc2)nc1 ZINC001164750885 720871224 /nfs/dbraw/zinc/87/12/24/720871224.db2.gz KDYOACUUCDMTPN-LADGPHEKSA-N 1 1 407.562 3.189 20 0 HGADMO COCC[N@H+]1CCO[C@@H]2CN(c3cnc(Cl)nc3Oc3ccccc3)CC[C@@H]2C1 ZINC001164865050 720888820 /nfs/dbraw/zinc/88/88/20/720888820.db2.gz YBAHKQBDXGXYEW-VQIMIIECSA-N 1 1 418.925 3.096 20 0 HGADMO Cc1cnc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COCc2cccnc2)c(N)c1 ZINC001164756246 720901409 /nfs/dbraw/zinc/90/14/09/720901409.db2.gz OQXLCIBVDRHFDC-ZJSXRUAMSA-N 1 1 407.562 3.122 20 0 HGADMO CCc1nc(C)cc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COCc2cccnc2)n1 ZINC001164752204 720912759 /nfs/dbraw/zinc/91/27/59/720912759.db2.gz NOBWZPMLPCDHDA-DHLKQENFSA-N 1 1 421.589 3.498 20 0 HGADMO COC(=O)/C=C/c1cc2cc[nH]c2c(N2CCn3c(C[N@@H+](C)C(C)C)cnc3[C@@H]2C)n1 ZINC001164859665 720985500 /nfs/dbraw/zinc/98/55/00/720985500.db2.gz KZAGSZJKXGLYOZ-MOEXGYKKSA-N 1 1 422.533 3.367 20 0 HGADMO COC(=O)c1c(Cl)cnc(N2CCn3c(C[N@@H+](C)C(C)C)cnc3[C@@H]2C)c1OC ZINC001164856303 720992351 /nfs/dbraw/zinc/99/23/51/720992351.db2.gz AWUHPAJXFAIOCM-ZDUSSCGKSA-N 1 1 421.929 3.148 20 0 HGADMO Fc1c(Cl)nccc1C(F)(F)N1CC[N@H+]2C[C@H](OCc3cccnc3)C[C@H]2C1 ZINC001164866268 721050533 /nfs/dbraw/zinc/05/05/33/721050533.db2.gz DJPKINRHZFXSOA-LSDHHAIUSA-N 1 1 412.843 3.294 20 0 HGADMO COc1cc(C(F)(F)N2CC[N@H+]3C[C@@H](OCc4cccnc4)C[C@H]3C2)cc(Cl)n1 ZINC001164867788 721054668 /nfs/dbraw/zinc/05/46/68/721054668.db2.gz KLJXYCWRMSQCDR-IRXDYDNUSA-N 1 1 424.879 3.163 20 0 HGADMO Fc1ccc(C(F)(F)N2CC[N@H+]3C[C@H](OCc4cccnc4)C[C@H]3C2)nc1Cl ZINC001164868750 721057466 /nfs/dbraw/zinc/05/74/66/721057466.db2.gz QFSQQRSXMNYEQG-LSDHHAIUSA-N 1 1 412.843 3.294 20 0 HGADMO FC(F)(Oc1cccnc1Cl)N1CC[N@H+]2C[C@H](OCc3cccnc3)C[C@H]2C1 ZINC001164867957 721065129 /nfs/dbraw/zinc/06/51/29/721065129.db2.gz LJIGDVYBRKNOMS-JKSUJKDBSA-N 1 1 410.852 3.034 20 0 HGADMO Fc1ccc(Cl)nc1C(F)(F)N1CC[N@H+]2C[C@@H](OCc3cccnc3)C[C@@H]2C1 ZINC001164864054 721085082 /nfs/dbraw/zinc/08/50/82/721085082.db2.gz DSUHZOQAMQHPLQ-CABCVRRESA-N 1 1 412.843 3.294 20 0 HGADMO Cc1ccc2c(c1)nc(Cl)nc2N1CC[N@H+]2C[C@@H](OCc3cccnc3)C[C@H]2C1 ZINC001164867740 721091387 /nfs/dbraw/zinc/09/13/87/721091387.db2.gz ZUITZFORKIZSNK-ROUUACIJSA-N 1 1 409.921 3.466 20 0 HGADMO COc1cc2ccnc(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@@H]4C3)c2cc1OC ZINC001164866627 721096489 /nfs/dbraw/zinc/09/64/89/721096489.db2.gz UHOMIZXHWWWKDJ-UXHICEINSA-N 1 1 420.513 3.127 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(C(F)(F)c4nc(Cl)ncc4Cl)C[C@H]3C2)cn1 ZINC001164765624 721096688 /nfs/dbraw/zinc/09/66/88/721096688.db2.gz JEZLCKWXRHWKAS-CHWSQXEVSA-N 1 1 417.291 3.020 20 0 HGADMO Cc1cc2c(nc(Cl)nc2N2C[C@@H]3CC[N@H+](Cc4cnn(C)c4)C[C@@H]3C2)s1 ZINC001164768955 721106191 /nfs/dbraw/zinc/10/61/91/721106191.db2.gz OJKHNFRXESROFZ-LSDHHAIUSA-N 1 1 402.955 3.345 20 0 HGADMO Cc1nc(C(F)(F)N2CC[N@H+]3C[C@H](OCc4cccnc4)C[C@H]3C2)nc(Cl)c1C ZINC001164867334 721109290 /nfs/dbraw/zinc/10/92/90/721109290.db2.gz XYCZGALYDKDCSP-DLBZAZTESA-N 1 1 423.895 3.166 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4nc5cc(F)c(F)cc5nc4Cl)C[C@H]3C2)cn1 ZINC001164769020 721114035 /nfs/dbraw/zinc/11/40/35/721114035.db2.gz OUCFRDLULAWAEN-UONOGXRCSA-N 1 1 418.879 3.253 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4nc(Cl)nc5c(F)cccc54)C[C@@H]3C2)cn1 ZINC001164762528 721117731 /nfs/dbraw/zinc/11/77/31/721117731.db2.gz CSUKKANXOVDZFD-GJZGRUSLSA-N 1 1 400.889 3.114 20 0 HGADMO CSc1nc2ccsc2c(N2C[C@@H]3C[N@H+](Cc4cnn(C)c4)CC[C@@H]3C2)n1 ZINC001164771726 721118024 /nfs/dbraw/zinc/11/80/24/721118024.db2.gz SSZWUZJCJPWYTM-CABCVRRESA-N 1 1 400.577 3.105 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4nc(Cl)nc5c4CCCCC5)C[C@H]3C2)cn1 ZINC001164773259 721120052 /nfs/dbraw/zinc/12/00/52/721120052.db2.gz XOASRQFQZMHGJK-IAGOWNOFSA-N 1 1 400.958 3.091 20 0 HGADMO c1ccc2c(c1)CCc1cnc(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@H]4C3)nc1-2 ZINC001164879496 721124827 /nfs/dbraw/zinc/12/48/27/721124827.db2.gz SVBKQWLEVXOFGW-VXKWHMMOSA-N 1 1 413.525 3.117 20 0 HGADMO CC(C)(C)c1nc2[nH]ccc2c(N2CC[N@H+]3C[C@@H](OCc4cccnc4)C[C@@H]3C2)n1 ZINC001164871557 721128876 /nfs/dbraw/zinc/12/88/76/721128876.db2.gz FGUJSYXNQRRXGH-MSOLQXFVSA-N 1 1 406.534 3.130 20 0 HGADMO COc1ccccc1-c1ccc(N2CC[N@H+]3C[C@H](OCc4cccnc4)C[C@H]3C2)nn1 ZINC001164872511 721147192 /nfs/dbraw/zinc/14/71/92/721147192.db2.gz HJVWIQARMKVMHK-VQTJNVASSA-N 1 1 417.513 3.027 20 0 HGADMO CCc1nc(Cl)c(N2CC[N@@H+]3C[C@@H](OCc4cccnc4)C[C@H]3C2)c(Cl)n1 ZINC001164871566 721159082 /nfs/dbraw/zinc/15/90/82/721159082.db2.gz FLJULTQRZVKRRL-GJZGRUSLSA-N 1 1 408.333 3.221 20 0 HGADMO CCc1nc(Cl)c(N2CC[N@H+]3C[C@@H](OCc4cccnc4)C[C@H]3C2)c(Cl)n1 ZINC001164871566 721159088 /nfs/dbraw/zinc/15/90/88/721159088.db2.gz FLJULTQRZVKRRL-GJZGRUSLSA-N 1 1 408.333 3.221 20 0 HGADMO Fc1cccc(-c2ccc(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@H]4C3)nn2)c1 ZINC001164880689 721162056 /nfs/dbraw/zinc/16/20/56/721162056.db2.gz XCPPNVZLFFQOBP-SFTDATJTSA-N 1 1 405.477 3.157 20 0 HGADMO CCOC(=O)c1cc2ccccc2nc1N1C[C@@H]2C[N@H+](Cc3cnn(C)c3)CC[C@@H]2C1 ZINC001164773903 721163876 /nfs/dbraw/zinc/16/38/76/721163876.db2.gz YFZLVEIGZGDTEG-UXHICEINSA-N 1 1 419.529 3.103 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4cc(-c5nc(C(C)(C)C)no5)ccn4)C[C@@H]3C2)cn1 ZINC001164774421 721183644 /nfs/dbraw/zinc/18/36/44/721183644.db2.gz ZAWZSNFKYYRHDO-OALUTQOASA-N 1 1 421.549 3.121 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4c(Cl)nc(Cl)nc4C4CC4)C[C@@H]3C2)cn1 ZINC001164768861 721241432 /nfs/dbraw/zinc/24/14/32/721241432.db2.gz YHVRCTRWGOIEQS-GJZGRUSLSA-N 1 1 407.349 3.353 20 0 HGADMO CSc1cc(C)nc(N2CCC[C@]3(C2)COCC[N@H+](Cc2c(C)noc2C)C3)n1 ZINC001164778307 721350586 /nfs/dbraw/zinc/35/05/86/721350586.db2.gz MGKKOOGPRNQGGH-NRFANRHFSA-N 1 1 417.579 3.231 20 0 HGADMO CSc1cc(C)nc(N2CCC[C@]3(C2)COCC[N@@H+](Cc2c(C)noc2C)C3)n1 ZINC001164778307 721350591 /nfs/dbraw/zinc/35/05/91/721350591.db2.gz MGKKOOGPRNQGGH-NRFANRHFSA-N 1 1 417.579 3.231 20 0 HGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@@]2(CCCN(c3nc(C)c(C)nc3Cl)C2)C1 ZINC001164778295 721351237 /nfs/dbraw/zinc/35/12/37/721351237.db2.gz LZVAAIZCSKMUJS-NRFANRHFSA-N 1 1 419.957 3.471 20 0 HGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@@]2(CCCN(c3nc(C)c(C)nc3Cl)C2)C1 ZINC001164778295 721351245 /nfs/dbraw/zinc/35/12/45/721351245.db2.gz LZVAAIZCSKMUJS-NRFANRHFSA-N 1 1 419.957 3.471 20 0 HGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@]2(CCCN(c3nc(Cl)c(F)cc3N)C2)C1 ZINC001164785244 721360058 /nfs/dbraw/zinc/36/00/58/721360058.db2.gz SSTFQUCMANKGNF-HXUWFJFHSA-N 1 1 423.920 3.180 20 0 HGADMO COc1nc(N2CCC[C@@]3(C2)COCC[N@@H+](Cc2c(C)noc2C)C3)ccc1Cl ZINC001164782980 721361729 /nfs/dbraw/zinc/36/17/29/721361729.db2.gz OOLMJCMDFVMPLG-OAQYLSRUSA-N 1 1 420.941 3.467 20 0 HGADMO COCCN1CCN(c2nc(Cl)ccc2C[NH+]2CCCC2)Cc2cccnc21 ZINC001164888015 721368878 /nfs/dbraw/zinc/36/88/78/721368878.db2.gz SSWZTVHWJWKHIN-UHFFFAOYSA-N 1 1 401.942 3.199 20 0 HGADMO C[NH+]1CCN(C[C@H]2CCC[C@@]3(CCN(C(F)(F)c4ccc(Cl)nc4)C3)O2)CC1 ZINC001164894120 721378093 /nfs/dbraw/zinc/37/80/93/721378093.db2.gz XTEGBPQQDUMJDL-MJGOQNOKSA-N 1 1 414.928 3.045 20 0 HGADMO C[NH+]1CCN(C[C@@H]2CCC[C@]3(CCN(c4nccc(Oc5ccccc5)n4)C3)O2)CC1 ZINC001164884310 721396717 /nfs/dbraw/zinc/39/67/17/721396717.db2.gz AAKPIFLSEWYCTQ-XUZZJYLKSA-N 1 1 423.561 3.034 20 0 HGADMO C[NH+]1CCN(C[C@@H]2CCC[C@]3(CCN(c4cnc5cc(Cl)ccc5n4)C3)O2)CC1 ZINC001164883509 721402734 /nfs/dbraw/zinc/40/27/34/721402734.db2.gz AHMPDAYZXPAVBO-PGRDOPGGSA-N 1 1 415.969 3.049 20 0 HGADMO CCc1cc2c(ncnc2N2CC[C@@]3(C2)CCC[C@@H](CN2CC[NH+](C)CC2)O3)s1 ZINC001164883915 721409605 /nfs/dbraw/zinc/40/96/05/721409605.db2.gz CRDOKZNDEQMVCY-HTAPYJJXSA-N 1 1 415.607 3.019 20 0 HGADMO CC(C)(C)NC(=O)c1ccc(Cl)nc1N1C[C@H]2C[NH+](Cc3nccs3)C[C@@H]2C1 ZINC001164791060 721414919 /nfs/dbraw/zinc/41/49/19/721414919.db2.gz ZDEWLSSOJGCRQB-ZIAGYGMSSA-N 1 1 419.982 3.288 20 0 HGADMO COc1ccc2ccc(N3CC[C@@]4(C3)CCC[C@@H](CN3CC[NH+](C)CC3)O4)nc2c1 ZINC001164885163 721420456 /nfs/dbraw/zinc/42/04/56/721420456.db2.gz GCDMAMWPDPPZGX-XUZZJYLKSA-N 1 1 410.562 3.009 20 0 HGADMO Cc1ccc(-c2ccc(N3CC[C@]4(C3)CCC[C@@H](CN3CC[NH+](C)CC3)O4)nn2)cc1 ZINC001164896563 721432490 /nfs/dbraw/zinc/43/24/90/721432490.db2.gz RNKAYAPDLXELSK-DHLKQENFSA-N 1 1 421.589 3.217 20 0 HGADMO c1csc(C[NH+]2C[C@H]3CN(c4nc(-c5ccncc5)nc5c4CCC5)C[C@@H]3C2)n1 ZINC001164783660 721432541 /nfs/dbraw/zinc/43/25/41/721432541.db2.gz JDNFRQIFVALWNW-IRXDYDNUSA-N 1 1 404.543 3.052 20 0 HGADMO Cc1cc(OCc2ccccc2)nc(N2C[C@@H]3C[N@@H+](Cc4nccs4)C[C@@H]3C2)n1 ZINC001164785544 721433920 /nfs/dbraw/zinc/43/39/20/721433920.db2.gz NQDARVRIZQQIOJ-KDURUIRLSA-N 1 1 407.543 3.389 20 0 HGADMO Cc1cc(OCc2ccccc2)nc(N2C[C@@H]3C[N@H+](Cc4nccs4)C[C@@H]3C2)n1 ZINC001164785544 721433923 /nfs/dbraw/zinc/43/39/23/721433923.db2.gz NQDARVRIZQQIOJ-KDURUIRLSA-N 1 1 407.543 3.389 20 0 HGADMO Cc1csc2nc(C)nc(N3CC[C@@]4(C3)CCC[C@H](CN3CC[NH+](C)CC3)O4)c12 ZINC001164890243 721441289 /nfs/dbraw/zinc/44/12/89/721441289.db2.gz CQSBSOUZNDWBBA-XMSQKQJNSA-N 1 1 415.607 3.074 20 0 HGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1cc(C)nc(SC)n1)CC2 ZINC001164790140 721448423 /nfs/dbraw/zinc/44/84/23/721448423.db2.gz WZTPTMYDBMHCDU-LJQANCHMSA-N 1 1 420.623 3.241 20 0 HGADMO CCc1ncnc(Cl)c1N1CCC2(C[C@@H](COCC3CC3)[N@@H+](CCOC)C2)CC1 ZINC001164787698 721452697 /nfs/dbraw/zinc/45/26/97/721452697.db2.gz PLWFOGVVGGRRPB-SFHVURJKSA-N 1 1 423.001 3.426 20 0 HGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1nc(C)ccc1OC)CC2 ZINC001164783301 721459081 /nfs/dbraw/zinc/45/90/81/721459081.db2.gz DEOQNHBLVCHATH-HXUWFJFHSA-N 1 1 403.567 3.133 20 0 HGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1nc(OC)ccc1Cl)CC2 ZINC001164789890 721460412 /nfs/dbraw/zinc/46/04/12/721460412.db2.gz YDVUKFCMSYUGEH-GOSISDBHSA-N 1 1 423.985 3.478 20 0 HGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1ccc(C3CC3)nn1)CC2 ZINC001164789930 721460807 /nfs/dbraw/zinc/46/08/07/721460807.db2.gz YNQFJRBFBHBDQX-HXUWFJFHSA-N 1 1 400.567 3.088 20 0 HGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1ncc(Cl)cc1N)CC2 ZINC001164788225 721464974 /nfs/dbraw/zinc/46/49/74/721464974.db2.gz IQDJGASSUNLDRH-GOSISDBHSA-N 1 1 408.974 3.051 20 0 HGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1ncc(Cl)cc1N)CC2 ZINC001164788228 721464990 /nfs/dbraw/zinc/46/49/90/721464990.db2.gz IQDJGASSUNLDRH-SFHVURJKSA-N 1 1 408.974 3.051 20 0 HGADMO CCOC(=O)c1cnc(Cl)cc1N1CC[N@H+]2C[C@H](Oc3cccc(F)c3)C[C@H]2C1 ZINC001164900763 721509568 /nfs/dbraw/zinc/50/95/68/721509568.db2.gz UPMJXLAHOJDIBS-DOTOQJQBSA-N 1 1 419.884 3.393 20 0 HGADMO Cc1cc(Cl)nc(C(F)(F)N2CC[N@H+]3C[C@@H](Oc4cccc(F)c4)C[C@@H]3C2)n1 ZINC001164900058 721512571 /nfs/dbraw/zinc/51/25/71/721512571.db2.gz NQCNVSLLAOMYIB-ZBFHGGJFSA-N 1 1 412.843 3.464 20 0 HGADMO Fc1cccc(O[C@@H]2C[C@@H]3CN(c4nc(Cl)nc5c4CCCC5)CC[N@H+]3C2)c1 ZINC001164901344 721520361 /nfs/dbraw/zinc/52/03/61/721520361.db2.gz WPOSTCZNXGKJGG-NVXWUHKLSA-N 1 1 402.901 3.490 20 0 HGADMO Cc1cc(C(F)(F)N2CC[N@H+]3C[C@@H](Oc4cccc(F)c4)C[C@@H]3C2)nc(Cl)n1 ZINC001164900062 721526255 /nfs/dbraw/zinc/52/62/55/721526255.db2.gz NQMQYYMTWWTZDC-ZBFHGGJFSA-N 1 1 412.843 3.464 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2ccnc(-c3ccccc3)n2)[C@@H]2CCCO[C@H]12 ZINC001164801553 721535850 /nfs/dbraw/zinc/53/58/50/721535850.db2.gz FPTBAGPDPNKXOY-XPNTWCBSSA-N 1 1 401.514 3.407 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2nc(Cl)nc3c2CCCC3)[C@H]2CCCO[C@@H]12 ZINC001164799882 721537929 /nfs/dbraw/zinc/53/79/29/721537929.db2.gz BOXOOSUBTLDUDZ-XUVXKRRUSA-N 1 1 413.953 3.272 20 0 HGADMO COc1ccc2nc(N3CC[N@H+]4C[C@@H](Oc5cccc(F)c5)C[C@@H]4C3)nc(C)c2c1 ZINC001164912013 721540938 /nfs/dbraw/zinc/54/09/38/721540938.db2.gz YDDVAFXYBDTDCT-XLIONFOSSA-N 1 1 408.477 3.428 20 0 HGADMO Cc1nc2cc(F)ccc2c(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@H]3OCCC[C@@H]32)n1 ZINC001164805593 721541410 /nfs/dbraw/zinc/54/14/10/721541410.db2.gz MKVLHEXOWJHGKI-FKBYEOEOSA-N 1 1 407.493 3.341 20 0 HGADMO Fc1cccc(O[C@@H]2C[C@H]3CN(c4nccc(-c5cccnc5F)n4)CC[N@H+]3C2)c1 ZINC001164911094 721544769 /nfs/dbraw/zinc/54/47/69/721544769.db2.gz VOIZYFCDMLNORM-FUHWJXTLSA-N 1 1 409.440 3.159 20 0 HGADMO COC(OC)c1cc(C)cnc1N1CC[N@H+]2C[C@@H](Oc3cccc(F)c3)C[C@@H]2C1 ZINC001164909726 721547676 /nfs/dbraw/zinc/54/76/76/721547676.db2.gz RRSGMUHIOBEANX-MJGOQNOKSA-N 1 1 401.482 3.162 20 0 HGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2ccc(C(=O)OC(C)(C)C)cn2)[C@@H]2CCCO[C@H]12 ZINC001164805707 721553051 /nfs/dbraw/zinc/55/30/51/721553051.db2.gz MYEGBJYVLXJDSX-SJBKTWHCSA-N 1 1 424.545 3.300 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2ccc(C(=O)OC(C)(C)C)cn2)[C@@H]2CCCO[C@H]12 ZINC001164805707 721553052 /nfs/dbraw/zinc/55/30/52/721553052.db2.gz MYEGBJYVLXJDSX-SJBKTWHCSA-N 1 1 424.545 3.300 20 0 HGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2ccc(C(=O)OC(C)(C)C)cn2)[C@H]2CCCO[C@H]12 ZINC001164805713 721553083 /nfs/dbraw/zinc/55/30/83/721553083.db2.gz MYEGBJYVLXJDSX-VWPQPMDRSA-N 1 1 424.545 3.300 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2ccc(C(=O)OC(C)(C)C)cn2)[C@H]2CCCO[C@H]12 ZINC001164805713 721553086 /nfs/dbraw/zinc/55/30/86/721553086.db2.gz MYEGBJYVLXJDSX-VWPQPMDRSA-N 1 1 424.545 3.300 20 0 HGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN([C@H](F)Oc2cccc(Cl)n2)[C@H]2CCCO[C@H]12 ZINC001164798540 721554205 /nfs/dbraw/zinc/55/42/05/721554205.db2.gz BGTYMGKSRIAWSM-JSJNYSNDSA-N 1 1 406.889 3.126 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN([C@H](F)Oc2cccc(Cl)n2)[C@H]2CCCO[C@H]12 ZINC001164798540 721554210 /nfs/dbraw/zinc/55/42/10/721554210.db2.gz BGTYMGKSRIAWSM-JSJNYSNDSA-N 1 1 406.889 3.126 20 0 HGADMO CC1CCN(c2ccc(N3CC[N@H+]4C[C@@H](Oc5cccc(F)c5)C[C@H]4C3)nn2)CC1 ZINC001164911658 721555397 /nfs/dbraw/zinc/55/53/97/721555397.db2.gz ZKJCFWBXWLRIKU-FPOVZHCZSA-N 1 1 411.525 3.194 20 0 HGADMO CSc1cnc(Cl)nc1N1C[C@H]([N@H+](C)Cc2cccnc2)[C@H]2OCCC[C@H]21 ZINC001164798647 721558115 /nfs/dbraw/zinc/55/81/15/721558115.db2.gz BUOOSSARRHICER-VYDXJSESSA-N 1 1 405.955 3.115 20 0 HGADMO CSc1cnc(Cl)nc1N1C[C@H]([N@@H+](C)Cc2cccnc2)[C@H]2OCCC[C@H]21 ZINC001164798647 721558117 /nfs/dbraw/zinc/55/81/17/721558117.db2.gz BUOOSSARRHICER-VYDXJSESSA-N 1 1 405.955 3.115 20 0 HGADMO CCCN(CCC)c1cncc(N2C[C@H]([N@H+](C)Cc3cccnc3)[C@H]3OCCC[C@H]32)n1 ZINC001164806235 721568244 /nfs/dbraw/zinc/56/82/44/721568244.db2.gz PKPYOTPDJOEUJL-DPLHUUCSSA-N 1 1 424.593 3.366 20 0 HGADMO CCCN(CCC)c1cncc(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@H]3OCCC[C@H]32)n1 ZINC001164806235 721568247 /nfs/dbraw/zinc/56/82/47/721568247.db2.gz PKPYOTPDJOEUJL-DPLHUUCSSA-N 1 1 424.593 3.366 20 0 HGADMO Cc1cc(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@H]32)nc(-c2ccncc2)n1 ZINC001164806226 721574976 /nfs/dbraw/zinc/57/49/76/721574976.db2.gz PJLNNGMAOSBEMX-FUPPJEDESA-N 1 1 416.529 3.110 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2ccc(-c3ccncc3)cn2)[C@@H]2CCCO[C@@H]12 ZINC001164805842 721575046 /nfs/dbraw/zinc/57/50/46/721575046.db2.gz PCXBLCZYNNWHMY-CQOQZXRMSA-N 1 1 401.514 3.407 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2ccc(-c3ccncc3)cn2)[C@H]2CCCO[C@@H]12 ZINC001164805843 721575284 /nfs/dbraw/zinc/57/52/84/721575284.db2.gz PCXBLCZYNNWHMY-WMTXJRDZSA-N 1 1 401.514 3.407 20 0 HGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2cnc(-c3ccccc3)cn2)[C@@H]2CCCO[C@@H]12 ZINC001164809894 721577142 /nfs/dbraw/zinc/57/71/42/721577142.db2.gz XYJCHHWHKDHWGK-CQOQZXRMSA-N 1 1 401.514 3.407 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2cnc(-c3ccccc3)cn2)[C@@H]2CCCO[C@@H]12 ZINC001164809894 721577143 /nfs/dbraw/zinc/57/71/43/721577143.db2.gz XYJCHHWHKDHWGK-CQOQZXRMSA-N 1 1 401.514 3.407 20 0 HGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2cc(-c3cccs3)ncn2)[C@@H]2CCCO[C@@H]12 ZINC001164799249 721581610 /nfs/dbraw/zinc/58/16/10/721581610.db2.gz ABGJMNGRQVOBHA-WOIUINJBSA-N 1 1 407.543 3.468 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2cc(-c3cccs3)ncn2)[C@@H]2CCCO[C@@H]12 ZINC001164799249 721581614 /nfs/dbraw/zinc/58/16/14/721581614.db2.gz ABGJMNGRQVOBHA-WOIUINJBSA-N 1 1 407.543 3.468 20 0 HGADMO FC1(F)CCN(c2nccc(N3CCCC3)n2)C[C@@]12CC[N@@H+](Cc1ccccn1)C2 ZINC001164905134 721582791 /nfs/dbraw/zinc/58/27/91/721582791.db2.gz SPHIEJASABZIEE-NRFANRHFSA-N 1 1 414.504 3.210 20 0 HGADMO COc1nc(Cl)cc(N2CCC(F)(F)[C@@]3(CC[N@@H+](Cc4ccccn4)C3)C2)n1 ZINC001164907914 721584948 /nfs/dbraw/zinc/58/49/48/721584948.db2.gz WJUASIKSIKYLEO-GOSISDBHSA-N 1 1 409.868 3.271 20 0 HGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2cncc(N3CCCCCC3)n2)[C@H]2CCCO[C@@H]12 ZINC001164804310 721585174 /nfs/dbraw/zinc/58/51/74/721585174.db2.gz JJSJFEUOSNBRKZ-YZUZCNPQSA-N 1 1 422.577 3.120 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2cncc(N3CCCCCC3)n2)[C@H]2CCCO[C@@H]12 ZINC001164804310 721585177 /nfs/dbraw/zinc/58/51/77/721585177.db2.gz JJSJFEUOSNBRKZ-YZUZCNPQSA-N 1 1 422.577 3.120 20 0 HGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2ccc(-c3ccsc3)nn2)[C@H]2CCCO[C@H]12 ZINC001164811298 721587458 /nfs/dbraw/zinc/58/74/58/721587458.db2.gz XDRNXKONYWWAKJ-VWPQPMDRSA-N 1 1 407.543 3.468 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2ccc(-c3ccsc3)nn2)[C@H]2CCCO[C@H]12 ZINC001164811298 721587461 /nfs/dbraw/zinc/58/74/61/721587461.db2.gz XDRNXKONYWWAKJ-VWPQPMDRSA-N 1 1 407.543 3.468 20 0 HGADMO COC(=O)c1cccnc1N1CCC(F)(F)[C@@]2(CC[N@@H+](Cc3ccccn3)C2)C1 ZINC001164907991 721587512 /nfs/dbraw/zinc/58/75/12/721587512.db2.gz XTCGEHOAXGGWKE-HXUWFJFHSA-N 1 1 402.445 3.001 20 0 HGADMO Fc1cc2c(cn1)ncnc2N1CCC(F)(F)[C@@]2(CC[N@@H+](Cc3ccccn3)C2)C1 ZINC001164907039 721695822 /nfs/dbraw/zinc/69/58/22/721695822.db2.gz QLMXQFNGWOLPLU-HXUWFJFHSA-N 1 1 414.435 3.297 20 0 HGADMO Cc1nc2ccc(N3CCC(F)(F)[C@@]4(CC[N@@H+](Cc5ccccn5)C4)C3)nc2n1C ZINC001164904347 721704034 /nfs/dbraw/zinc/70/40/34/721704034.db2.gz BXRDBUFPCVHJEP-OAQYLSRUSA-N 1 1 412.488 3.409 20 0 HGADMO CC(=O)Nc1cccc(N2CCC(F)(F)[C@@]3(CC[N@@H+](Cc4ccccn4)C3)C2)n1 ZINC001164904820 721704479 /nfs/dbraw/zinc/70/44/79/721704479.db2.gz DFLVCVLEQVXRBA-HXUWFJFHSA-N 1 1 401.461 3.173 20 0 HGADMO CN(C)C(=O)C[NH+]1CCC2(CCCN2C(F)(F)c2cc(Cl)ncc2Cl)CC1 ZINC001165009559 721731352 /nfs/dbraw/zinc/73/13/52/721731352.db2.gz YIXIIFWEZBZOFJ-UHFFFAOYSA-N 1 1 421.319 3.456 20 0 HGADMO Cc1ccc(C(F)(F)N2CCCC23CC[NH+](CC(=O)N(C)C)CC3)nc1Cl ZINC001165011147 721738570 /nfs/dbraw/zinc/73/85/70/721738570.db2.gz NHJZFQBAYWNDGG-UHFFFAOYSA-N 1 1 400.901 3.111 20 0 HGADMO COc1cnc(SC)nc1N1CCc2c(C[N@H+](C)Cc3ccco3)cncc2C1 ZINC001164909385 721745837 /nfs/dbraw/zinc/74/58/37/721745837.db2.gz QNYXQJNZOVLVSP-UHFFFAOYSA-N 1 1 411.531 3.390 20 0 HGADMO COc1cnc(SC)nc1N1CCc2c(C[N@@H+](C)Cc3ccco3)cncc2C1 ZINC001164909385 721745843 /nfs/dbraw/zinc/74/58/43/721745843.db2.gz QNYXQJNZOVLVSP-UHFFFAOYSA-N 1 1 411.531 3.390 20 0 HGADMO C[N@H+](Cc1ccco1)Cc1cncc2c1CCN(c1ccc(C(=O)NC3CC3)cn1)C2 ZINC001164910794 721756716 /nfs/dbraw/zinc/75/67/16/721756716.db2.gz RRHVDHUPKSBPNC-UHFFFAOYSA-N 1 1 417.513 3.157 20 0 HGADMO C[N@@H+](Cc1ccco1)Cc1cncc2c1CCN(c1ccc(C(=O)NC3CC3)cn1)C2 ZINC001164910794 721756718 /nfs/dbraw/zinc/75/67/18/721756718.db2.gz RRHVDHUPKSBPNC-UHFFFAOYSA-N 1 1 417.513 3.157 20 0 HGADMO Clc1ccc2ccnc(N3CCO[C@]4(C3)COCC[N@H+](Cc3cccnc3)C4)c2c1 ZINC001164912711 721778012 /nfs/dbraw/zinc/77/80/12/721778012.db2.gz OVRNBQONTCQJME-HSZRJFAPSA-N 1 1 424.932 3.391 20 0 HGADMO Clc1ccc2ccnc(N3CCO[C@]4(C3)COCC[N@@H+](Cc3cccnc3)C4)c2c1 ZINC001164912711 721778020 /nfs/dbraw/zinc/77/80/20/721778020.db2.gz OVRNBQONTCQJME-HSZRJFAPSA-N 1 1 424.932 3.391 20 0 HGADMO Cc1cccc2cc[nH+]c(N3CCO[C@@]4(C3)COCCN(Cc3cccnc3)C4)c12 ZINC001164914670 721797789 /nfs/dbraw/zinc/79/77/89/721797789.db2.gz PNCCPHMZFLPPDD-DEOSSOPVSA-N 1 1 404.514 3.046 20 0 HGADMO COC(=O)c1cnc(Cl)nc1N1C[C@@H]2CCC[C@H]([N@@H+](C)Cc3ccccn3)[C@@H]2C1 ZINC001165021355 721801094 /nfs/dbraw/zinc/80/10/94/721801094.db2.gz GKZKFUJGXLZJGX-QGTPRVQTSA-N 1 1 415.925 3.049 20 0 HGADMO C[C@@H]1CC(=O)Nc2ncnc(N3C[C@@H]4CCC[C@H]([N@@H+](C)Cc5ccccn5)[C@H]4C3)c21 ZINC001165026520 721813745 /nfs/dbraw/zinc/81/37/45/721813745.db2.gz QYQFXNDNSOYREK-NEPXVJNWSA-N 1 1 406.534 3.054 20 0 HGADMO CCOc1ccc(C(=O)OC)c(N2C[C@@H]3CCC[C@H]([N@@H+](C)Cc4ccccn4)[C@@H]3C2)n1 ZINC001165026422 721815957 /nfs/dbraw/zinc/81/59/57/721815957.db2.gz PZSITEOITBUDHG-WMQCIHAUSA-N 1 1 424.545 3.399 20 0 HGADMO CNC(=O)c1nc(N2C[C@@H]3CCC[C@@H]([N@@H+](C)Cc4ccccn4)[C@H]3C2)ccc1Cl ZINC001165025507 721816594 /nfs/dbraw/zinc/81/65/94/721816594.db2.gz NCHZZYPMRJDXHW-VDZJLULYSA-N 1 1 413.953 3.227 20 0 HGADMO CC(C)c1nc(N(C)C)nc(N2C[C@@H]3CCC[C@@H]([N@@H+](C)Cc4ccccn4)[C@H]3C2)n1 ZINC001165024253 721816665 /nfs/dbraw/zinc/81/66/65/721816665.db2.gz KBUGMTBEPCBOIT-YSIASYRMSA-N 1 1 409.582 3.193 20 0 HGADMO CCOC(=O)c1cnc(N2C[C@@H]3CCC[C@@H]([N@@H+](C)Cc4ccccn4)[C@@H]3C2)c(OC)c1 ZINC001165024232 721817238 /nfs/dbraw/zinc/81/72/38/721817238.db2.gz KAAQAKQEIUTMLT-IOMROCGXSA-N 1 1 424.545 3.399 20 0 HGADMO Cc1cn(-c2ccc(N3C[C@@H]4CCC[C@@H]([N@@H+](C)Cc5ccccn5)[C@H]4C3)nn2)cn1 ZINC001165027138 721818448 /nfs/dbraw/zinc/81/84/48/721818448.db2.gz SKJOLPHPLDKSLP-SESVDKBCSA-N 1 1 403.534 3.103 20 0 HGADMO CCCNC(=O)c1ccc(N2C[C@@H]3CCC[C@H]([N@@H+](C)Cc4ccccn4)[C@@H]3C2)nc1 ZINC001165030513 721824677 /nfs/dbraw/zinc/82/46/77/721824677.db2.gz ZNMKCWXXAHNPJH-NNWRFLSQSA-N 1 1 407.562 3.353 20 0 HGADMO COc1nc(N2C[C@@H]3CCC[C@H]([N@@H+](C)Cc4ccccn4)[C@H]3C2)nc2c1ccn2C ZINC001165027006 721830582 /nfs/dbraw/zinc/83/05/82/721830582.db2.gz QSMONAAGPFMQMG-VDGAXYAQSA-N 1 1 406.534 3.109 20 0 HGADMO CN(C)CC[N@@H+]1CC[C@@H]2[C@@H]1CCN2c1cnc(Cl)nc1Oc1cccc(F)c1 ZINC001164931845 721888373 /nfs/dbraw/zinc/88/83/73/721888373.db2.gz GGYIWJVSYKWUKJ-DLBZAZTESA-N 1 1 405.905 3.276 20 0 HGADMO CN(C)CC[N@H+]1CC[C@@H]2[C@@H]1CCN2c1cnc(Cl)nc1Oc1cccc(F)c1 ZINC001164931845 721888374 /nfs/dbraw/zinc/88/83/74/721888374.db2.gz GGYIWJVSYKWUKJ-DLBZAZTESA-N 1 1 405.905 3.276 20 0 HGADMO CCOC(=O)c1c(Cl)c2ccccc2nc1N1CC[NH+](C[C@@H]2CCCO2)CC1 ZINC001165037063 721916940 /nfs/dbraw/zinc/91/69/40/721916940.db2.gz GDCAHLMSIMEJNL-HNNXBMFYSA-N 1 1 403.910 3.366 20 0 HGADMO COc1ccc(Oc2nc(Cl)ncc2N2CC[NH+](C[C@H]3CCCO3)CC2)cc1 ZINC001165043112 721925047 /nfs/dbraw/zinc/92/50/47/721925047.db2.gz GRQLNSHLQZBJNB-QGZVFWFLSA-N 1 1 404.898 3.232 20 0 HGADMO CCOC(=O)c1cnc(N2CCC3(CC2)C[N@@H+](Cc2ccc(C)cc2)CCO3)nc1C ZINC001164941042 721925256 /nfs/dbraw/zinc/92/52/56/721925256.db2.gz ZLZNJEHSAHYMMB-UHFFFAOYSA-N 1 1 424.545 3.142 20 0 HGADMO Cc1cc(N2CC[NH+](CCOc3ccccc3)CC2)nc(NC(=O)c2ccccc2)n1 ZINC001165044447 721961258 /nfs/dbraw/zinc/96/12/58/721961258.db2.gz LOGLYIWMZSOUPG-UHFFFAOYSA-N 1 1 417.513 3.238 20 0 HGADMO O=C1NCC[N@@H+](Cc2ccccc2)C12CCN(c1nnc(Cl)c3ccccc31)CC2 ZINC001164946793 721970598 /nfs/dbraw/zinc/97/05/98/721970598.db2.gz WIZQJJDITRBARB-UHFFFAOYSA-N 1 1 421.932 3.254 20 0 HGADMO O=C1NCC[N@H+](Cc2ccccc2)C12CCN(c1nnc(Cl)c3ccccc31)CC2 ZINC001164946793 721970600 /nfs/dbraw/zinc/97/06/00/721970600.db2.gz WIZQJJDITRBARB-UHFFFAOYSA-N 1 1 421.932 3.254 20 0 HGADMO CC[NH+](CC)Cc1nc2sc(C)c(C)c2c(N2C[C@H]3COC[C@]3(COC)C2)n1 ZINC001164952349 721995230 /nfs/dbraw/zinc/99/52/30/721995230.db2.gz OQQWPVNMVCXDJW-HRAATJIYSA-N 1 1 404.580 3.249 20 0 HGADMO COC(=O)c1ccc2c(c1)ncnc2N1CCC2(CC[N@@H+](Cc3cccnc3)C2)CC1 ZINC001164955534 722013765 /nfs/dbraw/zinc/01/37/65/722013765.db2.gz WFERBZMDHJMIBU-UHFFFAOYSA-N 1 1 417.513 3.304 20 0 HGADMO CC(C)(C)NC(=O)c1ccc(N2CCC3(CC[N@@H+](Cc4cccnc4)C3)CC2)nc1 ZINC001164951654 722017491 /nfs/dbraw/zinc/01/74/91/722017491.db2.gz BQNCJXTUOJRPRG-UHFFFAOYSA-N 1 1 407.562 3.497 20 0 HGADMO O=c1ccccn1Cc1ccc(N2CCC3(CC[N@@H+](Cc4cccnc4)C3)CC2)nc1 ZINC001164955891 722022538 /nfs/dbraw/zinc/02/25/38/722022538.db2.gz RGRANWFQKKVDFA-UHFFFAOYSA-N 1 1 415.541 3.179 20 0 HGADMO Cc1nc2ccccc2c(N2CCC3(CC2)COCC[N@@H+](Cc2ccncc2)C3)n1 ZINC001164961963 722054202 /nfs/dbraw/zinc/05/42/02/722054202.db2.gz ZYRNGEUXGWKTDM-UHFFFAOYSA-N 1 1 403.530 3.452 20 0 HGADMO Cc1nc(N2CCC3(CC2)COCC[N@@H+](Cc2ccncc2)C3)nc2ccccc12 ZINC001164964633 722055346 /nfs/dbraw/zinc/05/53/46/722055346.db2.gz WFAPOVMDLLEPFT-UHFFFAOYSA-N 1 1 403.530 3.452 20 0 HGADMO F[C@H](Oc1cccc(-c2ccc(Cl)nn2)c1)N1C[C@@H]2C[N@@H+](CC3CC3)C[C@H](C1)O2 ZINC001164968236 722076609 /nfs/dbraw/zinc/07/66/09/722076609.db2.gz XERGKGAHHSVJLJ-UEXGIBASSA-N 1 1 418.900 3.224 20 0 HGADMO F[C@H](Oc1cccc(-c2ccc(Cl)nn2)c1)N1C[C@@H]2C[N@H+](CC3CC3)C[C@H](C1)O2 ZINC001164968236 722076611 /nfs/dbraw/zinc/07/66/11/722076611.db2.gz XERGKGAHHSVJLJ-UEXGIBASSA-N 1 1 418.900 3.224 20 0 HGADMO FC(F)(c1cccnc1Cl)N1CC[C@@H]2C[N@@H+](Cc3cccnc3)CCO[C@H]2C1 ZINC001164981248 722100130 /nfs/dbraw/zinc/10/01/30/722100130.db2.gz KSMZERJUJOJRAY-AEFFLSMTSA-N 1 1 408.880 3.402 20 0 HGADMO FC(F)(c1ccnc(Cl)c1)N1CC[C@H]2C[N@@H+](Cc3cccnc3)CCO[C@@H]2C1 ZINC001164986539 722100517 /nfs/dbraw/zinc/10/05/17/722100517.db2.gz ZGZOVUHCEZCHKK-FUHWJXTLSA-N 1 1 408.880 3.402 20 0 HGADMO CC(C)(C)OC(=O)c1ccnc(N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)c1 ZINC001164986635 722104281 /nfs/dbraw/zinc/10/42/81/722104281.db2.gz ZQRFUTZOTRQEHF-SFTDATJTSA-N 1 1 424.545 3.159 20 0 HGADMO Clc1cccc2c1ncnc2N1CC[C@@H]2C[N@@H+](Cc3cccnc3)CCO[C@H]2C1 ZINC001164981609 722106232 /nfs/dbraw/zinc/10/62/32/722106232.db2.gz LTMDNGATOPXPNO-XLIONFOSSA-N 1 1 409.921 3.406 20 0 HGADMO COc1cccc2ccc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)nc21 ZINC001164980102 722107198 /nfs/dbraw/zinc/10/71/98/722107198.db2.gz JIRMJFIYVWCAKC-IFMALSPDSA-N 1 1 404.514 3.366 20 0 HGADMO Clc1cccc2nc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)cnc12 ZINC001164982018 722110195 /nfs/dbraw/zinc/11/01/95/722110195.db2.gz VSWBZNYTRFFBLZ-XLIONFOSSA-N 1 1 409.921 3.406 20 0 HGADMO Fc1ccc(-c2ccnc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)n2)cc1 ZINC001164971888 722113918 /nfs/dbraw/zinc/11/39/18/722113918.db2.gz DAWSLIUCNQDMNH-OFNKIYASSA-N 1 1 419.504 3.405 20 0 HGADMO Clc1ccc2cc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)ncc2n1 ZINC001164979168 722122008 /nfs/dbraw/zinc/12/20/08/722122008.db2.gz PJXQEVRHFQIUAQ-UYAOXDASSA-N 1 1 409.921 3.406 20 0 HGADMO CCOc1ccc2ncnc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)c2c1 ZINC001164971430 722122287 /nfs/dbraw/zinc/12/22/87/722122287.db2.gz CKWSGGHOIYFLSD-WMZHIEFXSA-N 1 1 419.529 3.151 20 0 HGADMO Clc1ccc2cc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)ncc2n1 ZINC001164979164 722122525 /nfs/dbraw/zinc/12/25/25/722122525.db2.gz PJXQEVRHFQIUAQ-ICSRJNTNSA-N 1 1 409.921 3.406 20 0 HGADMO COc1ccc2ccc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)nc2c1 ZINC001164975121 722126547 /nfs/dbraw/zinc/12/65/47/722126547.db2.gz JSRICIXEIPKPEU-OFNKIYASSA-N 1 1 404.514 3.366 20 0 HGADMO CC(C)n1ccc2c1ncnc2N1CC[C@@H]2C[N@@H+](Cc3cccnc3)CCO[C@@H]2C1 ZINC001164978885 722136479 /nfs/dbraw/zinc/13/64/79/722136479.db2.gz KHWUULDLYNDEBK-TZIWHRDSSA-N 1 1 406.534 3.135 20 0 HGADMO c1ccc(-c2cc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)ncn2)cc1 ZINC001164975158 722138273 /nfs/dbraw/zinc/13/82/73/722138273.db2.gz DXOMFUUHWKYPQT-FYYLOGMGSA-N 1 1 401.514 3.266 20 0 HGADMO c1cncc(C[N@H+]2CCO[C@H]3CN(c4ncnc5sc6c(c54)CCC6)CC[C@H]3C2)c1 ZINC001164980362 722139159 /nfs/dbraw/zinc/13/91/59/722139159.db2.gz NFSIRPJQQMFSEX-HKUYNNGSSA-N 1 1 421.570 3.302 20 0 HGADMO c1csc(-c2cc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)ncn2)c1 ZINC001164983331 722144891 /nfs/dbraw/zinc/14/48/91/722144891.db2.gz UGSLUEZKVLDYQW-AZUAARDMSA-N 1 1 407.543 3.327 20 0 HGADMO COc1ccc2nc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)c(C)nc2c1 ZINC001164976068 722146474 /nfs/dbraw/zinc/14/64/74/722146474.db2.gz GYARHEFXVSRBGM-AUSIDOKSSA-N 1 1 419.529 3.069 20 0 HGADMO c1ccc(Oc2nccnc2N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)cc1 ZINC001164985066 722150505 /nfs/dbraw/zinc/15/05/05/722150505.db2.gz ZBHOIRAUXMTCAV-RBBKRZOGSA-N 1 1 417.513 3.391 20 0 HGADMO Fc1ccc(-c2cncc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)n2)cc1 ZINC001164971136 722154038 /nfs/dbraw/zinc/15/40/38/722154038.db2.gz AUDYYFGZWJBRDS-NFBKMPQASA-N 1 1 419.504 3.405 20 0 HGADMO c1cncc(C[N@H+]2CCO[C@@H]3CN(c4nccc5c6c([nH]c54)CCC6)CC[C@@H]3C2)c1 ZINC001164971203 722154113 /nfs/dbraw/zinc/15/41/13/722154113.db2.gz BCMJXPGGJVTUHP-XMSQKQJNSA-N 1 1 403.530 3.174 20 0 HGADMO COC(=O)c1cnc(Cl)nc1N1CCC[C@]2(CC[N@H+]2Cc2cccc(F)c2)C1 ZINC001164995124 722192386 /nfs/dbraw/zinc/19/23/86/722192386.db2.gz RVMJWIYVVNXCAX-FQEVSTJZSA-N 1 1 404.873 3.301 20 0 HGADMO CN(C)c1nc(C[NH2+][C@H](CO)Cc2ccc(F)cc2)c(Cl)n1-c1ccccc1 ZINC000802647885 1126110671 /nfs/dbraw/zinc/11/06/71/1126110671.db2.gz RMDQXIBVRBQBRA-KRWDZBQOSA-N 1 1 402.901 3.424 20 0 HGADMO CS(=O)(=O)c1ccc(Cl)nc1N1CCC[C@@H]2C[N@H+](Cc3ccccc3)C[C@H]21 ZINC001164621780 719094108 /nfs/dbraw/zinc/09/41/08/719094108.db2.gz AUFYDSOKYXQZJE-IAGOWNOFSA-N 1 1 405.951 3.239 20 0 HGADMO CS(=O)(=O)c1ccc(Cl)nc1N1CCC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]21 ZINC001164621780 719094114 /nfs/dbraw/zinc/09/41/14/719094114.db2.gz AUFYDSOKYXQZJE-IAGOWNOFSA-N 1 1 405.951 3.239 20 0 HGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2C[C@@H](N3CCCC3=O)[C@@H]3OCCC[C@H]3C2)nc1 ZINC001164646029 719305876 /nfs/dbraw/zinc/30/58/76/719305876.db2.gz AVLUJUXDMCANRD-FBHSLPMESA-N 1 1 412.578 3.235 20 0 HGADMO CCOC(=O)c1cnc(Cl)cc1N1CCc2c(C[NH+](C)C)nn(C(C)C)c2C1 ZINC001164649582 719306925 /nfs/dbraw/zinc/30/69/25/719306925.db2.gz UVCRYCVSEQNKPZ-UHFFFAOYSA-N 1 1 405.930 3.313 20 0 HGADMO CC(C)n1nc(C[NH+](C)C)c2c1CN(c1ncccc1C(=O)N1CCC(C)CC1)CC2 ZINC001164653577 719315014 /nfs/dbraw/zinc/31/50/14/719315014.db2.gz WLSWJZLQNKODIF-UHFFFAOYSA-N 1 1 424.593 3.355 20 0 HGADMO Cc1oncc1C(=O)N[C@@H]1C[N@@H+](C(C)(C)c2ccnc(Cl)c2)C[C@@H]2CCCO[C@@H]12 ZINC001164654547 719321168 /nfs/dbraw/zinc/32/11/68/719321168.db2.gz RLSMWHVOWVMAIK-POZUXBRTSA-N 1 1 418.925 3.176 20 0 HGADMO Cc1oncc1C(=O)N[C@@H]1C[N@H+](C(C)(C)c2ccnc(Cl)c2)C[C@@H]2CCCO[C@@H]12 ZINC001164654547 719321172 /nfs/dbraw/zinc/32/11/72/719321172.db2.gz RLSMWHVOWVMAIK-POZUXBRTSA-N 1 1 418.925 3.176 20 0 HGADMO COc1ccnc(N2CCC3(C[C@@H](CC(=O)NCC[NH+](C)C)c4ccccc43)CC2)c1 ZINC001164683054 719657658 /nfs/dbraw/zinc/65/76/58/719657658.db2.gz UOHUXEANKBWZAJ-LJQANCHMSA-N 1 1 422.573 3.184 20 0 HGADMO CNC(=O)C[N@H+]1CCCC12CCN(c1cc(Cl)nc3c(OC)cccc13)CC2 ZINC001164687165 719695932 /nfs/dbraw/zinc/69/59/32/719695932.db2.gz QDWYYKKFPUCKMR-UHFFFAOYSA-N 1 1 402.926 3.078 20 0 HGADMO CNC(=O)C[N@H+]1CCCC12CCN(c1nc3ccccc3c(-c3ccccc3)n1)CC2 ZINC001164687517 719715175 /nfs/dbraw/zinc/71/51/75/719715175.db2.gz YRTOUFYDTIPDOS-UHFFFAOYSA-N 1 1 415.541 3.478 20 0 HGADMO CNC(=O)C[N@H+]1CCCC12CCN(c1nnc(Cl)c3ccc(Cl)cc31)CC2 ZINC001164689653 719751245 /nfs/dbraw/zinc/75/12/45/719751245.db2.gz JVOWWUBSNIUHTC-UHFFFAOYSA-N 1 1 408.333 3.117 20 0 HGADMO COC(=O)c1ccc(N2CCC3(CCC[N@H+]3Cc3csc(C)n3)CC2)nc1OC ZINC001164691506 719804835 /nfs/dbraw/zinc/80/48/35/719804835.db2.gz IOILVYVBAXKUDI-UHFFFAOYSA-N 1 1 416.547 3.277 20 0 HGADMO COC(=O)[C@@]1(C)C[C@@H]([NH+]2CCOCC2)CCN1c1cc(Cl)nc2ccc(F)cc21 ZINC001164701092 719847174 /nfs/dbraw/zinc/84/71/74/719847174.db2.gz LXLHTVQTPFTHBQ-YCRPNKLZSA-N 1 1 421.900 3.260 20 0 HGADMO COC(=O)[C@@]1(C)C[C@H]([NH+]2CCOCC2)CCN1c1cc(Cl)nc2ccsc21 ZINC001164703274 719849618 /nfs/dbraw/zinc/84/96/18/719849618.db2.gz PRENUNMBSLFZKY-BFUOFWGJSA-N 1 1 409.939 3.182 20 0 HGADMO Cc1cnc(N2CCC3(CC2)C[N@@H+](Cc2cccs2)CCO3)nc1N1CCCC1 ZINC001164700339 719885933 /nfs/dbraw/zinc/88/59/33/719885933.db2.gz KANSCUFAPNGQGZ-UHFFFAOYSA-N 1 1 413.591 3.318 20 0 HGADMO Clc1ncnc2[nH]cc(N3CCC4(CC3)C[N@@H+](Cc3cccs3)CCO4)c21 ZINC001164695274 719887670 /nfs/dbraw/zinc/88/76/70/719887670.db2.gz KUVFVMRBLPRBTC-UHFFFAOYSA-N 1 1 403.939 3.496 20 0 HGADMO CCOC(=O)c1cc(C)cc(N2CCC3(CC2)C[N@@H+](Cc2cccs2)CCO3)n1 ZINC001164696048 719888059 /nfs/dbraw/zinc/88/80/59/719888059.db2.gz VOKYLKCGSKIIIZ-UHFFFAOYSA-N 1 1 415.559 3.500 20 0 HGADMO COC(=O)c1cnc(N2CCC3(CC2)C[N@@H+](Cc2cccs2)CCO3)c(C)c1 ZINC001164694734 719889904 /nfs/dbraw/zinc/88/99/04/719889904.db2.gz DNAMVVCCRODBGA-UHFFFAOYSA-N 1 1 401.532 3.110 20 0 HGADMO CCCNC(=O)c1cccnc1N1CCC2(CC1)C[N@@H+](Cc1cccs1)CCO2 ZINC001164697651 719897489 /nfs/dbraw/zinc/89/74/89/719897489.db2.gz MQMKWJNMESKNBL-UHFFFAOYSA-N 1 1 414.575 3.154 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1nc(Cl)nc3ccc(OC)cc31)C2 ZINC001164806708 720067589 /nfs/dbraw/zinc/06/75/89/720067589.db2.gz CZRAGUULRXMHCF-ZHRRBRCNSA-N 1 1 416.953 3.477 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1nc(Cl)nc3[nH]cc(Cl)c31)C2 ZINC001164812712 720070830 /nfs/dbraw/zinc/07/08/30/720070830.db2.gz RHNNGVGZWAEJQS-ORAYPTAESA-N 1 1 410.349 3.449 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1nnc(Cl)cc1-c1ccncc1)C2 ZINC001164810859 720081671 /nfs/dbraw/zinc/08/16/71/720081671.db2.gz MBYIYYKWACPODY-GCJKJVERSA-N 1 1 413.953 3.377 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1cncc(OCc3ccccc3)n1)C2 ZINC001164809288 720086869 /nfs/dbraw/zinc/08/68/69/720086869.db2.gz JFSXOPCWBFHBGX-QPPBQGQZSA-N 1 1 408.546 3.240 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1nc(Cl)nc(-c3ccccc3)n1)C2 ZINC001164806445 720098946 /nfs/dbraw/zinc/09/89/46/720098946.db2.gz CYZWPPSGISUKJF-AVRDEDQJSA-N 1 1 413.953 3.377 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1nc(Cl)nc(-c3ccccc3)n1)C2 ZINC001164806446 720099275 /nfs/dbraw/zinc/09/92/75/720099275.db2.gz CYZWPPSGISUKJF-GCJKJVERSA-N 1 1 413.953 3.377 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1cc(OCc3ccccc3)cnn1)C2 ZINC001164807294 720130553 /nfs/dbraw/zinc/13/05/53/720130553.db2.gz BTIYFJKTAQQYJJ-XUZZJYLKSA-N 1 1 408.546 3.240 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1ccc3cc(OC)c(OC)cc3n1)C2 ZINC001164807002 720134375 /nfs/dbraw/zinc/13/43/75/720134375.db2.gz ADDVZXWIMCMOEU-CYFREDJKSA-N 1 1 411.546 3.437 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1nccc(-c3cccc(OC)c3)n1)C2 ZINC001164807058 720145006 /nfs/dbraw/zinc/14/50/06/720145006.db2.gz AXCQWWNPRPRCHH-RDPSFJRHSA-N 1 1 408.546 3.337 20 0 HGADMO COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1cnc3c(n1)CCCC3)CC2 ZINC001164713954 720151768 /nfs/dbraw/zinc/15/17/68/720151768.db2.gz UIAPJFKYHZPHQA-HXUWFJFHSA-N 1 1 407.562 3.258 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1nc3ccccc3nc1N1CCCC1)C2 ZINC001164817427 720160405 /nfs/dbraw/zinc/16/04/05/720160405.db2.gz PIOMHQPAUZOWKR-CPJSRVTESA-N 1 1 421.589 3.415 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(C(F)(F)c1cc(C)nnc1Cl)C2 ZINC001164817067 720173089 /nfs/dbraw/zinc/17/30/89/720173089.db2.gz NUQADMGMQPNIOU-CRAIPNDOSA-N 1 1 400.901 3.168 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1nc(C(=O)OC)cc3ccccc31)C2 ZINC001164817823 720174335 /nfs/dbraw/zinc/17/43/35/720174335.db2.gz QIMZVQISFWHHCO-DVECYGJZSA-N 1 1 409.530 3.206 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1cc(-c3ccccc3OC)ncn1)C2 ZINC001164812422 720176097 /nfs/dbraw/zinc/17/60/97/720176097.db2.gz ANSUWJVSZXZLEZ-DVECYGJZSA-N 1 1 408.546 3.337 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1cncc(OCC3CCCC3)n1)C2 ZINC001164810764 720196351 /nfs/dbraw/zinc/19/63/51/720196351.db2.gz CNKADTDCMYIJLC-OFNKIYASSA-N 1 1 400.567 3.230 20 0 HGADMO CCCSc1ncnc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COC)c1OC ZINC001164812946 720200275 /nfs/dbraw/zinc/20/02/75/720200275.db2.gz NJWFQCURLJXEFK-LAUBAEHRSA-N 1 1 406.596 3.172 20 0 HGADMO CC(C)[N@@H+](C)Cc1cc(=O)n2c(n1)CN(c1ncc3c(Cl)cccc3n1)CCC2 ZINC001164814062 720225794 /nfs/dbraw/zinc/22/57/94/720225794.db2.gz RWPVEQZUUWJXST-UHFFFAOYSA-N 1 1 412.925 3.090 20 0 HGADMO COc1ccc2ccc(N3CCCn4c(=O)cc(C[N@@H+](C)C(C)C)nc4C3)nc2c1 ZINC001164814791 720226398 /nfs/dbraw/zinc/22/63/98/720226398.db2.gz ZEZWZAUQQWCYPQ-UHFFFAOYSA-N 1 1 407.518 3.051 20 0 HGADMO CN(C)c1ccc(-c2ccnc(N3CC[C@@H]4[C@@H]3CC[N@H+]4Cc3cccnc3)n2)cc1 ZINC001164732821 720420727 /nfs/dbraw/zinc/42/07/27/720420727.db2.gz OINXKEGMBDRKQV-PKTZIBPZSA-N 1 1 400.530 3.458 20 0 HGADMO CC1CCN(C(=O)c2cccnc2N2CC[C@H]3[C@H]2CC[N@H+]3Cc2cccnc2)CC1 ZINC001164727967 720436796 /nfs/dbraw/zinc/43/67/96/720436796.db2.gz FMJQJMMKQJMUAA-FCHUYYIVSA-N 1 1 405.546 3.202 20 0 HGADMO COC(=O)c1nc(N2CC[C@H]3[C@H]2CC[N@H+]3Cc2cccnc2)c2ccccc2c1OC ZINC001164735071 720459754 /nfs/dbraw/zinc/45/97/54/720459754.db2.gz VMWBOBHGKAUJSN-VQTJNVASSA-N 1 1 418.497 3.278 20 0 HGADMO Cc1cnc(N2CC[C@@H]3[C@@H](C[C@H](Cn4cccn4)[N@@H+]3C(C)C)C2)nc1NCC1CC1 ZINC001164836533 720504897 /nfs/dbraw/zinc/50/48/97/720504897.db2.gz MXTPSYUJSWEXIA-PWRODBHTSA-N 1 1 409.582 3.181 20 0 HGADMO COC(=O)c1ccc(Cl)nc1N1CC[C@@H]2[C@H](C[C@@H](Cn3cccn3)[N@H+]2C(C)C)C1 ZINC001164841119 720507794 /nfs/dbraw/zinc/50/77/94/720507794.db2.gz XOEWGPSJTKEDDM-SOLBZPMBSA-N 1 1 417.941 3.096 20 0 HGADMO CC(C)[N@@H+]1[C@@H]2CCN(C(F)(F)c3nccc(Cl)n3)C[C@H]2C[C@H]1Cn1cccn1 ZINC001164840024 720514959 /nfs/dbraw/zinc/51/49/59/720514959.db2.gz VUMIWFLJVKDCFP-OWCLPIDISA-N 1 1 410.900 3.249 20 0 HGADMO CC(C)[N@@H+]1[C@@H]2CCN([C@H](F)Oc3ccnc(Cl)c3)C[C@H]2C[C@H]1Cn1cccn1 ZINC001164835739 720523821 /nfs/dbraw/zinc/52/38/21/720523821.db2.gz KRIYHGNWVFWDDO-HNAWSFBYSA-N 1 1 407.921 3.437 20 0 HGADMO COc1c(Cl)nc(C)nc1N1CC[C@@H]2[C@H](C[C@@H](Cn3cccn3)[N@H+]2C(C)C)C1 ZINC001164839318 720543302 /nfs/dbraw/zinc/54/33/02/720543302.db2.gz QFXNLTAMKXAXDJ-IXDOHACOSA-N 1 1 404.946 3.021 20 0 HGADMO CCOC(=O)c1cc(C)cnc1N1CC[C@@H]2[C@@H](C[C@@H](Cn3cccn3)[N@H+]2C(C)C)C1 ZINC001164836334 720546035 /nfs/dbraw/zinc/54/60/35/720546035.db2.gz JOUUFMOOWKPKOS-IRFCIJBXSA-N 1 1 411.550 3.141 20 0 HGADMO CCOC(=O)c1cc(N2CC[C@@H]3[C@H](C[C@@H](Cn4cccn4)[N@H+]3C(C)C)C2)ncc1C ZINC001164842990 720552520 /nfs/dbraw/zinc/55/25/20/720552520.db2.gz ZKIACYLTHCTCNU-SVFBPWRDSA-N 1 1 411.550 3.141 20 0 HGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@H]2CN(c3ncnc4cc(Cl)cnc43)CC[C@@H]21 ZINC001164836605 720559725 /nfs/dbraw/zinc/55/97/25/720559725.db2.gz KFFDUNBSINZJBT-IEZWGBDMSA-N 1 1 411.941 3.253 20 0 HGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@@H]2CN(c3cc(C(=O)NC(C)(C)C)ccn3)CC[C@@H]21 ZINC001164839575 720577268 /nfs/dbraw/zinc/57/72/68/720577268.db2.gz QPEIECHPGTVSBS-HKBOAZHASA-N 1 1 424.593 3.184 20 0 HGADMO COC(=O)/C=C/c1cc(C)cnc1N1CC[C@@H]2[C@H](C[C@H](Cn3cccn3)[N@H+]2C(C)C)C1 ZINC001164842210 720579121 /nfs/dbraw/zinc/57/91/21/720579121.db2.gz UMDXKJOVRYTKOS-LDVMJDGHSA-N 1 1 423.561 3.151 20 0 HGADMO CCOCc1cnc(Cl)nc1N1CC[C@@H]2[C@H](C[C@@H](Cn3cccn3)[N@H+]2C(C)C)C1 ZINC001164840284 720588377 /nfs/dbraw/zinc/58/83/77/720588377.db2.gz PWRKLWBFFYKWFY-NZSAHSFTSA-N 1 1 418.973 3.241 20 0 HGADMO CC(C)[N@@H+]1[C@@H]2CCN(c3ccc(N4CCC(C)CC4)nn3)C[C@@H]2C[C@H]1Cn1cccn1 ZINC001164840080 720606884 /nfs/dbraw/zinc/60/68/84/720606884.db2.gz OWSHSJWKXXCATJ-FDFHNCONSA-N 1 1 423.609 3.287 20 0 HGADMO COc1cccc2c(N3CC[N@H+]4C[C@@H](Oc5cncnc5)C[C@H]4C3)cc(Cl)nc12 ZINC001164743742 720607021 /nfs/dbraw/zinc/60/70/21/720607021.db2.gz QKMRAPJLWLSNOI-GJZGRUSLSA-N 1 1 411.893 3.029 20 0 HGADMO FC(F)(c1cc(Cl)ncc1Cl)N1CC[N@@H+]2C[C@@H](Oc3cncnc3)C[C@@H]2C1 ZINC001164739615 720621891 /nfs/dbraw/zinc/62/18/91/720621891.db2.gz GGIAFQVIIFRALE-NEPJUHHUSA-N 1 1 416.259 3.065 20 0 HGADMO FC(F)(c1cc(Cl)ncc1Cl)N1CC[N@H+]2C[C@@H](Oc3cncnc3)C[C@@H]2C1 ZINC001164739615 720621896 /nfs/dbraw/zinc/62/18/96/720621896.db2.gz GGIAFQVIIFRALE-NEPJUHHUSA-N 1 1 416.259 3.065 20 0 HGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@H]2CN(c3ccc(-c4ccccn4)nn3)CC[C@@H]21 ZINC001164841666 720622675 /nfs/dbraw/zinc/62/26/75/720622675.db2.gz UAZWXTWACXEGAK-IPJJNNNSSA-N 1 1 403.534 3.113 20 0 HGADMO COC(=O)c1cc(F)cnc1N1CCC2(C[C@@H]([N@@H+](C)Cc3ccccc3)CO2)CC1 ZINC001164840552 720663555 /nfs/dbraw/zinc/66/35/55/720663555.db2.gz NKJZSJDACJBSRB-LJQANCHMSA-N 1 1 413.493 3.267 20 0 HGADMO COC(=O)c1ccc(C)nc1N1CCC2(C[C@H]([N@@H+](C)Cc3ccccc3)CO2)CC1 ZINC001164840450 720666048 /nfs/dbraw/zinc/66/60/48/720666048.db2.gz MPNMSAIZYKBNJD-FQEVSTJZSA-N 1 1 409.530 3.437 20 0 HGADMO Clc1ccc2nc(N3CC[N@H+]4C[C@@H](Oc5cncnc5)C[C@@H]4C3)c(Cl)nc2c1 ZINC001164737836 720671735 /nfs/dbraw/zinc/67/17/35/720671735.db2.gz HIDWSBLCINBWQK-KGLIPLIRSA-N 1 1 417.300 3.069 20 0 HGADMO COc1cnc(N2CC[N@H+]3C[C@H](Oc4cncnc4)C[C@H]3C2)c2cc(Cl)ccc12 ZINC001164740109 720697686 /nfs/dbraw/zinc/69/76/86/720697686.db2.gz QARIHEZOSRGOIR-JKSUJKDBSA-N 1 1 411.893 3.029 20 0 HGADMO COC(=O)c1cc(C)cc(N2CCC3(C[C@@H]([N@@H+](C)Cc4ccccc4)CO3)CC2)n1 ZINC001164843655 720700083 /nfs/dbraw/zinc/70/00/83/720700083.db2.gz PVOWRODRJIEORQ-HXUWFJFHSA-N 1 1 409.530 3.437 20 0 HGADMO Cc1nc2sc3c(c2c(N2CC[N@H+]4C[C@@H](Oc5cncnc5)C[C@H]4C2)n1)CCCC3 ZINC001164738497 720756624 /nfs/dbraw/zinc/75/66/24/720756624.db2.gz FVDMPTPZSDMJMA-HOTGVXAUSA-N 1 1 422.558 3.010 20 0 HGADMO Clc1ccc2c(Cl)nnc(N3CC[N@H+]4C[C@@H](Oc5cncnc5)C[C@@H]4C3)c2c1 ZINC001164748896 720792821 /nfs/dbraw/zinc/79/28/21/720792821.db2.gz RVBRDRQTFZODOV-KGLIPLIRSA-N 1 1 417.300 3.069 20 0 HGADMO Clc1cc(C2CCCCC2)nc(N2CC[N@H+]3C[C@H](Oc4cncnc4)C[C@@H]3C2)n1 ZINC001164752827 720802296 /nfs/dbraw/zinc/80/22/96/720802296.db2.gz ZZZIKJIITDDGBR-IAGOWNOFSA-N 1 1 414.941 3.310 20 0 HGADMO FC(F)(c1cnc(Cl)c(C2CC2)c1)N1CC[N@@H+]2C[C@H](Oc3cncnc3)C[C@@H]2C1 ZINC001164751147 720806634 /nfs/dbraw/zinc/80/66/34/720806634.db2.gz WZNBKRUNMLKMQB-HZPDHXFCSA-N 1 1 421.879 3.289 20 0 HGADMO FC(F)(c1cnc(Cl)c(C2CC2)c1)N1CC[N@H+]2C[C@H](Oc3cncnc3)C[C@@H]2C1 ZINC001164751147 720806637 /nfs/dbraw/zinc/80/66/37/720806637.db2.gz WZNBKRUNMLKMQB-HZPDHXFCSA-N 1 1 421.879 3.289 20 0 HGADMO c1ncn(C[C@@H]2C[C@H]3CN(c4ccc(-c5ccccc5)nn4)CC[C@H]3[N@H+]2CC2CC2)n1 ZINC001164738422 720816271 /nfs/dbraw/zinc/81/62/71/720816271.db2.gz FRDRKVKYWSKJSS-QNWVGRARSA-N 1 1 415.545 3.115 20 0 HGADMO COc1ccc2c(ccnc2N2CC[C@@H]3[C@@H](C[C@H](Cn4cncn4)[N@H+]3CC3CC3)C2)c1 ZINC001164745610 720818577 /nfs/dbraw/zinc/81/85/77/720818577.db2.gz XFAYDYCHIPTMFT-MIZPHKNDSA-N 1 1 418.545 3.214 20 0 HGADMO Clc1cc(N2CC[C@@H]3[C@@H](C[C@H](Cn4cncn4)[N@H+]3CC3CC3)C2)c2c(n1)CCC2 ZINC001164740273 720820209 /nfs/dbraw/zinc/82/02/09/720820209.db2.gz JYMHCCIHLJUOHF-SQGPQFPESA-N 1 1 412.969 3.195 20 0 HGADMO Fc1ccc2nc(N3CC[C@@H]4[C@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)ccc2c1 ZINC001164744447 720824415 /nfs/dbraw/zinc/82/44/15/720824415.db2.gz UGFTVTGNNCDOOT-KAGYGMCKSA-N 1 1 406.509 3.345 20 0 HGADMO Clc1cc(N2CC[C@@H]3[C@@H](C[C@@H](Cn4cncn4)[N@H+]3CC3CC3)C2)c2cccnc2n1 ZINC001164737722 720825132 /nfs/dbraw/zinc/82/51/32/720825132.db2.gz CGXNJWBZJHUPRB-JENIJYKNSA-N 1 1 423.952 3.254 20 0 HGADMO COC[C@]12CCCO[C@@H]1CCN(c1ncnc3c1CC[N@H+](Cc1ccccc1)C3)C2 ZINC001164851042 720825661 /nfs/dbraw/zinc/82/56/61/720825661.db2.gz WJADUFLBWFOKCT-ISKFKSNPSA-N 1 1 408.546 3.057 20 0 HGADMO COC[C@]12CCCO[C@@H]1CCN(c1ncnc3c1CC[N@@H+](Cc1ccccc1)C3)C2 ZINC001164851042 720825662 /nfs/dbraw/zinc/82/56/62/720825662.db2.gz WJADUFLBWFOKCT-ISKFKSNPSA-N 1 1 408.546 3.057 20 0 HGADMO Cc1cc(Cl)c(C)c(N2CC[C@@H]3[C@H](C[C@@H](Cn4cncn4)[N@H+]3CC3CC3)C2)n1 ZINC001164739380 720833356 /nfs/dbraw/zinc/83/33/56/720833356.db2.gz ACXVYWJEGRGXKU-WSTZPKSXSA-N 1 1 400.958 3.323 20 0 HGADMO COc1ccc2ccnc(N3CC[C@@H]4[C@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)c2c1 ZINC001164741157 720841092 /nfs/dbraw/zinc/84/10/92/720841092.db2.gz DLMMKNISAILCOA-ZRCGQRJVSA-N 1 1 418.545 3.214 20 0 HGADMO Clc1ccnc2ccc(N3CC[C@@H]4[C@@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)nc12 ZINC001164751085 720843202 /nfs/dbraw/zinc/84/32/02/720843202.db2.gz YKJZVVGTTTVZQO-SQGPQFPESA-N 1 1 423.952 3.254 20 0 HGADMO CSc1cc(Cl)cnc1N1CC[C@@H]2[C@@H](C[C@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164748363 720843590 /nfs/dbraw/zinc/84/35/90/720843590.db2.gz UKUVJPDYXMRNDE-CGTJXYLNSA-N 1 1 418.998 3.428 20 0 HGADMO c1ncn(C[C@H]2C[C@H]3CN(c4ccc(-c5ccncc5)cn4)CC[C@H]3[N@H+]2CC2CC2)n1 ZINC001164747725 720845003 /nfs/dbraw/zinc/84/50/03/720845003.db2.gz RMQGYGBRMZPDEL-YTFSRNRJSA-N 1 1 415.545 3.115 20 0 HGADMO COCC[N@H+]1CCO[C@H]2CN(c3nc4ccc(Cl)cc4nc3Cl)CC[C@H]2C1 ZINC001164851408 720848334 /nfs/dbraw/zinc/84/83/34/720848334.db2.gz GWZBQWJHLPYDRU-GUYCJALGSA-N 1 1 411.333 3.110 20 0 HGADMO c1csc(-c2cc(N3CC[C@@H]4[C@H](C[C@@H](Cn5cncn5)[N@@H+]4CC4CC4)C3)ncn2)c1 ZINC001164749506 720850520 /nfs/dbraw/zinc/85/05/20/720850520.db2.gz VYAZNYQLOSJPEE-WSTZPKSXSA-N 1 1 421.574 3.176 20 0 HGADMO COCC[N@H+]1CCO[C@H]2CN(c3ncnc4cc(Cl)c(Cl)cc43)CC[C@H]2C1 ZINC001164854376 720866967 /nfs/dbraw/zinc/86/69/67/720866967.db2.gz JOYJTNRHQSMSKW-UGSOOPFHSA-N 1 1 411.333 3.110 20 0 HGADMO Clc1cnc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COCc2cccnc2)nc1 ZINC001164750142 720868058 /nfs/dbraw/zinc/86/80/58/720868058.db2.gz JAXBGGZCTGEYNL-DENIHFKCSA-N 1 1 413.953 3.280 20 0 HGADMO c1cc2ncc(N3CC[C@@]4(C3)C[N@H+](CC3CC3)C[C@H]4COCc3cccnc3)nc2[nH]1 ZINC001164754880 720869488 /nfs/dbraw/zinc/86/94/88/720869488.db2.gz UILQXEOIOCGGIR-RDPSFJRHSA-N 1 1 418.545 3.108 20 0 HGADMO CCc1cnc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COCc2cccnc2)nc1 ZINC001164750888 720871335 /nfs/dbraw/zinc/87/13/35/720871335.db2.gz KDYOACUUCDMTPN-UPVQGACJSA-N 1 1 407.562 3.189 20 0 HGADMO COCC[N@H+]1CCO[C@@H]2CN(c3nc(C)nc4sc5c(c43)CCCC5)CC[C@H]2C1 ZINC001164852946 720873232 /nfs/dbraw/zinc/87/32/32/720873232.db2.gz AREQQEACDCQVDM-FUHWJXTLSA-N 1 1 416.591 3.052 20 0 HGADMO Clc1ncncc1N1CC[C@@]2(C1)C[N@@H+](CC1CC1)C[C@H]2COCc1cccnc1 ZINC001164754350 720876673 /nfs/dbraw/zinc/87/66/73/720876673.db2.gz RHXOTWCXDZWCQV-UGKGYDQZSA-N 1 1 413.953 3.280 20 0 HGADMO COCC[N@H+]1CCO[C@H]2CN(c3c(C)nc(-c4ccccc4)nc3Cl)CC[C@@H]2C1 ZINC001164859911 720878954 /nfs/dbraw/zinc/87/89/54/720878954.db2.gz NFASTLMSIBSHLU-MOPGFXCFSA-N 1 1 416.953 3.279 20 0 HGADMO COCC[N@H+]1CCO[C@@H]2CN(c3cc(F)ccc3-c3ccc(Cl)nn3)CC[C@@H]2C1 ZINC001164854919 720881240 /nfs/dbraw/zinc/88/12/40/720881240.db2.gz GGKFDYZIRIBHQZ-FOIQADDNSA-N 1 1 420.916 3.110 20 0 HGADMO Cc1nc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COCc2cccnc2)ncc1F ZINC001164755061 720887135 /nfs/dbraw/zinc/88/71/35/720887135.db2.gz KMRNXVYJBRGGFU-OFNKIYASSA-N 1 1 411.525 3.074 20 0 HGADMO COCC[N@H+]1CCO[C@H]2CN(C(F)(F)C3(c4ccnc(Cl)c4)CC3)CC[C@@H]2C1 ZINC001164860526 720890762 /nfs/dbraw/zinc/89/07/62/720890762.db2.gz OTQGKABHDAHSMP-WBVHZDCISA-N 1 1 415.912 3.029 20 0 HGADMO C[N@@H+](Cc1ccc(N2CC[C@]3(C2)C[C@@H](NC(=O)c2ccccc2)CCO3)nc1)C1CC1 ZINC001164861545 720902437 /nfs/dbraw/zinc/90/24/37/720902437.db2.gz TVXLAKRQJXHTBZ-SQJMNOBHSA-N 1 1 420.557 3.234 20 0 HGADMO CCc1nc(C)cc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COCc2cccnc2)n1 ZINC001164752207 720913169 /nfs/dbraw/zinc/91/31/69/720913169.db2.gz NOBWZPMLPCDHDA-RCZVLFRGSA-N 1 1 421.589 3.498 20 0 HGADMO CCOC(=O)c1cnc(N2CCn3c(C[N@@H+](C)C(C)C)cnc3[C@H]2C)cc1OCC ZINC001164858683 720958771 /nfs/dbraw/zinc/95/87/71/720958771.db2.gz JYWFTVHHXCPZAR-MRXNPFEDSA-N 1 1 415.538 3.275 20 0 HGADMO CC(C)[N@@H+](C)Cc1cnc2n1CCN(C(F)(F)c1nc(Cl)nc3[nH]cnc31)[C@H]2C ZINC001164858916 721004711 /nfs/dbraw/zinc/00/47/11/721004711.db2.gz JENSARLFWAFANS-NSHDSACASA-N 1 1 424.887 3.121 20 0 HGADMO c1ccc(Oc2ccnc(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@H]4C3)n2)cc1 ZINC001164868814 721065848 /nfs/dbraw/zinc/06/58/48/721065848.db2.gz QRKSRRTVAUPFAW-PZJWPPBQSA-N 1 1 403.486 3.144 20 0 HGADMO Cc1cc(Cl)ncc1C(F)(F)N1CC[N@H+]2C[C@H](OCc3cccnc3)C[C@H]2C1 ZINC001164865566 721090539 /nfs/dbraw/zinc/09/05/39/721090539.db2.gz NBWPYCJUCBIDNA-DLBZAZTESA-N 1 1 408.880 3.463 20 0 HGADMO Cc1nc2cc(Cl)ccc2c(N2CC[N@H+]3C[C@H](OCc4cccnc4)C[C@H]3C2)n1 ZINC001164867194 721091156 /nfs/dbraw/zinc/09/11/56/721091156.db2.gz WUGVUBJXWBGGFI-RBUKOAKNSA-N 1 1 409.921 3.466 20 0 HGADMO Cc1nc2cc(Cl)ccc2c(N2CC[N@H+]3C[C@H](OCc4cccnc4)C[C@@H]3C2)n1 ZINC001164867195 721091696 /nfs/dbraw/zinc/09/16/96/721091696.db2.gz WUGVUBJXWBGGFI-RTBURBONSA-N 1 1 409.921 3.466 20 0 HGADMO COc1ccc(C(F)(F)N2CC[N@H+]3C[C@@H](OCc4cccnc4)C[C@H]3C2)nc1Cl ZINC001164863696 721100747 /nfs/dbraw/zinc/10/07/47/721100747.db2.gz CZIOHTXYJYXUQL-HOTGVXAUSA-N 1 1 424.879 3.163 20 0 HGADMO COc1cc2ccc(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@@H]4C3)nc2cc1OC ZINC001164865445 721107659 /nfs/dbraw/zinc/10/76/59/721107659.db2.gz LIWYZEOUILINET-WOJBJXKFSA-N 1 1 420.513 3.127 20 0 HGADMO COc1cccc(-c2ccnc(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@H]4C3)n2)c1 ZINC001164867349 721114593 /nfs/dbraw/zinc/11/45/93/721114593.db2.gz YDWJBMQVUDFGES-UNMCSNQZSA-N 1 1 417.513 3.027 20 0 HGADMO CCOC(=O)c1cc(N2C[C@@H]3CC[N@@H+](Cc4cnn(C)c4)C[C@@H]3C2)nc2ccccc21 ZINC001164769012 721124571 /nfs/dbraw/zinc/12/45/71/721124571.db2.gz OTYGXKRIBRHWFM-RBUKOAKNSA-N 1 1 419.529 3.103 20 0 HGADMO COc1ccccc1-c1cc(N2CC[N@H+]3C[C@H](OCc4cccnc4)C[C@H]3C2)ncn1 ZINC001164879426 721153931 /nfs/dbraw/zinc/15/39/31/721153931.db2.gz SDHBCSLWXJAUEF-VQTJNVASSA-N 1 1 417.513 3.027 20 0 HGADMO COc1ccccc1-c1cc(N2CC[N@H+]3C[C@H](OCc4cccnc4)C[C@@H]3C2)ncn1 ZINC001164879427 721155431 /nfs/dbraw/zinc/15/54/31/721155431.db2.gz SDHBCSLWXJAUEF-WOJBJXKFSA-N 1 1 417.513 3.027 20 0 HGADMO Fc1ccc(-c2ccc(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@H]4C3)nn2)cc1 ZINC001164874574 721156921 /nfs/dbraw/zinc/15/69/21/721156921.db2.gz KSTDSHGXTKLHFY-SFTDATJTSA-N 1 1 405.477 3.157 20 0 HGADMO Cc1c(Cl)nc(C(C)C)nc1N1CC[N@H+]2C[C@@H](OCc3cccnc3)C[C@@H]2C1 ZINC001164871546 721178652 /nfs/dbraw/zinc/17/86/52/721178652.db2.gz FGOJKLLZSYCADL-MSOLQXFVSA-N 1 1 401.942 3.437 20 0 HGADMO Fc1ccc(-c2cncc(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@H]4C3)n2)cc1 ZINC001164870984 721182680 /nfs/dbraw/zinc/18/26/80/721182680.db2.gz CUDORWMUDRJPMW-LEWJYISDSA-N 1 1 405.477 3.157 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4cc(-c5nc(C(C)(C)C)no5)ccn4)C[C@@H]3C2)cn1 ZINC001164774419 721183583 /nfs/dbraw/zinc/18/35/83/721183583.db2.gz ZAWZSNFKYYRHDO-MOPGFXCFSA-N 1 1 421.549 3.121 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4ccc(NC(=O)OC(C)(C)C)cn4)C[C@H]3C2)cn1 ZINC001164764170 721188056 /nfs/dbraw/zinc/18/80/56/721188056.db2.gz GKIBLLILJOKEKK-QZTJIDSGSA-N 1 1 412.538 3.120 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4ncccc4OCc4ccccc4)C[C@H]3C2)cn1 ZINC001164768631 721192432 /nfs/dbraw/zinc/19/24/32/721192432.db2.gz LKHNUVCAWNMHHO-FCHUYYIVSA-N 1 1 403.530 3.352 20 0 HGADMO Cc1c(Cl)nc(C(C)(C)C)nc1N1C[C@@H]2CC[N@H+](Cc3cnn(C)c3)C[C@@H]2C1 ZINC001164774438 721195345 /nfs/dbraw/zinc/19/53/45/721195345.db2.gz ZEUQAYBXZCTTAR-DLBZAZTESA-N 1 1 402.974 3.428 20 0 HGADMO O=C(N1CCCC1)C12CC(C1)CN2c1ccc2c(n1)CC[N@H+](Cc1ccccc1)C2 ZINC001164872604 721236912 /nfs/dbraw/zinc/23/69/12/721236912.db2.gz NBEGIGRZSACTNE-UHFFFAOYSA-N 1 1 402.542 3.231 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4c(Cl)nc(Cl)nc4C4CC4)C[C@H]3C2)cn1 ZINC001164768863 721242592 /nfs/dbraw/zinc/24/25/92/721242592.db2.gz YHVRCTRWGOIEQS-HUUCEWRRSA-N 1 1 407.349 3.353 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4c(F)ccc5c(Cl)ncnc54)C[C@@H]3C2)cn1 ZINC001164764882 721244383 /nfs/dbraw/zinc/24/43/83/721244383.db2.gz QIIOSFGVGYSOLM-GJZGRUSLSA-N 1 1 400.889 3.114 20 0 HGADMO CCN1CC[C@]2(CN(c3ccc4c(n3)CC[N@H+](Cc3ccccc3)C4)C[C@H]2C)C1=O ZINC001164777297 721317882 /nfs/dbraw/zinc/31/78/82/721317882.db2.gz JNQWZOGNMFFMMW-KBMIEXCESA-N 1 1 404.558 3.335 20 0 HGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@]2(CCCN(c3nc(C)cc(Cl)n3)C2)C1 ZINC001164777980 721333563 /nfs/dbraw/zinc/33/35/63/721333563.db2.gz RSCVJHPFSBAGSK-HXUWFJFHSA-N 1 1 405.930 3.162 20 0 HGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@]2(CCCN(c3nc(C)cc(Cl)n3)C2)C1 ZINC001164777980 721333568 /nfs/dbraw/zinc/33/35/68/721333568.db2.gz RSCVJHPFSBAGSK-HXUWFJFHSA-N 1 1 405.930 3.162 20 0 HGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@@]2(CCCN(c3nncc4ccccc43)C2)C1 ZINC001164776831 721341519 /nfs/dbraw/zinc/34/15/19/721341519.db2.gz DDSICLMHAVTURL-QHCPKHFHSA-N 1 1 407.518 3.354 20 0 HGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2CC[C@@H]3OCC[C@]3(C(=O)NCC3CC3)C2)nc1 ZINC001164882875 721345543 /nfs/dbraw/zinc/34/55/43/721345543.db2.gz IGZNSKPHKUSBLF-DPLHUUCSSA-N 1 1 412.578 3.140 20 0 HGADMO COc1cc(Cl)cc(N2CCC[C@]3(C2)COCC[N@H+](Cc2c(C)noc2C)C3)n1 ZINC001164779112 721348595 /nfs/dbraw/zinc/34/85/95/721348595.db2.gz RCYUUEVOQSIJBG-NRFANRHFSA-N 1 1 420.941 3.467 20 0 HGADMO COc1cc(Cl)cc(N2CCC[C@]3(C2)COCC[N@@H+](Cc2c(C)noc2C)C3)n1 ZINC001164779112 721348597 /nfs/dbraw/zinc/34/85/97/721348597.db2.gz RCYUUEVOQSIJBG-NRFANRHFSA-N 1 1 420.941 3.467 20 0 HGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@@]2(CCCN(c3cnc(Cl)cc3N)C2)C1 ZINC001164781641 721363432 /nfs/dbraw/zinc/36/34/32/721363432.db2.gz KHUWCFMVUBYQKL-FQEVSTJZSA-N 1 1 405.930 3.041 20 0 HGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@]2(CCCN(c3ncc(Cl)cc3N)C2)C1 ZINC001164787058 721363897 /nfs/dbraw/zinc/36/38/97/721363897.db2.gz XXHDULXPCCADNT-HXUWFJFHSA-N 1 1 405.930 3.041 20 0 HGADMO CC(C)(c1ccnc(Cl)c1)[N@@H+]1C[C@@H]2CCCO[C@H]2[C@@H](NC(=O)c2cccnc2)C1 ZINC001164786949 721382321 /nfs/dbraw/zinc/38/23/21/721382321.db2.gz VMGMUBLKLPXSCI-XKGZKEIXSA-N 1 1 414.937 3.275 20 0 HGADMO CC(C)(c1ccnc(Cl)c1)[N@H+]1C[C@@H]2CCCO[C@H]2[C@@H](NC(=O)c2cccnc2)C1 ZINC001164786949 721382324 /nfs/dbraw/zinc/38/23/24/721382324.db2.gz VMGMUBLKLPXSCI-XKGZKEIXSA-N 1 1 414.937 3.275 20 0 HGADMO C[NH+]1CCN(C[C@H]2CCC[C@@]3(CCN(c4cc(Cl)nc5ncccc45)C3)O2)CC1 ZINC001164883641 721405824 /nfs/dbraw/zinc/40/58/24/721405824.db2.gz BOVPFPHBAYSCDK-VGSWGCGISA-N 1 1 415.969 3.049 20 0 HGADMO C[NH+]1CCN(C[C@@H]2CCC[C@]3(CCN(c4cnc5ccc(Cl)cc5n4)C3)O2)CC1 ZINC001164885643 721406034 /nfs/dbraw/zinc/40/60/34/721406034.db2.gz GWSPDCUGJQTDJB-PGRDOPGGSA-N 1 1 415.969 3.049 20 0 HGADMO CCN(CC)C(=O)c1cc(Cl)nc(N2C[C@H]3C[NH+](Cc4nccs4)C[C@@H]3C2)c1 ZINC001164781804 721414339 /nfs/dbraw/zinc/41/43/39/721414339.db2.gz FFVJCSHQHNXNIU-HZPDHXFCSA-N 1 1 419.982 3.242 20 0 HGADMO CC(C)n1cnc2c1nc(Cl)nc2N1C[C@@H]2C[N@@H+](Cc3nccs3)C[C@@H]2C1 ZINC001164781737 721420093 /nfs/dbraw/zinc/42/00/93/721420093.db2.gz DMPQXQVVOQYQLS-BETUJISGSA-N 1 1 403.943 3.085 20 0 HGADMO CC(C)n1cnc2c1nc(Cl)nc2N1C[C@@H]2C[N@H+](Cc3nccs3)C[C@@H]2C1 ZINC001164781737 721420095 /nfs/dbraw/zinc/42/00/95/721420095.db2.gz DMPQXQVVOQYQLS-BETUJISGSA-N 1 1 403.943 3.085 20 0 HGADMO CC(C)n1cnc2c1nc(Cl)nc2N1C[C@H]2C[NH+](Cc3nccs3)C[C@@H]2C1 ZINC001164781738 721420276 /nfs/dbraw/zinc/42/02/76/721420276.db2.gz DMPQXQVVOQYQLS-CHWSQXEVSA-N 1 1 403.943 3.085 20 0 HGADMO CSc1ccnc(Cl)c1N1CC[C@]2(C1)CCC[C@H](CN1CC[NH+](C)CC1)O2 ZINC001164890595 721421505 /nfs/dbraw/zinc/42/15/05/721421505.db2.gz TZNGPQZEXVOWHW-UZLBHIALSA-N 1 1 411.015 3.222 20 0 HGADMO O=C(OCc1ccccc1)c1ccc(N2C[C@@H]3C[N@@H+](Cc4nccs4)C[C@@H]3C2)nc1 ZINC001164783318 721429309 /nfs/dbraw/zinc/42/93/09/721429309.db2.gz IIQFFGSYGJLIBD-BGYRXZFFSA-N 1 1 420.538 3.463 20 0 HGADMO O=C(OCc1ccccc1)c1ccc(N2C[C@@H]3C[N@H+](Cc4nccs4)C[C@@H]3C2)nc1 ZINC001164783318 721429312 /nfs/dbraw/zinc/42/93/12/721429312.db2.gz IIQFFGSYGJLIBD-BGYRXZFFSA-N 1 1 420.538 3.463 20 0 HGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1cc(Cl)cc(OC)n1)CC2 ZINC001164783525 721459001 /nfs/dbraw/zinc/45/90/01/721459001.db2.gz DICGYTQEURGCGC-IBGZPJMESA-N 1 1 423.985 3.478 20 0 HGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1ncncc1C(C)C)CC2 ZINC001164786809 721459670 /nfs/dbraw/zinc/45/96/70/721459670.db2.gz PLHAJSOUVURZDV-HXUWFJFHSA-N 1 1 402.583 3.334 20 0 HGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1cc(CC(C)C)ncn1)CC2 ZINC001164788804 721468063 /nfs/dbraw/zinc/46/80/63/721468063.db2.gz LFYUJTAMEUQRDR-QFIPXVFZSA-N 1 1 416.610 3.409 20 0 HGADMO C[N@@H+](Cc1ccc(N2Cc3nccn3C[C@@H](COCc3ccccn3)C2)nc1)C1CC1 ZINC001164888976 721470171 /nfs/dbraw/zinc/47/01/71/721470171.db2.gz GTARGSWODHANFV-HXUWFJFHSA-N 1 1 418.545 3.121 20 0 HGADMO CCc1cc(CC)nc(N2CCC3(C[C@@H](COCC4CC4)[N@@H+](CCOC)C3)CC2)n1 ZINC001164788791 721473290 /nfs/dbraw/zinc/47/32/90/721473290.db2.gz KXGCPRHYXIKMHO-QFIPXVFZSA-N 1 1 416.610 3.335 20 0 HGADMO CN1Cc2ccccc2CC2(CCN(c3ccc(C[N@@H+](C)C4CC4)cn3)CC2)C1=O ZINC001164893448 721474161 /nfs/dbraw/zinc/47/41/61/721474161.db2.gz IXTLIHIIHHMFON-UHFFFAOYSA-N 1 1 404.558 3.477 20 0 HGADMO COC(=O)c1ccc(N2CCC3(CC([N@@H+](C)Cc4ccncc4)C3)CC2)nc1OC ZINC001164793109 721491010 /nfs/dbraw/zinc/49/10/10/721491010.db2.gz NVSHAGFGBTXBKW-UHFFFAOYSA-N 1 1 410.518 3.153 20 0 HGADMO C[N@@H+](Cc1ccncc1)C1CC2(C1)CCN(c1nc(Cl)cc3c1CNC3=O)CC2 ZINC001164792976 721497180 /nfs/dbraw/zinc/49/71/80/721497180.db2.gz WSWIBSVNPXDYNI-UHFFFAOYSA-N 1 1 411.937 3.254 20 0 HGADMO CON(C)C(=O)c1cc(C)cnc1N1CCC2(CC([N@@H+](C)Cc3ccncc3)C2)CC1 ZINC001164796357 721498827 /nfs/dbraw/zinc/49/88/27/721498827.db2.gz RBSCRGYTAXWOBY-UHFFFAOYSA-N 1 1 423.561 3.299 20 0 HGADMO Fc1cccc(O[C@@H]2C[C@H]3CN(c4nc(Cl)nc5c4SCC5)CC[N@H+]3C2)c1 ZINC001164903942 721527058 /nfs/dbraw/zinc/52/70/58/721527058.db2.gz DLAYVFCHLRUCMD-DZGCQCFKSA-N 1 1 406.914 3.259 20 0 HGADMO Fc1cccc(O[C@@H]2C[C@H]3CN(c4nc(Cl)nc5ncsc54)CC[N@H+]3C2)c1 ZINC001164908604 721536017 /nfs/dbraw/zinc/53/60/17/721536017.db2.gz PUODREVGXFWMMC-GXTWGEPZSA-N 1 1 405.886 3.221 20 0 HGADMO CCOC(=O)c1cnc(N2CC[N@H+]3C[C@@H](Oc4cccc(F)c4)C[C@H]3C2)c(Cl)c1 ZINC001164907167 721536552 /nfs/dbraw/zinc/53/65/52/721536552.db2.gz MJHKSDGYAFPVNA-WMZOPIPTSA-N 1 1 419.884 3.393 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2nc(Cl)nc3c2CCCC3)[C@@H]2CCCO[C@H]21 ZINC001164799881 721538116 /nfs/dbraw/zinc/53/81/16/721538116.db2.gz BOXOOSUBTLDUDZ-VAMGGRTRSA-N 1 1 413.953 3.272 20 0 HGADMO CCOC(=O)c1c(C)cc(N2CC[N@H+]3C[C@H](Oc4cccc(F)c4)C[C@@H]3C2)nc1C ZINC001164909748 721540895 /nfs/dbraw/zinc/54/08/95/721540895.db2.gz RSSLAYONYNGFFI-UYAOXDASSA-N 1 1 413.493 3.356 20 0 HGADMO Fc1cccc(O[C@H]2C[C@H]3CN(c4cncc(N5CCCCCC5)n4)CC[N@H+]3C2)c1 ZINC001164903541 721559797 /nfs/dbraw/zinc/55/97/97/721559797.db2.gz CCYWJVDAFZZQBQ-FPOVZHCZSA-N 1 1 411.525 3.338 20 0 HGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2ccc(-c3cccs3)nn2)[C@H]2CCCO[C@H]12 ZINC001164806693 721564331 /nfs/dbraw/zinc/56/43/31/721564331.db2.gz QXDZMTAUYGPURO-JQVVWYNYSA-N 1 1 407.543 3.468 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2ccc(-c3cccs3)nn2)[C@H]2CCCO[C@H]12 ZINC001164806693 721564333 /nfs/dbraw/zinc/56/43/33/721564333.db2.gz QXDZMTAUYGPURO-JQVVWYNYSA-N 1 1 407.543 3.468 20 0 HGADMO CN(C)c1nc(Cl)cc(N2CCC(F)(F)[C@]3(CC[N@@H+](Cc4ccccn4)C3)C2)n1 ZINC001164905775 721584065 /nfs/dbraw/zinc/58/40/65/721584065.db2.gz WYWIVUKLVMITLB-IBGZPJMESA-N 1 1 422.911 3.329 20 0 HGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2cncc(N3CCCCCC3)n2)[C@@H]2CCCO[C@H]12 ZINC001164804304 721585223 /nfs/dbraw/zinc/58/52/23/721585223.db2.gz JJSJFEUOSNBRKZ-LGVFNWMJSA-N 1 1 422.577 3.120 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2cncc(N3CCCCCC3)n2)[C@@H]2CCCO[C@H]12 ZINC001164804304 721585224 /nfs/dbraw/zinc/58/52/24/721585224.db2.gz JJSJFEUOSNBRKZ-LGVFNWMJSA-N 1 1 422.577 3.120 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2nccc3c4c([nH]c32)CCC4)[C@H]2CCCO[C@@H]12 ZINC001164808287 721589121 /nfs/dbraw/zinc/58/91/21/721589121.db2.gz QGQQQYQTYPONKM-QZNHQXDQSA-N 1 1 403.530 3.315 20 0 HGADMO FC1(F)CCN(c2nc(Cl)nc(Cl)n2)C[C@]12CC[N@@H+](Cc1ccccn1)C2 ZINC001164907102 721695846 /nfs/dbraw/zinc/69/58/46/721695846.db2.gz RPSJOJJGYHXFAK-MRXNPFEDSA-N 1 1 415.275 3.311 20 0 HGADMO COCc1cc(N2CCC(F)(F)[C@]3(CC[N@@H+](Cc4ccccn4)C3)C2)nc(C)n1 ZINC001164906981 721700815 /nfs/dbraw/zinc/70/08/15/721700815.db2.gz QBEDLBBUQTWCMC-FQEVSTJZSA-N 1 1 403.477 3.064 20 0 HGADMO CC(C)N(C)Cc1nnc2n1CCCN(c1[nH+]cnc3c1ccn3C1CCCC1)C2 ZINC001165010853 721706363 /nfs/dbraw/zinc/70/63/63/721706363.db2.gz NSFWNBPBHFAYET-UHFFFAOYSA-N 1 1 408.554 3.388 20 0 HGADMO COc1cnc(N2CCc3c(C[N@H+](C)Cc4ccco4)cncc3C2)nc1NC(C)C ZINC001164913484 721743076 /nfs/dbraw/zinc/74/30/76/721743076.db2.gz WFDDYAAVYDAUFZ-UHFFFAOYSA-N 1 1 422.533 3.488 20 0 HGADMO COc1cnc(N2CCc3c(C[N@@H+](C)Cc4ccco4)cncc3C2)nc1NC(C)C ZINC001164913484 721743083 /nfs/dbraw/zinc/74/30/83/721743083.db2.gz WFDDYAAVYDAUFZ-UHFFFAOYSA-N 1 1 422.533 3.488 20 0 HGADMO CC(C)c1nc(N(C)C)nc(N2CCc3c(C[N@H+](C)Cc4ccco4)cncc3C2)n1 ZINC001164911571 721757517 /nfs/dbraw/zinc/75/75/17/721757517.db2.gz WQYQZTHGTDKLMX-UHFFFAOYSA-N 1 1 421.549 3.244 20 0 HGADMO CC(C)c1nc(N(C)C)nc(N2CCc3c(C[N@@H+](C)Cc4ccco4)cncc3C2)n1 ZINC001164911571 721757524 /nfs/dbraw/zinc/75/75/24/721757524.db2.gz WQYQZTHGTDKLMX-UHFFFAOYSA-N 1 1 421.549 3.244 20 0 HGADMO C[N@@H+](Cc1ccc(N2CCO[C@H]3[C@H]2CC[C@H]3COCc2nccs2)nc1)C1CC1 ZINC001164916701 721811028 /nfs/dbraw/zinc/81/10/28/721811028.db2.gz ITXWOPNJKNJTLN-LRXVAGHRSA-N 1 1 414.575 3.333 20 0 HGADMO CCOC(=O)c1ncnc(N2C[C@@H]3CCC[C@H]([N@@H+](C)Cc4ccccn4)[C@@H]3C2)c1C ZINC001165023608 721814803 /nfs/dbraw/zinc/81/48/03/721814803.db2.gz IJXVQSQFSBSZSE-SXLOBPIMSA-N 1 1 409.534 3.094 20 0 HGADMO CCOc1ccc(C(=O)OC)c(N2C[C@@H]3CCC[C@@H]([N@@H+](C)Cc4ccccn4)[C@@H]3C2)n1 ZINC001165026421 721815884 /nfs/dbraw/zinc/81/58/84/721815884.db2.gz PZSITEOITBUDHG-IOMROCGXSA-N 1 1 424.545 3.399 20 0 HGADMO C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@H]2CN(c3nc(Cl)cc4c3CNC4=O)C[C@@H]21 ZINC001165028994 721817102 /nfs/dbraw/zinc/81/71/02/721817102.db2.gz YLDNPMWITLWBQA-ZOCIIQOWSA-N 1 1 411.937 3.110 20 0 HGADMO CCOC(=O)c1cnc(N2C[C@@H]3CCC[C@H]([N@@H+](C)Cc4ccccn4)[C@H]3C2)c(OC)c1 ZINC001165024236 721817171 /nfs/dbraw/zinc/81/71/71/721817171.db2.gz KAAQAKQEIUTMLT-YYWHXJBOSA-N 1 1 424.545 3.399 20 0 HGADMO Cc1nc(CN2CCOC[C@@]3(CN(c4[nH+]ccc5ccc(C)cc54)CCO3)C2)cs1 ZINC001164925523 721827373 /nfs/dbraw/zinc/82/73/73/721827373.db2.gz RSYQWCGBUZFSPS-QHCPKHFHSA-N 1 1 424.570 3.416 20 0 HGADMO C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@@H]2CN([C@H](F)Oc3cncc(Cl)n3)C[C@@H]21 ZINC001165027880 721829177 /nfs/dbraw/zinc/82/91/77/721829177.db2.gz USGXEVOUQMMWOB-ASKNOMKYSA-N 1 1 405.905 3.389 20 0 HGADMO CN(C)CC[N@@H+]1CC[C@@H]2[C@@H]1CCN2c1cnc(Cl)nc1Oc1ccccc1F ZINC001164935565 721888439 /nfs/dbraw/zinc/88/84/39/721888439.db2.gz XSPPVCCOVIMWIU-JKSUJKDBSA-N 1 1 405.905 3.276 20 0 HGADMO CN(C)CC[N@H+]1CC[C@@H]2[C@@H]1CCN2c1cnc(Cl)nc1Oc1ccccc1F ZINC001164935565 721888441 /nfs/dbraw/zinc/88/84/41/721888441.db2.gz XSPPVCCOVIMWIU-JKSUJKDBSA-N 1 1 405.905 3.276 20 0 HGADMO COc1cnc(Cl)nc1N1CCC2(CC1)C[N@@H+](Cc1ccc(C)cc1)CCO2 ZINC001164938349 721920890 /nfs/dbraw/zinc/92/08/90/721920890.db2.gz LVKNYTCQZRTSPC-UHFFFAOYSA-N 1 1 402.926 3.318 20 0 HGADMO Cc1ccc(C[N@H+]2CCOC3(CCN(c4cc(C(N)=O)c(Cl)cn4)CC3)C2)cc1 ZINC001164937935 721921663 /nfs/dbraw/zinc/92/16/63/721921663.db2.gz HSLTWJDBRWHRTF-UHFFFAOYSA-N 1 1 414.937 3.014 20 0 HGADMO COc1ccccc1Oc1nc(Cl)ncc1N1CC[NH+](C[C@@H]2CCCO2)CC1 ZINC001165043315 721925545 /nfs/dbraw/zinc/92/55/45/721925545.db2.gz IWTSEQQXYQNLDX-HNNXBMFYSA-N 1 1 404.898 3.232 20 0 HGADMO O=C1NCC[N@@H+](Cc2ccccc2)C12CCN(c1ccc3cccc(F)c3n1)CC2 ZINC001164946010 721976824 /nfs/dbraw/zinc/97/68/24/721976824.db2.gz IIJLSYAMQLXPAB-UHFFFAOYSA-N 1 1 404.489 3.345 20 0 HGADMO O=C1NCC[N@H+](Cc2ccccc2)C12CCN(c1ccc3cccc(F)c3n1)CC2 ZINC001164946010 721976829 /nfs/dbraw/zinc/97/68/29/721976829.db2.gz IIJLSYAMQLXPAB-UHFFFAOYSA-N 1 1 404.489 3.345 20 0 HGADMO CC(C)(C)NC(=O)c1cc(Cl)nc(N2CC[NH+](CCc3ccccn3)CC2)c1 ZINC001165055932 722014530 /nfs/dbraw/zinc/01/45/30/722014530.db2.gz NRCGQEXXWHUWAN-UHFFFAOYSA-N 1 1 401.942 3.023 20 0 HGADMO CC(C)(C)OC(=O)c1ccnc(N2CCC3(CC[N@@H+](Cc4cccnc4)C3)CC2)n1 ZINC001164955210 722018536 /nfs/dbraw/zinc/01/85/36/722018536.db2.gz ACJIZXGBFTXFCI-UHFFFAOYSA-N 1 1 409.534 3.319 20 0 HGADMO CC(C)(C)NC(=O)c1ccnc(N2CCC3(CC[N@@H+](Cc4cccnc4)C3)CC2)c1 ZINC001164955276 722019758 /nfs/dbraw/zinc/01/97/58/722019758.db2.gz CUWGUXIXSBJCLS-UHFFFAOYSA-N 1 1 407.562 3.497 20 0 HGADMO Cc1sc2nc(C[NH+]3CCCC3)nc(N3C[C@H]4[C@@H](C3)[C@@H]4NC(=O)C(C)C)c2c1C ZINC001164958231 722039633 /nfs/dbraw/zinc/03/96/33/722039633.db2.gz BUSANPOITOWLOH-MNZLEMJZSA-N 1 1 413.591 3.111 20 0 HGADMO O=C(c1ccco1)N1CC[C@@H]2CN(c3nc(Cl)ccc3C[NH+]3CCCC3)C[C@H]21 ZINC001164960814 722047301 /nfs/dbraw/zinc/04/73/01/722047301.db2.gz XHMJWMQRQUOTTB-NVXWUHKLSA-N 1 1 400.910 3.275 20 0 HGADMO F[C@@H](Oc1ccnc(Cl)c1)N1CCC2(CC1)COCC[N@@H+](Cc1ccncc1)C2 ZINC001164964870 722054541 /nfs/dbraw/zinc/05/45/41/722054541.db2.gz YUYZJTMJYHNQJE-HXUWFJFHSA-N 1 1 420.916 3.377 20 0 HGADMO CCOc1nc(Cl)cc(N2CCC3(CC2)COCC[N@@H+](Cc2ccncc2)C3)n1 ZINC001164964667 722054760 /nfs/dbraw/zinc/05/47/60/722054760.db2.gz WMRYZULEKUPSNW-UHFFFAOYSA-N 1 1 417.941 3.043 20 0 HGADMO COc1ccc2c(c1)ncnc2N1CCC2(CC1)COCC[N@@H+](Cc1ccncc1)C2 ZINC001164963128 722056049 /nfs/dbraw/zinc/05/60/49/722056049.db2.gz HLKSOHLSRXIEEG-UHFFFAOYSA-N 1 1 419.529 3.152 20 0 HGADMO CSc1ncc(Cl)nc1N1CCC2(CC1)COCC[N@@H+](Cc1ccncc1)C2 ZINC001164960719 722058609 /nfs/dbraw/zinc/05/86/09/722058609.db2.gz JDFCTTNQYXYLJQ-UHFFFAOYSA-N 1 1 419.982 3.366 20 0 HGADMO COc1cccc2ncnc(N3CCC4(CC3)COCC[N@@H+](Cc3ccncc3)C4)c21 ZINC001164960654 722059803 /nfs/dbraw/zinc/05/98/03/722059803.db2.gz GCFUMEWNDSGZNY-UHFFFAOYSA-N 1 1 419.529 3.152 20 0 HGADMO FC(F)(c1cc(Cl)nc(-c2cccnc2)n1)N1C[C@@H]2C[N@@H+](CC3CC3)C[C@H](C1)O2 ZINC001164967473 722074910 /nfs/dbraw/zinc/07/49/10/722074910.db2.gz RKCYCUOLHQCSSO-IYBDPMFKSA-N 1 1 421.879 3.036 20 0 HGADMO FC(F)(c1cc(Cl)nc(-c2cccnc2)n1)N1C[C@@H]2C[N@H+](CC3CC3)C[C@H](C1)O2 ZINC001164967473 722074911 /nfs/dbraw/zinc/07/49/11/722074911.db2.gz RKCYCUOLHQCSSO-IYBDPMFKSA-N 1 1 421.879 3.036 20 0 HGADMO COc1cccc(Oc2nc(Cl)ncc2N2C[C@@H]3C[N@H+](CC4CC4)C[C@H](C2)O3)c1 ZINC001164967672 722077672 /nfs/dbraw/zinc/07/76/72/722077672.db2.gz IOYSVQILGGXOOT-HDICACEKSA-N 1 1 416.909 3.230 20 0 HGADMO C[NH+]1CCC(Oc2ccnc(N3CCC4(CC3)Cc3ccccc3CNC4=O)c2)CC1 ZINC001164967419 722078450 /nfs/dbraw/zinc/07/84/50/722078450.db2.gz FMUCIBOJSIJXSB-UHFFFAOYSA-N 1 1 420.557 3.014 20 0 HGADMO FC(F)(c1cccnc1Cl)N1CC[C@@H]2C[N@@H+](Cc3cccnc3)CCO[C@@H]2C1 ZINC001164981252 722100074 /nfs/dbraw/zinc/10/00/74/722100074.db2.gz KSMZERJUJOJRAY-SJLPKXTDSA-N 1 1 408.880 3.402 20 0 HGADMO Clc1nnc(N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)c2ccccc12 ZINC001164984273 722103986 /nfs/dbraw/zinc/10/39/86/722103986.db2.gz RUDFFNDYBAKUKF-YLJYHZDGSA-N 1 1 409.921 3.406 20 0 HGADMO c1ccc(-c2ccc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)nn2)cc1 ZINC001164984309 722105222 /nfs/dbraw/zinc/10/52/22/722105222.db2.gz SHOUNHBZCJQVLP-JTHBVZDNSA-N 1 1 401.514 3.266 20 0 HGADMO Clc1cnc2nc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)ccc2c1 ZINC001164975641 722113072 /nfs/dbraw/zinc/11/30/72/722113072.db2.gz KDMRWLVWCUJOCF-UYAOXDASSA-N 1 1 409.921 3.406 20 0 HGADMO Clc1ccc2ncc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)nc2c1 ZINC001164981082 722113112 /nfs/dbraw/zinc/11/31/12/722113112.db2.gz SKLVFPHLHRQPSB-DYESRHJHSA-N 1 1 409.921 3.406 20 0 HGADMO CSc1nc2ccccc2c(N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)n1 ZINC001164980577 722123715 /nfs/dbraw/zinc/12/37/15/722123715.db2.gz RWFXNBCZRWHGTK-NQIIRXRSSA-N 1 1 421.570 3.474 20 0 HGADMO c1csc(-c2ccc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)nn2)c1 ZINC001164982532 722128075 /nfs/dbraw/zinc/12/80/75/722128075.db2.gz WYVWJZFNFRZKMS-ICSRJNTNSA-N 1 1 407.543 3.327 20 0 HGADMO COc1ccc2ccnc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)c2c1 ZINC001164974128 722134321 /nfs/dbraw/zinc/13/43/21/722134321.db2.gz CJLGOQXLUZOFCS-NZQKXSOJSA-N 1 1 404.514 3.366 20 0 HGADMO c1cncc(C[N@H+]2CCO[C@@H]3CN(c4ccc(-c5ccncc5)cn4)CC[C@@H]3C2)c1 ZINC001164985471 722138446 /nfs/dbraw/zinc/13/84/46/722138446.db2.gz ZPGZUAMJQJUGRO-DHIUTWEWSA-N 1 1 401.514 3.266 20 0 HGADMO COc1cccc2c1ccnc2N1CC[C@@H]2C[N@@H+](Cc3cccnc3)CCO[C@@H]2C1 ZINC001164972813 722146797 /nfs/dbraw/zinc/14/67/97/722146797.db2.gz ARYLSBFNYSQPFK-AUSIDOKSSA-N 1 1 404.514 3.366 20 0 HGADMO Fc1cccc(-c2ccc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)nn2)c1 ZINC001164985003 722146910 /nfs/dbraw/zinc/14/69/10/722146910.db2.gz YTHHGKZPGLHLBO-NFBKMPQASA-N 1 1 419.504 3.405 20 0 HGADMO Cc1cc(N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)nc(-c2ccco2)n1 ZINC001164983866 722147256 /nfs/dbraw/zinc/14/72/56/722147256.db2.gz VWQMEYOWTNZJAR-TZIWHRDSSA-N 1 1 405.502 3.167 20 0 HGADMO Cc1ccc(-c2ccc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)nn2)o1 ZINC001164974400 722148149 /nfs/dbraw/zinc/14/81/49/722148149.db2.gz DRMFDXAFNSDCAI-KNQAVFIVSA-N 1 1 405.502 3.167 20 0 HGADMO c1cc(-c2ccc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)nn2)cs1 ZINC001164976194 722151971 /nfs/dbraw/zinc/15/19/71/722151971.db2.gz UWJGXGLYAVDELH-GHTZIAJQSA-N 1 1 407.543 3.327 20 0 HGADMO COC(=O)c1cc(Cl)nc(N2CCC[C@@]3(CC[N@H+]3Cc3cccc(F)c3)C2)n1 ZINC001164993608 722192522 /nfs/dbraw/zinc/19/25/22/722192522.db2.gz FHQFWGIWKZAHDY-HXUWFJFHSA-N 1 1 404.873 3.301 20 0 HGADMO Fc1cccc(CN2CC[C@@]23CCCN(c2nc(Cl)nc4c2CC[NH2+]C4)C3)c1 ZINC001164993652 722194269 /nfs/dbraw/zinc/19/42/69/722194269.db2.gz GTQYALCZVFSHBM-OAQYLSRUSA-N 1 1 401.917 3.160 20 0 HGADMO COC(=O)c1nc(Cl)cnc1N1CCC[C@@]2(CC[N@H+]2Cc2cccc(F)c2)C1 ZINC001164994052 722200948 /nfs/dbraw/zinc/20/09/48/722200948.db2.gz DYILDHCVBUVVPP-HXUWFJFHSA-N 1 1 404.873 3.301 20 0 HGADMO CCC[N@H+]1CCCC[C@@H]1c1ccc(N2CCCn3cnc(CNC(C)=O)c3C2)nc1 ZINC001164999753 722228420 /nfs/dbraw/zinc/22/84/20/722228420.db2.gz OVMKAFNFNZCARH-OAQYLSRUSA-N 1 1 410.566 3.262 20 0 HGADMO CC(C)CN1c2ccccc2[C@H]2CN(c3ccnc(N4CC[NH+](C)CC4)n3)CC[C@@H]21 ZINC001165005690 722245633 /nfs/dbraw/zinc/24/56/33/722245633.db2.gz VQQMAPZVKSQTAQ-IRLDBZIGSA-N 1 1 406.578 3.067 20 0 HGADMO Cc1cncc(-c2nc(C[NH2+][C@@](C)(CO)Cc3ccc(Br)cc3)no2)c1 ZINC001308117764 1126163557 /nfs/dbraw/zinc/16/35/57/1126163557.db2.gz LYINYBGGKQUSDM-LJQANCHMSA-N 1 1 417.307 3.286 20 0 HGADMO CC(C)(C)OC(=O)NC(C)(C)c1noc(C[NH2+][C@@](C)(CO)Cc2ccc(F)cc2)n1 ZINC001308117869 1126163563 /nfs/dbraw/zinc/16/35/63/1126163563.db2.gz NVRBRDPAQCJQNI-OAQYLSRUSA-N 1 1 422.501 3.052 20 0 HGADMO CCOC(=O)c1cnc(Cl)nc1N1CCC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]21 ZINC001164618347 719053926 /nfs/dbraw/zinc/05/39/26/719053926.db2.gz ARROWSZYROQLHK-SJLPKXTDSA-N 1 1 400.910 3.408 20 0 HGADMO CCOC(=O)c1cnc(SC)nc1N1CCC[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]21 ZINC001164620929 719053935 /nfs/dbraw/zinc/05/39/35/719053935.db2.gz HJFBVDNSOQFLMN-PKOBYXMFSA-N 1 1 412.559 3.476 20 0 HGADMO CCN(CC)C(=O)c1nc2c(s1)CCN(c1ccc(C[N@@H+](C)C3CC3)cn1)CC2 ZINC001164664601 719360042 /nfs/dbraw/zinc/36/00/42/719360042.db2.gz OWQBNIMBPSZJFB-UHFFFAOYSA-N 1 1 413.591 3.220 20 0 HGADMO C[N@H+]1CCO[C@@H]2CN(c3cc(-c4ccc(Cl)nc4)ccc3C3OCCCO3)C[C@@H]21 ZINC001164666474 719422127 /nfs/dbraw/zinc/42/21/27/719422127.db2.gz CVTLCPRRTIXQSD-VQTJNVASSA-N 1 1 415.921 3.357 20 0 HGADMO Fc1ccc(CN2CCOCC23CCN(c2nc(N4CCCC4)cc[nH+]2)CC3)cc1 ZINC001164665691 719491225 /nfs/dbraw/zinc/49/12/25/719491225.db2.gz AZZRKRPAEIBKDU-UHFFFAOYSA-N 1 1 411.525 3.087 20 0 HGADMO CNC(=O)C[N@H+]1CCCC12CCN(C(F)(F)c1ccc3ncnc(Cl)c3c1)CC2 ZINC001164683936 719713572 /nfs/dbraw/zinc/71/35/72/719713572.db2.gz MDQHQLWIHBIHJT-UHFFFAOYSA-N 1 1 423.895 3.009 20 0 HGADMO O=C1C[C@H]2[C@H](CCN2c2nc(Cl)ccc2C[NH+]2CCCC2)N1Cc1cccnc1 ZINC001164691611 719768545 /nfs/dbraw/zinc/76/85/45/719768545.db2.gz PAZSLDBIWSTZSG-OALUTQOASA-N 1 1 411.937 3.106 20 0 HGADMO Cc1nc(C[N@H+]2CCCC23CCN(c2nc(Cl)c(F)cc2C(N)=O)CC3)cs1 ZINC001164692849 719805825 /nfs/dbraw/zinc/80/58/25/719805825.db2.gz PXKQEIQYGOSEHV-UHFFFAOYSA-N 1 1 423.945 3.373 20 0 HGADMO CCOC(=O)c1cnc(C)nc1N1CCC2(CCC[N@H+]2Cc2csc(C)n2)CC1 ZINC001164694455 719806853 /nfs/dbraw/zinc/80/68/53/719806853.db2.gz YDXDMZZLNGISLN-UHFFFAOYSA-N 1 1 415.563 3.362 20 0 HGADMO Cc1nc(C[N@H+]2CCCC23CCN(c2nc(Cl)cc4c2CNC4=O)CC3)cs1 ZINC001164691968 719810605 /nfs/dbraw/zinc/81/06/05/719810605.db2.gz CTFBGJGRFFVMIA-UHFFFAOYSA-N 1 1 417.966 3.378 20 0 HGADMO COC(=O)[C@]1(C)C[C@H]([NH+]2CCOCC2)CCN1c1nc(Cl)cc2ccc(F)cc21 ZINC001164699336 719847168 /nfs/dbraw/zinc/84/71/68/719847168.db2.gz HMPGNGNQYSQDMH-IERDGZPVSA-N 1 1 421.900 3.260 20 0 HGADMO COC(=O)[C@]1(C)C[C@@H]([NH+]2CCOCC2)CCN1c1cc(Cl)nc2sccc21 ZINC001164706735 719849284 /nfs/dbraw/zinc/84/92/84/719849284.db2.gz YJNXXPRBVAYPFQ-DJJJIMSYSA-N 1 1 409.939 3.182 20 0 HGADMO C=C(OCC)c1ccc(N2CCC3(CC2)C[N@@H+](Cc2cccs2)CCO3)nn1 ZINC001164699265 719892695 /nfs/dbraw/zinc/89/26/95/719892695.db2.gz YLGYQEPNRXBMQJ-UHFFFAOYSA-N 1 1 400.548 3.417 20 0 HGADMO COCc1cc(N2CC[C@]3(C2)C[N@H+](CC2CC2)C[C@@H]3COC)nc(-c2ccccc2)n1 ZINC001164810391 720077075 /nfs/dbraw/zinc/07/70/75/720077075.db2.gz LMFCQEQRKIMCOL-PXDATVDWSA-N 1 1 422.573 3.475 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1cncc(OCc3ccccc3)n1)C2 ZINC001164809294 720087677 /nfs/dbraw/zinc/08/76/77/720087677.db2.gz JFSXOPCWBFHBGX-ZJSXRUAMSA-N 1 1 408.546 3.240 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1ccc(C(=O)OC(C)(C)C)cn1)C2 ZINC001164810007 720115303 /nfs/dbraw/zinc/11/53/03/720115303.db2.gz JELHBDCQDSUIQE-WMZHIEFXSA-N 1 1 401.551 3.222 20 0 HGADMO CCN(CC)c1cncc(N2CCC3(C[C@@H](COC)[N@@H+](Cc4ccccn4)C3)CC2)n1 ZINC001164712244 720131019 /nfs/dbraw/zinc/13/10/19/720131019.db2.gz LRNFTGFNVFYQHF-NRFANRHFSA-N 1 1 424.593 3.225 20 0 HGADMO COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1nccnc1OC(C)C)CC2 ZINC001164710831 720150123 /nfs/dbraw/zinc/15/01/23/720150123.db2.gz DKFAOGOAKZXDOR-HXUWFJFHSA-N 1 1 411.550 3.166 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1nc(C(=O)OC)cc3ccccc31)C2 ZINC001164817820 720174253 /nfs/dbraw/zinc/17/42/53/720174253.db2.gz QIMZVQISFWHHCO-CYFREDJKSA-N 1 1 409.530 3.206 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1nc(-c3ccccn3)nc(C)c1C)C2 ZINC001164818681 720183413 /nfs/dbraw/zinc/18/34/13/720183413.db2.gz TZHDHGWBLMUKQO-HYBUGGRVSA-N 1 1 407.562 3.340 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1cc(-c3nc(C(C)C)no3)ccn1)C2 ZINC001164820245 720185366 /nfs/dbraw/zinc/18/53/66/720185366.db2.gz ZVRWIEUFNGPLRZ-CVDCTZTESA-N 1 1 411.550 3.440 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1cncc(OCC3CCCC3)n1)C2 ZINC001164810766 720197039 /nfs/dbraw/zinc/19/70/39/720197039.db2.gz CNKADTDCMYIJLC-REWPJTCUSA-N 1 1 400.567 3.230 20 0 HGADMO CC(C)[N@@H+](C)Cc1cc(=O)n2c(n1)CN(C(F)(F)c1cccc(Cl)n1)CCC2 ZINC001164814606 720210190 /nfs/dbraw/zinc/21/01/90/720210190.db2.gz VFTHOJLWAWBNJM-UHFFFAOYSA-N 1 1 411.884 3.087 20 0 HGADMO CCOC(=O)c1c(Cl)cc(C)nc1N1CC[C@H]2[C@H]1CC[N@H+]2Cc1cccnc1 ZINC001164723003 720335667 /nfs/dbraw/zinc/33/56/67/720335667.db2.gz GQIVMBLBTQYXEY-ZWKOTPCHSA-N 1 1 400.910 3.468 20 0 HGADMO C[NH+]1CCC(CN2C(=O)CC[C@H]3[C@@H]2CCN3C(C)(C)c2ccnc(Cl)c2)CC1 ZINC001164830862 720355182 /nfs/dbraw/zinc/35/51/82/720355182.db2.gz XNTGKCDVZGEKDM-OALUTQOASA-N 1 1 404.986 3.377 20 0 HGADMO COC(=O)c1cc(C(F)(F)N2CC[C@@H]3[C@H]2CC[N@@H+]3Cc2cccnc2)cnc1Cl ZINC001164726553 720364180 /nfs/dbraw/zinc/36/41/80/720364180.db2.gz PMPNYCKDZONQNY-IAGOWNOFSA-N 1 1 422.863 3.315 20 0 HGADMO COC(=O)c1cc(C(F)(F)N2CC[C@@H]3[C@H]2CC[N@H+]3Cc2cccnc2)cnc1Cl ZINC001164726553 720364186 /nfs/dbraw/zinc/36/41/86/720364186.db2.gz PMPNYCKDZONQNY-IAGOWNOFSA-N 1 1 422.863 3.315 20 0 HGADMO COC(=O)c1cc(C(F)(F)N2CC[C@H]3[C@H]2CC[N@@H+]3Cc2cccnc2)cnc1Cl ZINC001164726552 720365139 /nfs/dbraw/zinc/36/51/39/720365139.db2.gz PMPNYCKDZONQNY-DLBZAZTESA-N 1 1 422.863 3.315 20 0 HGADMO COC(=O)c1cc(C(F)(F)N2CC[C@H]3[C@H]2CC[N@H+]3Cc2cccnc2)cnc1Cl ZINC001164726552 720365147 /nfs/dbraw/zinc/36/51/47/720365147.db2.gz PMPNYCKDZONQNY-DLBZAZTESA-N 1 1 422.863 3.315 20 0 HGADMO C[C@@H]1CCCN(C(=O)c2ccc(N3CC[C@@H]4[C@@H]3CC[N@H+]4Cc3cccnc3)nc2)C1 ZINC001164731481 720436518 /nfs/dbraw/zinc/43/65/18/720436518.db2.gz KWNMNGMOPYWHMW-QIJUGHKUSA-N 1 1 405.546 3.202 20 0 HGADMO COC(=O)c1cnc(N2CC[C@@H]3[C@H](C[C@@H](Cn4cccn4)[N@H+]3C(C)C)C2)c(Cl)c1 ZINC001164834742 720506399 /nfs/dbraw/zinc/50/63/99/720506399.db2.gz HKRRJDSDCFYEBB-ZIFCJYIRSA-N 1 1 417.941 3.096 20 0 HGADMO CC(C)[N@@H+]1[C@@H]2CCN(c3ccc(N4CCCCC4)nn3)C[C@@H]2C[C@H]1Cn1cccn1 ZINC001164837845 720506988 /nfs/dbraw/zinc/50/69/88/720506988.db2.gz PVIKICNYKMPELW-PCCBWWKXSA-N 1 1 409.582 3.041 20 0 HGADMO COC(=O)c1cc(N2CC[C@@H]3[C@@H](C[C@H](Cn4cccn4)[N@H+]3C(C)C)C2)ncc1Cl ZINC001164839032 720513428 /nfs/dbraw/zinc/51/34/28/720513428.db2.gz RZWUJGGVJDFNQB-FRQCXROJSA-N 1 1 417.941 3.096 20 0 HGADMO CC(C)[N@@H+]1[C@@H]2CCN(c3ncnc4nc(Cl)ccc43)C[C@H]2C[C@H]1Cn1cccn1 ZINC001164834621 720518355 /nfs/dbraw/zinc/51/83/55/720518355.db2.gz GSRLUYKAYDQKHV-SOLBZPMBSA-N 1 1 411.941 3.253 20 0 HGADMO CC(C)[N@@H+]1[C@@H]2CCN(C(F)(F)c3cnc(Cl)nc3)C[C@@H]2C[C@H]1Cn1cccn1 ZINC001164834855 720518839 /nfs/dbraw/zinc/51/88/39/720518839.db2.gz HMNPGUOJXGOSTD-BHYGNILZSA-N 1 1 410.900 3.249 20 0 HGADMO COC(=O)c1cc(Cl)cc(N2CC[C@@H]3[C@H](C[C@@H](Cn4cccn4)[N@H+]3C(C)C)C2)n1 ZINC001164834015 720520072 /nfs/dbraw/zinc/52/00/72/720520072.db2.gz FDYGIGISHSOWSQ-HHXXYDBFSA-N 1 1 417.941 3.096 20 0 HGADMO COc1ccc2cnc(N3CC[C@@H]4[C@@H](C[C@@H](Cn5cccn5)[N@H+]4C(C)C)C3)nc2c1 ZINC001164839430 720526007 /nfs/dbraw/zinc/52/60/07/720526007.db2.gz UGRJUSKBFMNTQS-CNNODRBYSA-N 1 1 406.534 3.213 20 0 HGADMO CC(C)[N@@H+]1[C@@H]2CCN(c3nc(Cl)nc4c3ccn4C)C[C@@H]2C[C@H]1Cn1cccn1 ZINC001164841140 720527747 /nfs/dbraw/zinc/52/77/47/720527747.db2.gz XORXQDDDOSMBTE-XYJFISCASA-N 1 1 413.957 3.196 20 0 HGADMO CC(C)[N@@H+]1[C@@H]2CCN(C(F)(F)c3cnnc(Cl)c3)C[C@@H]2C[C@H]1Cn1cccn1 ZINC001164841382 720544651 /nfs/dbraw/zinc/54/46/51/720544651.db2.gz URYVWIXXKKLUHC-BHYGNILZSA-N 1 1 410.900 3.249 20 0 HGADMO CC(C)[N@@H+]1[C@@H]2CCN(c3ccc(C(=O)NC(C)(C)C)cn3)C[C@@H]2C[C@H]1Cn1cccn1 ZINC001164837345 720546746 /nfs/dbraw/zinc/54/67/46/720546746.db2.gz LTYCYQDXIJXVDH-PCCBWWKXSA-N 1 1 424.593 3.184 20 0 HGADMO CC(C)[N@@H+]1[C@@H]2CCN(c3cncc(N4CCCCC4)n3)C[C@H]2C[C@H]1Cn1cccn1 ZINC001164839287 720575323 /nfs/dbraw/zinc/57/53/23/720575323.db2.gz PTSHBNKTPAFZRV-QHAWAJNXSA-N 1 1 409.582 3.041 20 0 HGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@H]2CN(C(F)(F)c3cncc(Cl)n3)CC[C@@H]21 ZINC001164842231 720579089 /nfs/dbraw/zinc/57/90/89/720579089.db2.gz UUZXTVAPUVNWGE-JYJNAYRXSA-N 1 1 410.900 3.249 20 0 HGADMO CSc1cnc(Cl)c(N2CC[C@@H]3[C@H](C[C@@H](Cn4cccn4)[N@H+]3C(C)C)C2)n1 ZINC001164842221 720590548 /nfs/dbraw/zinc/59/05/48/720590548.db2.gz UQLISTGOSGLSKW-OWCLPIDISA-N 1 1 406.987 3.426 20 0 HGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@H]2CN(c3ccnc(N4CCCCC4)n3)CC[C@@H]21 ZINC001164844152 720597839 /nfs/dbraw/zinc/59/78/39/720597839.db2.gz ZHHFYLNMTOMTQA-ACRUOGEOSA-N 1 1 409.582 3.041 20 0 HGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@H]2CN(c3cc(N4CCCCC4)ncn3)CC[C@@H]21 ZINC001164842806 720601233 /nfs/dbraw/zinc/60/12/33/720601233.db2.gz VQIQWWVXDKKQRN-ACRUOGEOSA-N 1 1 409.582 3.041 20 0 HGADMO Clc1ccc2nc(Cl)nc(N3CC[N@H+]4C[C@@H](Oc5cncnc5)C[C@@H]4C3)c2c1 ZINC001164745074 720605876 /nfs/dbraw/zinc/60/58/76/720605876.db2.gz UHGKALSVHGOEKF-KGLIPLIRSA-N 1 1 417.300 3.069 20 0 HGADMO FC(F)(c1cc(Cl)ncc1Cl)N1CC[N@@H+]2C[C@@H](Oc3cncnc3)C[C@H]2C1 ZINC001164739621 720620534 /nfs/dbraw/zinc/62/05/34/720620534.db2.gz GGIAFQVIIFRALE-RYUDHWBXSA-N 1 1 416.259 3.065 20 0 HGADMO FC(F)(c1cc(Cl)ncc1Cl)N1CC[N@H+]2C[C@@H](Oc3cncnc3)C[C@H]2C1 ZINC001164739621 720620542 /nfs/dbraw/zinc/62/05/42/720620542.db2.gz GGIAFQVIIFRALE-RYUDHWBXSA-N 1 1 416.259 3.065 20 0 HGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@H]2CN(c3ccc(-c4ccncc4)nn3)CC[C@@H]21 ZINC001164835908 720623932 /nfs/dbraw/zinc/62/39/32/720623932.db2.gz CQQWTSJKKVGWQT-ONTIZHBOSA-N 1 1 403.534 3.113 20 0 HGADMO C[N@@H+](Cc1ccccc1)[C@H]1COC2(C1)CCN(c1ncnc3cnc(F)cc31)CC2 ZINC001164843749 720676249 /nfs/dbraw/zinc/67/62/49/720676249.db2.gz QPFDIBBUOGMLAK-GOSISDBHSA-N 1 1 407.493 3.424 20 0 HGADMO CCOC(=O)c1cnc(C)nc1N1CCC2(C[C@@H]([N@@H+](C)Cc3ccccc3)CO2)CC1 ZINC001164842694 720678743 /nfs/dbraw/zinc/67/87/43/720678743.db2.gz MRZWLXPIRBKLRP-HXUWFJFHSA-N 1 1 424.545 3.222 20 0 HGADMO COC(=O)Cc1cccc(N2CCC3(C[C@@H]([N@@H+](C)Cc4ccccc4)CO3)CC2)n1 ZINC001164839697 720688186 /nfs/dbraw/zinc/68/81/86/720688186.db2.gz BIHUFMVWZLSVQP-OAQYLSRUSA-N 1 1 409.530 3.057 20 0 HGADMO COc1cnc(N2CC[N@H+]3C[C@@H](Oc4cncnc4)C[C@H]3C2)c2cc(Cl)ccc12 ZINC001164740107 720698149 /nfs/dbraw/zinc/69/81/49/720698149.db2.gz QARIHEZOSRGOIR-HOTGVXAUSA-N 1 1 411.893 3.029 20 0 HGADMO C[N@@H+](Cc1ccccc1)[C@H]1COC2(C1)CCN(c1cc(-c3nnco3)ccn1)CC2 ZINC001164840348 720719011 /nfs/dbraw/zinc/71/90/11/720719011.db2.gz PRASDNSXBXYCDJ-HXUWFJFHSA-N 1 1 405.502 3.392 20 0 HGADMO COc1ccc2c(cc(Cl)nc2N2CC[N@H+]3C[C@H](Oc4cncnc4)C[C@H]3C2)c1 ZINC001164744841 720729879 /nfs/dbraw/zinc/72/98/79/720729879.db2.gz SVWAWJILTFLRJF-DOTOQJQBSA-N 1 1 411.893 3.029 20 0 HGADMO C[N@@H+](Cc1ccc(N2CC[C@@H]3O[C@@H](COCc4ccccn4)CC[C@@H]32)nc1)C1CC1 ZINC001164845173 720778148 /nfs/dbraw/zinc/77/81/48/720778148.db2.gz FIZPNCGBGJYNCC-VJBWXMMDSA-N 1 1 408.546 3.414 20 0 HGADMO Clc1cc(Cl)nc(N2CC[C@@H]3[C@@H](C[C@H](Cn4cncn4)[N@H+]3CC3CC3)C2)c1 ZINC001164748931 720810686 /nfs/dbraw/zinc/81/06/86/720810686.db2.gz RXKMCVBQGOYUTL-USXIJHARSA-N 1 1 407.349 3.359 20 0 HGADMO Fc1ccc2ccnc(N3CC[C@@H]4[C@@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)c2c1 ZINC001164737366 720830895 /nfs/dbraw/zinc/83/08/95/720830895.db2.gz AKGXXJMTXDBSJY-CZTZKLFOSA-N 1 1 406.509 3.345 20 0 HGADMO CCOc1ccc(Cl)nc1N1CC[C@@H]2[C@H](C[C@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164745788 720833746 /nfs/dbraw/zinc/83/37/46/720833746.db2.gz NKLZGJAAECJGIM-KZNAEPCWSA-N 1 1 416.957 3.105 20 0 HGADMO Cc1cc(Cl)c(C)c(N2CC[C@@H]3[C@@H](C[C@H](Cn4cncn4)[N@H+]3CC3CC3)C2)n1 ZINC001164739371 720833759 /nfs/dbraw/zinc/83/37/59/720833759.db2.gz ACXVYWJEGRGXKU-NLWGTHIKSA-N 1 1 400.958 3.323 20 0 HGADMO CSc1cc(Cl)cnc1N1CC[C@@H]2[C@H](C[C@@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164748362 720843799 /nfs/dbraw/zinc/84/37/99/720843799.db2.gz UKUVJPDYXMRNDE-BPQIPLTHSA-N 1 1 418.998 3.428 20 0 HGADMO c1ncn(C[C@@H]2C[C@H]3CN(c4cnc(-c5ccccc5)cn4)CC[C@H]3[N@H+]2CC2CC2)n1 ZINC001164750372 720847313 /nfs/dbraw/zinc/84/73/13/720847313.db2.gz XJHXYWZBPPIXIZ-QNWVGRARSA-N 1 1 415.545 3.115 20 0 HGADMO Cc1cc(C)nc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COCc2cccnc2)n1 ZINC001164748451 720869667 /nfs/dbraw/zinc/86/96/67/720869667.db2.gz DXOJWWPVYVEGNW-UPVQGACJSA-N 1 1 407.562 3.244 20 0 HGADMO Cc1cnc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COCc2cccnc2)c(C)n1 ZINC001164754338 720871768 /nfs/dbraw/zinc/87/17/68/720871768.db2.gz RHJXZHVSEXJUQY-LADGPHEKSA-N 1 1 407.562 3.244 20 0 HGADMO COc1ccnc(N2CC[C@]3(C2)C[N@H+](CC2CC2)C[C@@H]3COCc2cccnc2)c1 ZINC001164749061 720871890 /nfs/dbraw/zinc/87/18/90/720871890.db2.gz GPFQZWNBRLGFGJ-ZJSXRUAMSA-N 1 1 408.546 3.240 20 0 HGADMO COc1ccnc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COCc2cccnc2)c1 ZINC001164749061 720871894 /nfs/dbraw/zinc/87/18/94/720871894.db2.gz GPFQZWNBRLGFGJ-ZJSXRUAMSA-N 1 1 408.546 3.240 20 0 HGADMO COc1ccnc(N2CC[C@]3(C2)C[N@H+](CC2CC2)C[C@H]3COCc2cccnc2)c1 ZINC001164749059 720871915 /nfs/dbraw/zinc/87/19/15/720871915.db2.gz GPFQZWNBRLGFGJ-XUZZJYLKSA-N 1 1 408.546 3.240 20 0 HGADMO COc1ccnc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COCc2cccnc2)c1 ZINC001164749059 720871920 /nfs/dbraw/zinc/87/19/20/720871920.db2.gz GPFQZWNBRLGFGJ-XUZZJYLKSA-N 1 1 408.546 3.240 20 0 HGADMO CCOc1ccc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COCc2cccnc2)nn1 ZINC001164750515 720873208 /nfs/dbraw/zinc/87/32/08/720873208.db2.gz JFRNTRAUSXXHJM-URXFXBBRSA-N 1 1 423.561 3.025 20 0 HGADMO CCOc1ccnc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COCc2cccnc2)n1 ZINC001164756815 720884347 /nfs/dbraw/zinc/88/43/47/720884347.db2.gz RDHHMVALLICLTI-QPPBQGQZSA-N 1 1 423.561 3.025 20 0 HGADMO COCC[N@H+]1CCO[C@@H]2CN(C(F)(F)C3(c4ccc(Cl)nc4)CC3)CC[C@H]2C1 ZINC001164853890 720890741 /nfs/dbraw/zinc/89/07/41/720890741.db2.gz DORVCCKVFIABPX-DOTOQJQBSA-N 1 1 415.912 3.029 20 0 HGADMO COCc1ccc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COCc2cccnc2)nc1 ZINC001164751331 720914622 /nfs/dbraw/zinc/91/46/22/720914622.db2.gz LJVLADKKHRJONE-ILBGXUMGSA-N 1 1 422.573 3.378 20 0 HGADMO COC(=O)c1ccc2nc(N3CCn4c(C[N@@H+](C)C(C)C)cnc4[C@@H]3C)ncc2c1 ZINC001164853952 720933761 /nfs/dbraw/zinc/93/37/61/720933761.db2.gz CNMROEMXVWAGSL-HNNXBMFYSA-N 1 1 408.506 3.034 20 0 HGADMO CC(C)N(C)Cc1cnc2n1CCN(c1nc(Cl)cc(C3CC[NH2+]CC3)n1)[C@H]2C ZINC001164857954 720944876 /nfs/dbraw/zinc/94/48/76/720944876.db2.gz ILMXXDOLQOJCIB-HNNXBMFYSA-N 1 1 417.989 3.215 20 0 HGADMO CCOC(=O)c1cc2ccnc(N3CCn4c(C[N@@H+](C)C(C)C)cnc4[C@@H]3C)c2[nH]1 ZINC001164861832 720950702 /nfs/dbraw/zinc/95/07/02/720950702.db2.gz UKIIEZURLCPQAQ-HNNXBMFYSA-N 1 1 410.522 3.358 20 0 HGADMO CC(C)N(C)Cc1cnc2n1CCN(c1cccc(OCC[NH+]3CCCC3)n1)[C@H]2C ZINC001164860366 720991440 /nfs/dbraw/zinc/99/14/40/720991440.db2.gz NCRMJUFXVZKZGK-IBGZPJMESA-N 1 1 412.582 3.174 20 0 HGADMO CC(C)[N@@H+](C)Cc1cnc2n1CCN(C(F)(F)COc1ccc(Cl)nn1)[C@@H]2C ZINC001164861952 721001803 /nfs/dbraw/zinc/00/18/03/721001803.db2.gz RQZLQMYQUILNDK-CYBMUJFWSA-N 1 1 414.888 3.215 20 0 HGADMO CC(C)[N@@H+](C)Cc1cnc2n1CCN(c1ncc(C(=O)N(C)C)cc1Cl)[C@@H]2C ZINC001164858024 721005336 /nfs/dbraw/zinc/00/53/36/721005336.db2.gz GHYLTHDZHYALPF-CQSZACIVSA-N 1 1 404.946 3.055 20 0 HGADMO FC(F)(N1CCc2[nH+]cc(Cn3cccn3)n2CC1)C1(c2ccnc(Cl)c2)CC1 ZINC001164861964 721033908 /nfs/dbraw/zinc/03/39/08/721033908.db2.gz IXYJKZZNPSYSJJ-UHFFFAOYSA-N 1 1 418.879 3.359 20 0 HGADMO Fc1ccc(-c2ccnc(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@@H]4C3)n2)cc1 ZINC001164864385 721082157 /nfs/dbraw/zinc/08/21/57/721082157.db2.gz FRKQEFAOIWQTQP-RTWAWAEBSA-N 1 1 405.477 3.157 20 0 HGADMO Cc1sc2nc(C)nc(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@H]4C3)c2c1C ZINC001164865415 721084494 /nfs/dbraw/zinc/08/44/94/721084494.db2.gz LEWUPMXRFNNXDP-OALUTQOASA-N 1 1 409.559 3.491 20 0 HGADMO COc1ccc2nc(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@@H]4C3)cc(C)c2c1 ZINC001164867654 721088709 /nfs/dbraw/zinc/08/87/09/721088709.db2.gz ZGMBZBGDLXGTNT-CTNGQTDRSA-N 1 1 404.514 3.427 20 0 HGADMO Cc1nc(C(F)(F)N2CC[N@H+]3C[C@@H](OCc4cccnc4)C[C@H]3C2)nc(Cl)c1C ZINC001164867336 721108105 /nfs/dbraw/zinc/10/81/05/721108105.db2.gz XYCZGALYDKDCSP-IRXDYDNUSA-N 1 1 423.895 3.166 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4cc(Cl)nc(Cc5ccccc5)n4)C[C@@H]3C2)cn1 ZINC001164763352 721112506 /nfs/dbraw/zinc/11/25/06/721112506.db2.gz FGOTXAKTBRUPAS-UXHICEINSA-N 1 1 422.964 3.413 20 0 HGADMO COc1cccc(-c2ccnc(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@@H]4C3)n2)c1 ZINC001164867346 721114058 /nfs/dbraw/zinc/11/40/58/721114058.db2.gz YDWJBMQVUDFGES-IFMALSPDSA-N 1 1 417.513 3.027 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4nc(Cl)nc5c(F)cccc54)C[C@@H]3C2)cn1 ZINC001164762523 721118386 /nfs/dbraw/zinc/11/83/86/721118386.db2.gz CSUKKANXOVDZFD-CABCVRRESA-N 1 1 400.889 3.114 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4nc(Cl)nc5c(F)cccc54)C[C@H]3C2)cn1 ZINC001164762533 721119114 /nfs/dbraw/zinc/11/91/14/721119114.db2.gz CSUKKANXOVDZFD-HUUCEWRRSA-N 1 1 400.889 3.114 20 0 HGADMO c1ccc2c(c1)CCc1cnc(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@@H]4C3)nc1-2 ZINC001164879498 721125363 /nfs/dbraw/zinc/12/53/63/721125363.db2.gz SVBKQWLEVXOFGW-YADHBBJMSA-N 1 1 413.525 3.117 20 0 HGADMO Fc1cccc(Oc2ccnc(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@@H]4C3)n2)c1 ZINC001164880705 721125968 /nfs/dbraw/zinc/12/59/68/721125968.db2.gz XDODDAXTJKZJNT-TZIWHRDSSA-N 1 1 421.476 3.283 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(C(F)(F)c4c[nH]c5nc(Cl)ccc45)C[C@@H]3C2)cn1 ZINC001164771374 721135236 /nfs/dbraw/zinc/13/52/36/721135236.db2.gz SKZCVBFYUDRPFM-CABCVRRESA-N 1 1 420.895 3.453 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4cc(C(=O)Nc5ccccc5)ccn4)C[C@@H]3C2)cn1 ZINC001164773687 721138488 /nfs/dbraw/zinc/13/84/88/721138488.db2.gz YQDJBKALVQWTLY-SFTDATJTSA-N 1 1 416.529 3.026 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4cc(C(=O)Nc5ccccc5)ccn4)C[C@@H]3C2)cn1 ZINC001164773683 721138810 /nfs/dbraw/zinc/13/88/10/721138810.db2.gz YQDJBKALVQWTLY-RTWAWAEBSA-N 1 1 416.529 3.026 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4nc(Cl)ccc4CN4CCCC4)C[C@@H]3C2)cn1 ZINC001164774141 721148576 /nfs/dbraw/zinc/14/85/76/721148576.db2.gz ZVHCAJQUQYXCQS-ICSRJNTNSA-N 1 1 414.985 3.023 20 0 HGADMO Cc1cc(N2CC[N@H+]3C[C@@H](OCc4cccnc4)C[C@H]3C2)nc(-c2cccs2)n1 ZINC001164872229 721160818 /nfs/dbraw/zinc/16/08/18/721160818.db2.gz HAFILQZRSQZXDM-OALUTQOASA-N 1 1 407.543 3.388 20 0 HGADMO Cc1cc(N2CC[N@H+]3C[C@H](OCc4cccnc4)C[C@H]3C2)nc(-c2cccs2)n1 ZINC001164872230 721160936 /nfs/dbraw/zinc/16/09/36/721160936.db2.gz HAFILQZRSQZXDM-RBUKOAKNSA-N 1 1 407.543 3.388 20 0 HGADMO Cc1cc(N2CC[N@H+]3C[C@H](OCc4cccnc4)C[C@@H]3C2)nc(-c2cccs2)n1 ZINC001164872231 721161348 /nfs/dbraw/zinc/16/13/48/721161348.db2.gz HAFILQZRSQZXDM-RTBURBONSA-N 1 1 407.543 3.388 20 0 HGADMO Fc1cccc(-c2ccc(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@@H]4C3)nn2)c1 ZINC001164880688 721163245 /nfs/dbraw/zinc/16/32/45/721163245.db2.gz XCPPNVZLFFQOBP-RTWAWAEBSA-N 1 1 405.477 3.157 20 0 HGADMO Cc1nc(-c2ccncc2)nc(N2CC[N@H+]3C[C@H](OCc4cccnc4)C[C@@H]3C2)c1C ZINC001164872531 721165064 /nfs/dbraw/zinc/16/50/64/721165064.db2.gz HJYLABLMZMHGHP-FGZHOGPDSA-N 1 1 416.529 3.030 20 0 HGADMO FC(F)(Oc1ccnc(Cl)c1)N1CC[N@H+]2C[C@@H](OCc3cccnc3)C[C@H]2C1 ZINC001164879587 721182457 /nfs/dbraw/zinc/18/24/57/721182457.db2.gz UDIGHNNDKNNTOB-RDJZCZTQSA-N 1 1 410.852 3.034 20 0 HGADMO Cc1cc(-c2cccc(F)c2)nnc1N1CC[N@H+]2C[C@H](OCc3cccnc3)C[C@@H]2C1 ZINC001164871658 721183064 /nfs/dbraw/zinc/18/30/64/721183064.db2.gz GDYUQSYLMTYNPP-FGZHOGPDSA-N 1 1 419.504 3.466 20 0 HGADMO Fc1cnc(N2CC[N@H+]3C[C@H](OCc4cccnc4)C[C@H]3C2)nc1-c1ccsc1 ZINC001164870289 721184865 /nfs/dbraw/zinc/18/48/65/721184865.db2.gz CJBNUGFBCGWHPA-ZWKOTPCHSA-N 1 1 411.506 3.219 20 0 HGADMO CCN1C(=O)[C@]2(CC[C@@H]3CN(c4ccc([C@@H]5CCCC[N@H+]5CC)cn4)C[C@@H]32)N=C1C ZINC001164876236 721234094 /nfs/dbraw/zinc/23/40/94/721234094.db2.gz YWUFKWXJEXYYMQ-MDAIXWLXSA-N 1 1 409.578 3.494 20 0 HGADMO Cc1c(Cl)nc(C2CCC2)nc1N1C[C@@H]2CC[N@H+](Cc3cnn(C)c3)C[C@H]2C1 ZINC001164767143 721238204 /nfs/dbraw/zinc/23/82/04/721238204.db2.gz VXDQUJOXNAIMLH-ROUUACIJSA-N 1 1 400.958 3.398 20 0 HGADMO CC(C)(c1ccnc(Cl)c1)[N@H+]1C[C@@H]2COC[C@H](C(=O)NCc3ccco3)[C@@H]2C1 ZINC001164760185 721258745 /nfs/dbraw/zinc/25/87/45/721258745.db2.gz CWRQMPUWSFSMJF-OLMNPRSZSA-N 1 1 403.910 3.074 20 0 HGADMO CCOC(=O)c1cnc2ccc(Cl)nc2c1N1CC2(C1)CC[N@@H+](CC1CC1)C2 ZINC001164774281 721286977 /nfs/dbraw/zinc/28/69/77/721286977.db2.gz YPUHZARNKUPOGE-UHFFFAOYSA-N 1 1 400.910 3.382 20 0 HGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@]2(CCCN(c3nccc4scnc43)C2)C1 ZINC001164779740 721352384 /nfs/dbraw/zinc/35/23/84/721352384.db2.gz VGKQSEROSQSACT-OAQYLSRUSA-N 1 1 413.547 3.415 20 0 HGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@@]2(CCCN(c3nccc4cnccc43)C2)C1 ZINC001164787011 721357447 /nfs/dbraw/zinc/35/74/47/721357447.db2.gz WZGVLYDGFYNRMT-QHCPKHFHSA-N 1 1 407.518 3.354 20 0 HGADMO CCCc1cc(N2CCC[C@]3(C2)COCC[N@@H+](Cc2c(C)noc2C)C3)nc(C)n1 ZINC001164785314 721358599 /nfs/dbraw/zinc/35/85/99/721358599.db2.gz UJYNPZRHKHGHRH-QHCPKHFHSA-N 1 1 413.566 3.461 20 0 HGADMO COc1cc(C)cnc1N1CCC[C@@]2(C1)COCC[N@H+](Cc1c(C)noc1C)C2 ZINC001164783019 721361486 /nfs/dbraw/zinc/36/14/86/721361486.db2.gz OWEVCTZFYSFBSE-JOCHJYFZSA-N 1 1 400.523 3.122 20 0 HGADMO COc1cc(C)cnc1N1CCC[C@@]2(C1)COCC[N@@H+](Cc1c(C)noc1C)C2 ZINC001164783019 721361491 /nfs/dbraw/zinc/36/14/91/721361491.db2.gz OWEVCTZFYSFBSE-JOCHJYFZSA-N 1 1 400.523 3.122 20 0 HGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@]2(CCCN(c3cnc(Cl)cc3N)C2)C1 ZINC001164781643 721362868 /nfs/dbraw/zinc/36/28/68/721362868.db2.gz KHUWCFMVUBYQKL-HXUWFJFHSA-N 1 1 405.930 3.041 20 0 HGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@]2(CCCN(c3cc(CC(C)C)ncn3)C2)C1 ZINC001164781366 721368850 /nfs/dbraw/zinc/36/88/50/721368850.db2.gz IUQIYOKFVLWGPX-HSZRJFAPSA-N 1 1 413.566 3.399 20 0 HGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@]2(CCCN(c3cc(CC(C)C)ncn3)C2)C1 ZINC001164781366 721368852 /nfs/dbraw/zinc/36/88/52/721368852.db2.gz IUQIYOKFVLWGPX-HSZRJFAPSA-N 1 1 413.566 3.399 20 0 HGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@]2(CCCN(c3cc(C)nc(C4CC4)n3)C2)C1 ZINC001164786049 721369536 /nfs/dbraw/zinc/36/95/36/721369536.db2.gz VDGHMOTZVOCOBM-HSZRJFAPSA-N 1 1 411.550 3.386 20 0 HGADMO C[NH+]1CCN(C[C@@H]2CCC[C@]3(CCN(C(F)(F)c4cccnc4Cl)C3)O2)CC1 ZINC001164892142 721381505 /nfs/dbraw/zinc/38/15/05/721381505.db2.gz RVSDXRGNBHZTAN-QFBILLFUSA-N 1 1 414.928 3.045 20 0 HGADMO CC(C)(c1ccnc(Cl)c1)[N@H+]1C[C@@H](NC(=O)c2cccnc2)[C@H]2OCCC[C@H]2C1 ZINC001164786946 721382221 /nfs/dbraw/zinc/38/22/21/721382221.db2.gz VMGMUBLKLPXSCI-HQRMLTQVSA-N 1 1 414.937 3.275 20 0 HGADMO CC(C)(c1ccnc(Cl)c1)[N@@H+]1C[C@@H](NC(=O)c2cccnc2)[C@H]2OCCC[C@H]2C1 ZINC001164786946 721382223 /nfs/dbraw/zinc/38/22/23/721382223.db2.gz VMGMUBLKLPXSCI-HQRMLTQVSA-N 1 1 414.937 3.275 20 0 HGADMO O=C(NCc1ccccc1)c1cccnc1N1C[C@H]2C[NH+](Cc3nccs3)C[C@@H]2C1 ZINC001164783427 721394227 /nfs/dbraw/zinc/39/42/27/721394227.db2.gz HZWCTFPOHGWABN-RTBURBONSA-N 1 1 419.554 3.036 20 0 HGADMO C[NH+]1CCN(C[C@@H]2CCC[C@]3(CCN(c4nnc(Cl)c5ccsc54)C3)O2)CC1 ZINC001164889321 721395263 /nfs/dbraw/zinc/39/52/63/721395263.db2.gz LSAJFJMVHNTTBB-MGPUTAFESA-N 1 1 421.998 3.110 20 0 HGADMO C[NH+]1CCN(C[C@@H]2CCC[C@]3(CCN(c4csc5ncnc(Cl)c45)C3)O2)CC1 ZINC001164892419 721402050 /nfs/dbraw/zinc/40/20/50/721402050.db2.gz YCEWSKSKECCIFH-MGPUTAFESA-N 1 1 421.998 3.110 20 0 HGADMO C[NH+]1CCN(C[C@H]2CCC[C@]3(CCN(c4csc5ncnc(Cl)c45)C3)O2)CC1 ZINC001164892416 721402245 /nfs/dbraw/zinc/40/22/45/721402245.db2.gz YCEWSKSKECCIFH-FOIQADDNSA-N 1 1 421.998 3.110 20 0 HGADMO C[NH+]1CCN(C[C@@H]2CCC[C@@]3(CCN(c4cc5nccc(Cl)c5cn4)C3)O2)CC1 ZINC001164884726 721408131 /nfs/dbraw/zinc/40/81/31/721408131.db2.gz FKPSHCKCDXSNSF-JTSKRJEESA-N 1 1 415.969 3.049 20 0 HGADMO CCc1c(Cl)nnc(N2CC[C@]3(C2)CCC[C@@H](CN2CC[NH+](C)CC2)O3)c1CC ZINC001164884078 721413747 /nfs/dbraw/zinc/41/37/47/721413747.db2.gz DAGHYZMTRIIDNT-JTSKRJEESA-N 1 1 422.017 3.020 20 0 HGADMO C[NH+]1CCN(C[C@H]2CCC[C@@]3(CCN(c4cccc(OC(C)(C)C)n4)C3)O2)CC1 ZINC001164891459 721418716 /nfs/dbraw/zinc/41/87/16/721418716.db2.gz WHUJHLYROGXRRE-XXBNENTESA-N 1 1 402.583 3.024 20 0 HGADMO CC(C)(C)c1noc(-c2ccnc(N3C[C@@H]4C[NH+](Cc5nccs5)C[C@H]4C3)c2)n1 ZINC001164785583 721422399 /nfs/dbraw/zinc/42/23/99/721422399.db2.gz NKVXEZYOQSAWOB-HOTGVXAUSA-N 1 1 410.547 3.454 20 0 HGADMO Clc1nc2c(Cl)nccc2c(N2C[C@@H]3C[NH+](Cc4nccs4)C[C@H]3C2)n1 ZINC001164781914 721424340 /nfs/dbraw/zinc/42/43/40/721424340.db2.gz DUUMSAPODOHYPG-QWRGUYRKSA-N 1 1 407.330 3.356 20 0 HGADMO c1csc(C[NH+]2C[C@H]3CN(c4nc(-c5cccnc5)nc5c4CCC5)C[C@@H]3C2)n1 ZINC001164785707 721432651 /nfs/dbraw/zinc/43/26/51/721432651.db2.gz OBMQAFOTJXRRFD-IRXDYDNUSA-N 1 1 404.543 3.052 20 0 HGADMO Cn1cnc2c1[C@H](COCc1cccnc1)N(c1ccc(C[N@@H+](C)C3CC3)cn1)CC2 ZINC001164780952 721441694 /nfs/dbraw/zinc/44/16/94/721441694.db2.gz DDDCENLQHSAECU-QFIPXVFZSA-N 1 1 418.545 3.125 20 0 HGADMO C[NH+]1CCN(C[C@H]2CCC[C@@]3(CCN(c4nccnc4Oc4ccccc4)C3)O2)CC1 ZINC001164889560 721443563 /nfs/dbraw/zinc/44/35/63/721443563.db2.gz BSJVUGLZTYRBFK-QPPBQGQZSA-N 1 1 423.561 3.034 20 0 HGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1ncnc3[nH]cc(C)c31)CC2 ZINC001164784493 721448493 /nfs/dbraw/zinc/44/84/93/721448493.db2.gz FSSMJQJGIAWKJR-IBGZPJMESA-N 1 1 413.566 3.000 20 0 HGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1ncc(Cl)nc1C)CC2 ZINC001164790217 721460766 /nfs/dbraw/zinc/46/07/66/721460766.db2.gz ZTCCPQXHOXBHSG-SFHVURJKSA-N 1 1 408.974 3.172 20 0 HGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1ncc(Cl)nc1C)CC2 ZINC001164790211 721460987 /nfs/dbraw/zinc/46/09/87/721460987.db2.gz ZTCCPQXHOXBHSG-GOSISDBHSA-N 1 1 408.974 3.172 20 0 HGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1nc(C)c(Cl)c(C)n1)CC2 ZINC001164785769 721461982 /nfs/dbraw/zinc/46/19/82/721461982.db2.gz NILLBJINUOWTIM-LJQANCHMSA-N 1 1 423.001 3.481 20 0 HGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1ncc(OC)cc1Cl)CC2 ZINC001164787731 721462828 /nfs/dbraw/zinc/46/28/28/721462828.db2.gz SANHLMQDKJDHAK-GOSISDBHSA-N 1 1 423.985 3.478 20 0 HGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1ncc(OC)cc1Cl)CC2 ZINC001164787736 721462865 /nfs/dbraw/zinc/46/28/65/721462865.db2.gz SANHLMQDKJDHAK-SFHVURJKSA-N 1 1 423.985 3.478 20 0 HGADMO Fc1c[nH]c2nc(Cl)nc(N3CC[N@H+]4C[C@@H](Oc5cccc(F)c5)C[C@@H]4C3)c12 ZINC001164896896 721509851 /nfs/dbraw/zinc/50/98/51/721509851.db2.gz CAXBLMZKZXVFDN-OCCSQVGLSA-N 1 1 405.836 3.231 20 0 HGADMO O=C(c1cccnc1N1CC[N@H+]2C[C@H](Oc3cccc(F)c3)C[C@H]2C1)N1CCCCC1 ZINC001164900670 721513649 /nfs/dbraw/zinc/51/36/49/721513649.db2.gz SRCOQDTZRRCSOX-PZJWPPBQSA-N 1 1 424.520 3.189 20 0 HGADMO Cc1c[nH]c2nc(Cl)nc(N3CC[N@H+]4C[C@H](Oc5cccc(F)c5)C[C@H]4C3)c12 ZINC001164899053 721525163 /nfs/dbraw/zinc/52/51/63/721525163.db2.gz JUFHBKIZBBVVMG-GOEBONIOSA-N 1 1 401.873 3.401 20 0 HGADMO Cc1nc2ccc(F)cc2c(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@H]3OCCC[C@@H]32)n1 ZINC001164806591 721541649 /nfs/dbraw/zinc/54/16/49/721541649.db2.gz OWHZGGUAIQPLPJ-FKBYEOEOSA-N 1 1 407.493 3.341 20 0 HGADMO CCOC(=O)/C=C/c1ccc(N2CC[N@H+]3C[C@H](Oc4cccc(F)c4)C[C@H]3C2)nc1 ZINC001164907326 721543350 /nfs/dbraw/zinc/54/33/50/721543350.db2.gz MYCYVWHPCNUXGM-LACOWATDSA-N 1 1 411.477 3.139 20 0 HGADMO CC(C)(C)NC(=O)c1ccnc(N2CC[N@H+]3C[C@@H](Oc4cccc(F)c4)C[C@@H]3C2)c1 ZINC001164903474 721545837 /nfs/dbraw/zinc/54/58/37/721545837.db2.gz CWXFKZIINIJVAT-QUCCMNQESA-N 1 1 412.509 3.091 20 0 HGADMO C=Cc1nc(Cl)nc(N2CC[N@H+]3C[C@@H](Oc4cccc(F)c4)C[C@H]3C2)c1OC ZINC001164907203 721550586 /nfs/dbraw/zinc/55/05/86/721550586.db2.gz MQSSCENYHDSCIY-HOCLYGCPSA-N 1 1 404.873 3.263 20 0 HGADMO CSc1nc(Cl)ncc1N1C[C@H]([N@H+](C)Cc2cccnc2)[C@H]2OCCC[C@H]21 ZINC001164807354 721553880 /nfs/dbraw/zinc/55/38/80/721553880.db2.gz STJMXGPOSOEYGH-PVAVHDDUSA-N 1 1 405.955 3.115 20 0 HGADMO CSc1nc(Cl)ncc1N1C[C@H]([N@@H+](C)Cc2cccnc2)[C@H]2OCCC[C@H]21 ZINC001164807354 721553883 /nfs/dbraw/zinc/55/38/83/721553883.db2.gz STJMXGPOSOEYGH-PVAVHDDUSA-N 1 1 405.955 3.115 20 0 HGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2nc(Cl)nc3ncsc32)[C@@H]2CCCO[C@@H]12 ZINC001164805422 721555961 /nfs/dbraw/zinc/55/59/61/721555961.db2.gz NTTNLCDDLDAXCX-RBSFLKMASA-N 1 1 416.938 3.003 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2nc(Cl)nc3ncsc32)[C@@H]2CCCO[C@@H]12 ZINC001164805422 721555964 /nfs/dbraw/zinc/55/59/64/721555964.db2.gz NTTNLCDDLDAXCX-RBSFLKMASA-N 1 1 416.938 3.003 20 0 HGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2ccc(-c3cccs3)nn2)[C@@H]2CCCO[C@H]12 ZINC001164806694 721564149 /nfs/dbraw/zinc/56/41/49/721564149.db2.gz QXDZMTAUYGPURO-KNKQGSTJSA-N 1 1 407.543 3.468 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2ccc(-c3cccs3)nn2)[C@@H]2CCCO[C@H]12 ZINC001164806694 721564153 /nfs/dbraw/zinc/56/41/53/721564153.db2.gz QXDZMTAUYGPURO-KNKQGSTJSA-N 1 1 407.543 3.468 20 0 HGADMO Fc1cccc(O[C@H]2C[C@H]3CN(c4nc5c(nc4Cl)CCCC5)CC[N@H+]3C2)c1 ZINC001164910239 721566857 /nfs/dbraw/zinc/56/68/57/721566857.db2.gz WBZZRNNGKPMKIH-RDJZCZTQSA-N 1 1 402.901 3.490 20 0 HGADMO CSc1ncc(Cl)nc1N1C[C@H]([N@H+](C)Cc2cccnc2)[C@H]2OCCC[C@H]21 ZINC001164798606 721573436 /nfs/dbraw/zinc/57/34/36/721573436.db2.gz BOXMYXBWEQVYID-VYDXJSESSA-N 1 1 405.955 3.115 20 0 HGADMO CSc1ncc(Cl)nc1N1C[C@H]([N@@H+](C)Cc2cccnc2)[C@H]2OCCC[C@H]21 ZINC001164798606 721573437 /nfs/dbraw/zinc/57/34/37/721573437.db2.gz BOXMYXBWEQVYID-VYDXJSESSA-N 1 1 405.955 3.115 20 0 HGADMO Cc1cc(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@@H]32)nc(-c2ccncc2)n1 ZINC001164806232 721575040 /nfs/dbraw/zinc/57/50/40/721575040.db2.gz PJLNNGMAOSBEMX-QNWVGRARSA-N 1 1 416.529 3.110 20 0 HGADMO Cc1nc(-c2ccncc2)cc(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@H]32)n1 ZINC001164810210 721582709 /nfs/dbraw/zinc/58/27/09/721582709.db2.gz VDTUXYSMILZREX-AOHZBQACSA-N 1 1 416.529 3.110 20 0 HGADMO CCOC(=O)c1cccc(N2CCC(F)(F)[C@@]3(CC[N@@H+](Cc4ccccn4)C3)C2)n1 ZINC001164908237 721697949 /nfs/dbraw/zinc/69/79/49/721697949.db2.gz YDMRXFQYQDSNLC-OAQYLSRUSA-N 1 1 416.472 3.391 20 0 HGADMO CC(=O)Nc1c(C)ccnc1N1CCC(F)(F)[C@]2(CC[N@@H+](Cc3ccccn3)C2)C1 ZINC001164904846 721720839 /nfs/dbraw/zinc/72/08/39/721720839.db2.gz DKHQLVHFUJFYFF-NRFANRHFSA-N 1 1 415.488 3.481 20 0 HGADMO Cn1cnc2c1nc(Cl)nc2N1CCc2c(C[N@H+](C)Cc3ccco3)cncc2C1 ZINC001164909983 721750967 /nfs/dbraw/zinc/75/09/67/721750967.db2.gz WKRZHBMMVLKVJP-UHFFFAOYSA-N 1 1 423.908 3.199 20 0 HGADMO Cn1cnc2c1nc(Cl)nc2N1CCc2c(C[N@@H+](C)Cc3ccco3)cncc2C1 ZINC001164909983 721750971 /nfs/dbraw/zinc/75/09/71/721750971.db2.gz WKRZHBMMVLKVJP-UHFFFAOYSA-N 1 1 423.908 3.199 20 0 HGADMO Cc1cccc2cc[nH+]c(N3CCO[C@]4(C3)COCCN(Cc3cccnc3)C4)c12 ZINC001164914671 721797494 /nfs/dbraw/zinc/79/74/94/721797494.db2.gz PNCCPHMZFLPPDD-XMMPIXPASA-N 1 1 404.514 3.046 20 0 HGADMO COC(=O)c1ccc(N2C[C@@H]3CCC[C@@H]([N@@H+](C)Cc4ccccn4)[C@H]3C2)nc1OC ZINC001165022088 721803597 /nfs/dbraw/zinc/80/35/97/721803597.db2.gz HUYOPGBURRFSKU-FFZOFVMBSA-N 1 1 410.518 3.009 20 0 HGADMO CCOC(=O)c1cc(C)nc(N2C[C@@H]3CCC[C@@H]([N@@H+](C)Cc4ccccn4)[C@@H]3C2)n1 ZINC001165023410 721806982 /nfs/dbraw/zinc/80/69/82/721806982.db2.gz JSWIZNUVYXTZCE-FBBABVLZSA-N 1 1 409.534 3.094 20 0 HGADMO C[N@@H+](Cc1ccc(N2CCO[C@@H]3[C@H](COCc4nccs4)CC[C@@H]32)nc1)C1CC1 ZINC001164916698 721811064 /nfs/dbraw/zinc/81/10/64/721811064.db2.gz ITXWOPNJKNJTLN-LQBOVUBWSA-N 1 1 414.575 3.333 20 0 HGADMO C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@H]2CN(c3ccc(C(=O)NC4CC4)cn3)C[C@@H]21 ZINC001165027407 721814591 /nfs/dbraw/zinc/81/45/91/721814591.db2.gz URGGWCZXMYSATC-YUXAGFNASA-N 1 1 405.546 3.106 20 0 HGADMO C[N@H+](Cc1ccccn1)[C@@H]1CCC[C@H]2CN(c3cccc(N4CCOCC4)n3)C[C@@H]21 ZINC001165027622 721819418 /nfs/dbraw/zinc/81/94/18/721819418.db2.gz VJSBQMFOYPUGGD-ILWGZMRPSA-N 1 1 407.562 3.050 20 0 HGADMO C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@H]2CN(c3cccc(N4CCOCC4)n3)C[C@@H]21 ZINC001165027622 721819419 /nfs/dbraw/zinc/81/94/19/721819419.db2.gz VJSBQMFOYPUGGD-ILWGZMRPSA-N 1 1 407.562 3.050 20 0 HGADMO C[N@H+](Cc1ccccn1)[C@@H]1CCC[C@@H]2CN(c3cccc(N4CCOCC4)n3)C[C@@H]21 ZINC001165027620 721819453 /nfs/dbraw/zinc/81/94/53/721819453.db2.gz VJSBQMFOYPUGGD-BAGYTPMASA-N 1 1 407.562 3.050 20 0 HGADMO C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@@H]2CN(c3cccc(N4CCOCC4)n3)C[C@@H]21 ZINC001165027620 721819456 /nfs/dbraw/zinc/81/94/56/721819456.db2.gz VJSBQMFOYPUGGD-BAGYTPMASA-N 1 1 407.562 3.050 20 0 HGADMO C[N@H+](Cc1ccccn1)[C@@H]1CCC[C@H]2CN(c3cccc(N4CCOCC4)n3)C[C@H]21 ZINC001165027623 721819577 /nfs/dbraw/zinc/81/95/77/721819577.db2.gz VJSBQMFOYPUGGD-KSEOMHKRSA-N 1 1 407.562 3.050 20 0 HGADMO C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@H]2CN(c3cccc(N4CCOCC4)n3)C[C@H]21 ZINC001165027623 721819578 /nfs/dbraw/zinc/81/95/78/721819578.db2.gz VJSBQMFOYPUGGD-KSEOMHKRSA-N 1 1 407.562 3.050 20 0 HGADMO CCCNC(=O)c1cccnc1N1C[C@@H]2CCC[C@H]([N@@H+](C)Cc3ccccn3)[C@H]2C1 ZINC001165023268 721823641 /nfs/dbraw/zinc/82/36/41/721823641.db2.gz IMXAZXIJSKTLAU-NYVOZVTQSA-N 1 1 407.562 3.353 20 0 HGADMO CCN(C)c1cc(C)[nH+]c(N(C)C2CCN(Cc3c(OC)cccc3OC)CC2)n1 ZINC001165017178 721837583 /nfs/dbraw/zinc/83/75/83/721837583.db2.gz IKZUHDZZYRKEAO-UHFFFAOYSA-N 1 1 413.566 3.359 20 0 HGADMO C[C@@H]1CCCCN1c1nc2ccccc2nc1N1CC[C@@H]2[C@H]1CC[N@@H+]2CCN(C)C ZINC001164936284 721878561 /nfs/dbraw/zinc/87/85/61/721878561.db2.gz ZDPGHOKKDAQHLU-STZQEDGTSA-N 1 1 408.594 3.223 20 0 HGADMO C[C@@H]1CCCCN1c1nc2ccccc2nc1N1CC[C@@H]2[C@H]1CC[N@H+]2CCN(C)C ZINC001164936284 721878562 /nfs/dbraw/zinc/87/85/62/721878562.db2.gz ZDPGHOKKDAQHLU-STZQEDGTSA-N 1 1 408.594 3.223 20 0 HGADMO COc1cccc(Oc2nc(Cl)ncc2N2CC[C@@H]3[C@@H]2CC[N@@H+]3CCN(C)C)c1 ZINC001164932570 721888928 /nfs/dbraw/zinc/88/89/28/721888928.db2.gz JEXDYKRJIVQUIY-MSOLQXFVSA-N 1 1 417.941 3.146 20 0 HGADMO COc1cccc(Oc2nc(Cl)ncc2N2CC[C@@H]3[C@@H]2CC[N@H+]3CCN(C)C)c1 ZINC001164932570 721888930 /nfs/dbraw/zinc/88/89/30/721888930.db2.gz JEXDYKRJIVQUIY-MSOLQXFVSA-N 1 1 417.941 3.146 20 0 HGADMO c1csc(C[N@@H+]2C[C@H]3CC[C@@H](C2)N3c2nc3ccccc3nc2N2CCOCC2)c1 ZINC001164936979 721912631 /nfs/dbraw/zinc/91/26/31/721912631.db2.gz DMQFPXVFRJLDHG-HDICACEKSA-N 1 1 421.570 3.381 20 0 HGADMO CC[N@H+]1CCCC[C@H]1c1ccc(N2CCCn3cnc(Cn4cccn4)c3C2)nc1 ZINC001164937945 721916044 /nfs/dbraw/zinc/91/60/44/721916044.db2.gz ICHXUGZNVNQHLQ-NRFANRHFSA-N 1 1 405.550 3.480 20 0 HGADMO CCOC(=O)c1cc(C)nc(N2CCC3(CC2)C[N@@H+](Cc2ccc(C)cc2)CCO3)n1 ZINC001164940880 721923629 /nfs/dbraw/zinc/92/36/29/721923629.db2.gz VSDOYDPUDLXHBU-UHFFFAOYSA-N 1 1 424.545 3.142 20 0 HGADMO CC1CCN(C(=O)c2cccnc2N2CC[NH+](CCOc3ccccc3)CC2)CC1 ZINC001165045415 721959482 /nfs/dbraw/zinc/95/94/82/721959482.db2.gz SQVKIQPJCWHXOP-UHFFFAOYSA-N 1 1 408.546 3.155 20 0 HGADMO CC(=O)N1CC[C@@]2(c3ccccc3)CCN(c3ccc(C[N@H+](C)C4CC4)cn3)C[C@H]12 ZINC001164947818 721967680 /nfs/dbraw/zinc/96/76/80/721967680.db2.gz RNIUQHIOUGNEQR-UKILVPOCSA-N 1 1 404.558 3.445 20 0 HGADMO CCOc1ccc(C(=O)OC)c(N2CCC3(CC[N@@H+](Cc4cccnc4)C3)CC2)n1 ZINC001164955868 722018970 /nfs/dbraw/zinc/01/89/70/722018970.db2.gz QATJNVLTLCCYIN-UHFFFAOYSA-N 1 1 410.518 3.154 20 0 HGADMO Fc1cccc2c1ncnc2N1CCC2(CC1)COCC[N@@H+](Cc1ccncc1)C2 ZINC001164963839 722055176 /nfs/dbraw/zinc/05/51/76/722055176.db2.gz NIOZNPLRLOOLIR-UHFFFAOYSA-N 1 1 407.493 3.283 20 0 HGADMO Cc1nc(N2CCC3(CC2)COCC[N@@H+](Cc2ccncc2)C3)nc(C)c1Cl ZINC001164963050 722057470 /nfs/dbraw/zinc/05/74/70/722057470.db2.gz GUAKOEOHAFIYDI-UHFFFAOYSA-N 1 1 401.942 3.261 20 0 HGADMO CCOC(=O)c1c(C)ccnc1N1CCC2(CC1)COCC[N@@H+](Cc1ccncc1)C2 ZINC001164962526 722058533 /nfs/dbraw/zinc/05/85/33/722058533.db2.gz TTWQHAXPMZPOJH-UHFFFAOYSA-N 1 1 424.545 3.081 20 0 HGADMO CN(C)C(=O)N[C@@H]1c2ccccc2[C@H]2CN(c3ccc(C[N@@H+](C)C4CC4)cn3)C[C@H]21 ZINC001164985851 722098225 /nfs/dbraw/zinc/09/82/25/722098225.db2.gz XFFVRTQIIRDTCB-MQSCRBSSSA-N 1 1 405.546 3.222 20 0 HGADMO c1ccc(-c2nccc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)n2)cc1 ZINC001164984718 722104937 /nfs/dbraw/zinc/10/49/37/722104937.db2.gz UEBFQJKJTJFHRQ-FCHUYYIVSA-N 1 1 401.514 3.266 20 0 HGADMO Clc1nc2c(c(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)n1)CCCC2 ZINC001164977269 722106070 /nfs/dbraw/zinc/10/60/70/722106070.db2.gz FNLXKACDCJSQBV-FXAWDEMLSA-N 1 1 413.953 3.131 20 0 HGADMO Clc1cccc2ncc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)nc12 ZINC001164983504 722106556 /nfs/dbraw/zinc/10/65/56/722106556.db2.gz QNJNVRYHKZSXRX-XLIONFOSSA-N 1 1 409.921 3.406 20 0 HGADMO COc1cccc2ccc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)nc21 ZINC001164980107 722106849 /nfs/dbraw/zinc/10/68/49/722106849.db2.gz JIRMJFIYVWCAKC-RBBKRZOGSA-N 1 1 404.514 3.366 20 0 HGADMO FC(F)(Oc1ccc(Cl)nc1)N1CC[C@H]2C[N@@H+](Cc3cccnc3)CCO[C@H]2C1 ZINC001164978309 722108553 /nfs/dbraw/zinc/10/85/53/722108553.db2.gz OKKUUVULGLIBMY-WMZOPIPTSA-N 1 1 424.879 3.282 20 0 HGADMO CCc1cc2c(ncnc2N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)s1 ZINC001164977402 722115877 /nfs/dbraw/zinc/11/58/77/722115877.db2.gz NASISJQHKTZNKT-XLIONFOSSA-N 1 1 409.559 3.376 20 0 HGADMO CC(C)(C)OC(=O)c1ccc(N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)nc1 ZINC001164980510 722117342 /nfs/dbraw/zinc/11/73/42/722117342.db2.gz RNENCRWYTDYVPZ-RTWAWAEBSA-N 1 1 424.545 3.159 20 0 HGADMO COc1ccc2cnc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)cc2c1 ZINC001164980963 722132051 /nfs/dbraw/zinc/13/20/51/722132051.db2.gz OGLNRLBBEMEMMR-NZQKXSOJSA-N 1 1 404.514 3.366 20 0 HGADMO COc1ccc2ccnc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)c2c1 ZINC001164974131 722134244 /nfs/dbraw/zinc/13/42/44/722134244.db2.gz CJLGOQXLUZOFCS-OFNKIYASSA-N 1 1 404.514 3.366 20 0 HGADMO c1cncc(C[N@H+]2CCO[C@@H]3CN(c4ncnc5sc6c(c54)CCC6)CC[C@H]3C2)c1 ZINC001164980366 722139074 /nfs/dbraw/zinc/13/90/74/722139074.db2.gz NFSIRPJQQMFSEX-PKOBYXMFSA-N 1 1 421.570 3.302 20 0 HGADMO c1ccc(-c2cnc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)cn2)cc1 ZINC001164978016 722140495 /nfs/dbraw/zinc/14/04/95/722140495.db2.gz JDTVVWJOZZOWFH-FYYLOGMGSA-N 1 1 401.514 3.266 20 0 HGADMO Fc1ccc(-c2cc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)ncn2)cc1 ZINC001164984624 722144894 /nfs/dbraw/zinc/14/48/94/722144894.db2.gz XXBFVXASIFJYAM-NZQKXSOJSA-N 1 1 419.504 3.405 20 0 HGADMO CCc1nc(Cl)c(N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)c(Cl)n1 ZINC001164972642 722146297 /nfs/dbraw/zinc/14/62/97/722146297.db2.gz AFYNKMXTJQDTRO-HOTGVXAUSA-N 1 1 422.360 3.468 20 0 HGADMO CSc1ccc2ncnc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)c2c1 ZINC001164972562 722154005 /nfs/dbraw/zinc/15/40/05/722154005.db2.gz IKCCJTLQNCHQCS-PGRDOPGGSA-N 1 1 421.570 3.474 20 0 HGADMO Fc1cccc(C[N@H+]2CC[C@]23CCCN(c2ccc(CN4CCOCC4)cn2)C3)c1 ZINC001164994970 722193160 /nfs/dbraw/zinc/19/31/60/722193160.db2.gz RDDHBPWZUKNLKW-DEOSSOPVSA-N 1 1 410.537 3.298 20 0 HGADMO COC(=O)c1nc(Cl)cnc1N1CCC[C@]2(CC[N@H+]2Cc2cccc(F)c2)C1 ZINC001164994051 722200736 /nfs/dbraw/zinc/20/07/36/722200736.db2.gz DYILDHCVBUVVPP-FQEVSTJZSA-N 1 1 404.873 3.301 20 0 HGADMO O[C@H](C(F)F)[C@@H](Cc1ccccc1)[NH2+]Cc1ncc(I)s1 ZINC000511996450 1126095465 /nfs/dbraw/zinc/09/54/65/1126095465.db2.gz HQRMVBDZNVFWPM-MFKMUULPSA-N 1 1 424.254 3.075 20 0 HGADMO O[C@H](C(F)F)[C@H](Cc1ccccc1)[NH2+]Cc1ncc(I)s1 ZINC000511996448 1126095560 /nfs/dbraw/zinc/09/55/60/1126095560.db2.gz HQRMVBDZNVFWPM-GWCFXTLKSA-N 1 1 424.254 3.075 20 0 HGADMO COc1ccccc1C[C@](C)(CO)[NH2+]Cc1nc2sc3c(c2c(N)n1)CCCC3 ZINC001308034943 1126162266 /nfs/dbraw/zinc/16/22/66/1126162266.db2.gz GFHMNGZKCNPIIL-JOCHJYFZSA-N 1 1 412.559 3.244 20 0 HGADMO COc1ccc(C[C@@](C)(CO)[NH2+]Cc2ccc(CN(C)C)c3c2OC(F)(F)O3)cc1 ZINC001461734531 1126196708 /nfs/dbraw/zinc/19/67/08/1126196708.db2.gz FACGSCFTTLARKE-NRFANRHFSA-N 1 1 422.472 3.162 20 0 HGADMO CN(C)Cc1ccc(C[NH2+][C@H](CO)Cc2c[nH]c3ccccc23)c2c1OC(F)(F)O2 ZINC001560330212 1126210120 /nfs/dbraw/zinc/21/01/20/1126210120.db2.gz HQKIJVZFPPXBPL-KRWDZBQOSA-N 1 1 417.456 3.244 20 0 HGADMO O=C(NC1CCCC1)c1ccc(N2CCC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)nn1 ZINC001164629599 719103620 /nfs/dbraw/zinc/10/36/20/719103620.db2.gz SUAZLCYBIQCOMB-KNQAVFIVSA-N 1 1 405.546 3.250 20 0 HGADMO CCOC(=O)[C@@H]1CCc2nnc(N3CCC[C@@H]4C[N@@H+](Cc5ccccc5)C[C@@H]43)cc2C1 ZINC001164629043 719113320 /nfs/dbraw/zinc/11/33/20/719113320.db2.gz QOBFQRVLXYLVEY-VIZSFHNOSA-N 1 1 420.557 3.245 20 0 HGADMO CC(C)n1nc(C[NH+](C)C)c2c1CN(c1nc(Cl)nc3c1COC3(C)C)CC2 ZINC001164647943 719309388 /nfs/dbraw/zinc/30/93/88/719309388.db2.gz PEEUKKCGMZRYRD-UHFFFAOYSA-N 1 1 404.946 3.297 20 0 HGADMO CCOC(=O)c1cc2cccnc2nc1N1CCc2c(C[NH+](C)C)nn(C(C)C)c2C1 ZINC001164647431 719310797 /nfs/dbraw/zinc/31/07/97/719310797.db2.gz AXRVBRJSYQAKER-UHFFFAOYSA-N 1 1 422.533 3.208 20 0 HGADMO COc1cnc2c(c1)ncnc2N1CCC2(CCC[N@H+]2Cc2csc(C)n2)CC1 ZINC001164691676 719812840 /nfs/dbraw/zinc/81/28/40/719812840.db2.gz JPDJXHQMKRLHOC-UHFFFAOYSA-N 1 1 410.547 3.433 20 0 HGADMO COc1nc(N2CCC3(CCC[N@H+]3Cc3csc(C)n3)CC2)nc2c1ccn2C ZINC001164697159 719816259 /nfs/dbraw/zinc/81/62/59/719816259.db2.gz AENPGBDBQCKGTN-UHFFFAOYSA-N 1 1 412.563 3.377 20 0 HGADMO COC(=O)[C@@]1(C)C[C@@H]([NH+]2CCOCC2)CCN1c1cc(Cl)nc2cc(C)ccc21 ZINC001164701029 719858799 /nfs/dbraw/zinc/85/87/99/719858799.db2.gz JBIXAVMBBPVMLW-KSFYIVLOSA-N 1 1 417.937 3.429 20 0 HGADMO Cc1noc(-c2ccnc(N3CCC4(CC3)C[N@@H+](Cc3cccs3)CCO4)c2)n1 ZINC001164705340 719899588 /nfs/dbraw/zinc/89/95/88/719899588.db2.gz AGCUGTIIJLZGHT-UHFFFAOYSA-N 1 1 411.531 3.373 20 0 HGADMO c1csc(C[N@H+]2CCOC3(CCN(c4nccnc4OC4CCC4)CC3)C2)c1 ZINC001164705860 719903144 /nfs/dbraw/zinc/90/31/44/719903144.db2.gz DNECCYJNFBTYPQ-UHFFFAOYSA-N 1 1 400.548 3.341 20 0 HGADMO CCOC(=O)c1cc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COC)ncc1Cl ZINC001164814243 720077020 /nfs/dbraw/zinc/07/70/20/720077020.db2.gz WIUBOTWRSROELX-HRAATJIYSA-N 1 1 407.942 3.096 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(C(F)(F)Oc1cccc(Cl)n1)C2 ZINC001164809785 720095140 /nfs/dbraw/zinc/09/51/40/720095140.db2.gz KHDJNIOQLURODM-CRAIPNDOSA-N 1 1 401.885 3.344 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(C(F)(F)Oc1cccc(Cl)n1)C2 ZINC001164809788 720095450 /nfs/dbraw/zinc/09/54/50/720095450.db2.gz KHDJNIOQLURODM-YJBOKZPZSA-N 1 1 401.885 3.344 20 0 HGADMO COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1ncnc3[nH]c(C)cc31)CC2 ZINC001164716226 720109749 /nfs/dbraw/zinc/10/97/49/720109749.db2.gz JLSVBWNZDZRCTC-IBGZPJMESA-N 1 1 406.534 3.169 20 0 HGADMO C=C(OCC)c1ccc(N2CCC3(C[C@@H](COC)[N@@H+](Cc4ccccn4)C3)CC2)nn1 ZINC001164716962 720118141 /nfs/dbraw/zinc/11/81/41/720118141.db2.gz MLNLVASTSKHQKL-NRFANRHFSA-N 1 1 423.561 3.386 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1nc3ccccc3cc1C(=O)OC)C2 ZINC001164815424 720142270 /nfs/dbraw/zinc/14/22/70/720142270.db2.gz VNVKHJGKHNPUGO-YADARESESA-N 1 1 409.530 3.206 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1nccc(-c3ccc(N(C)C)cc3)n1)C2 ZINC001164817536 720150013 /nfs/dbraw/zinc/15/00/13/720150013.db2.gz PUNQOEFSRGUIJY-BWKNWUBXSA-N 1 1 421.589 3.394 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1nccc(-c3ccc(N(C)C)cc3)n1)C2 ZINC001164817542 720150583 /nfs/dbraw/zinc/15/05/83/720150583.db2.gz PUNQOEFSRGUIJY-SQJMNOBHSA-N 1 1 421.589 3.394 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1cc3cc(OC)c(OC)cc3cn1)C2 ZINC001164818875 720177336 /nfs/dbraw/zinc/17/73/36/720177336.db2.gz VEDDOQHULFCSKO-YKSBVNFPSA-N 1 1 411.546 3.437 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1cc(-c3nc(C(C)C)no3)ccn1)C2 ZINC001164820250 720184664 /nfs/dbraw/zinc/18/46/64/720184664.db2.gz ZVRWIEUFNGPLRZ-XXBNENTESA-N 1 1 411.550 3.440 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1ccc(-c3sc(C)nc3C)nn1)C2 ZINC001164813047 720188550 /nfs/dbraw/zinc/18/85/50/720188550.db2.gz CCNRFOAIRYVUNZ-PGRDOPGGSA-N 1 1 413.591 3.402 20 0 HGADMO CC(C)c1c(Cl)ncnc1N1CCCn2c(=O)cc(C[N@H+](C)C(C)C)nc2C1 ZINC001164817706 720243562 /nfs/dbraw/zinc/24/35/62/720243562.db2.gz UEOCFUICSAXLFS-UHFFFAOYSA-N 1 1 404.946 3.061 20 0 HGADMO CCOC(=O)c1nc2ccccc2c(N2CC[C@H]3[C@H]2CC[N@H+]3Cc2cccnc2)n1 ZINC001164726647 720341189 /nfs/dbraw/zinc/34/11/89/720341189.db2.gz QTIUWCQPZBUDMP-VQTJNVASSA-N 1 1 403.486 3.055 20 0 HGADMO COC(=O)c1nc(Cl)ccc1C(F)(F)N1CC[C@H]2[C@@H]1CC[N@@H+]2Cc1cccnc1 ZINC001164723159 720377375 /nfs/dbraw/zinc/37/73/75/720377375.db2.gz GIFOSUJRVWUQEI-HOTGVXAUSA-N 1 1 422.863 3.315 20 0 HGADMO COC(=O)c1nc(Cl)ccc1C(F)(F)N1CC[C@H]2[C@@H]1CC[N@H+]2Cc1cccnc1 ZINC001164723159 720377382 /nfs/dbraw/zinc/37/73/82/720377382.db2.gz GIFOSUJRVWUQEI-HOTGVXAUSA-N 1 1 422.863 3.315 20 0 HGADMO Cc1nc(CO[C@@H]2CN(c3ccc(C[N@H+](C)C4CC4)cn3)[C@H]3CCCO[C@H]23)cs1 ZINC001164825796 720392025 /nfs/dbraw/zinc/39/20/25/720392025.db2.gz VIGJJECOEFKKEN-VWPQPMDRSA-N 1 1 414.575 3.394 20 0 HGADMO CCN(CC)C(=O)c1cc(Cl)nc(N2CC[C@@H]3[C@H]2CC[N@H+]3Cc2cccnc2)c1 ZINC001164731322 720396581 /nfs/dbraw/zinc/39/65/81/720396581.db2.gz ZCBVOBMYAUTLJQ-RTBURBONSA-N 1 1 413.953 3.465 20 0 HGADMO COC(=O)c1cnc(Cl)c(C(F)(F)N2CC[C@@H]3[C@@H]2CC[N@@H+]3Cc2cccnc2)c1 ZINC001164734400 720426429 /nfs/dbraw/zinc/42/64/29/720426429.db2.gz RXWXSZNJYVOLCW-SJORKVTESA-N 1 1 422.863 3.315 20 0 HGADMO COC(=O)c1cnc(Cl)c(C(F)(F)N2CC[C@@H]3[C@@H]2CC[N@H+]3Cc2cccnc2)c1 ZINC001164734400 720426431 /nfs/dbraw/zinc/42/64/31/720426431.db2.gz RXWXSZNJYVOLCW-SJORKVTESA-N 1 1 422.863 3.315 20 0 HGADMO Cc1cnc(N2CC[C@@H]3[C@@H](C[C@@H](Cn4cccn4)[N@@H+]3C(C)C)C2)nc1NCC1CC1 ZINC001164836532 720504369 /nfs/dbraw/zinc/50/43/69/720504369.db2.gz MXTPSYUJSWEXIA-PCCBWWKXSA-N 1 1 409.582 3.181 20 0 HGADMO CC(C)(c1ccnc(Cl)c1)[N@@H+]1CC[C@H]2OCC[C@]2(C(=O)Nc2cccnc2)C1 ZINC001164729886 720504375 /nfs/dbraw/zinc/50/43/75/720504375.db2.gz KGRMCMGTUINVDI-UTKZUKDTSA-N 1 1 400.910 3.485 20 0 HGADMO CC(C)(c1ccnc(Cl)c1)[N@H+]1CC[C@H]2OCC[C@]2(C(=O)Nc2cccnc2)C1 ZINC001164729886 720504377 /nfs/dbraw/zinc/50/43/77/720504377.db2.gz KGRMCMGTUINVDI-UTKZUKDTSA-N 1 1 400.910 3.485 20 0 HGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@@H]2CN(c3ccc(N4CCCCC4)nn3)CC[C@@H]21 ZINC001164837844 720506731 /nfs/dbraw/zinc/50/67/31/720506731.db2.gz PVIKICNYKMPELW-HKBOAZHASA-N 1 1 409.582 3.041 20 0 HGADMO CCOC(=O)c1ccc(N2CC[C@@H]3[C@@H](C[C@H](Cn4cccn4)[N@H+]3C(C)C)C2)nc1C ZINC001164836016 720507489 /nfs/dbraw/zinc/50/74/89/720507489.db2.gz LNVFLVANXJIWIQ-QKNQBKEWSA-N 1 1 411.550 3.141 20 0 HGADMO CCOC(=O)c1cc(C)cc(N2CC[C@@H]3[C@H](C[C@@H](Cn4cccn4)[N@H+]3C(C)C)C2)n1 ZINC001164834874 720519563 /nfs/dbraw/zinc/51/95/63/720519563.db2.gz HTSJFHCWLMRSAS-SVFBPWRDSA-N 1 1 411.550 3.141 20 0 HGADMO COc1ccc2cnc(N3CC[C@@H]4[C@H](C[C@@H](Cn5cccn5)[N@H+]4C(C)C)C3)nc2c1 ZINC001164839433 720525741 /nfs/dbraw/zinc/52/57/41/720525741.db2.gz UGRJUSKBFMNTQS-XQBPLPMBSA-N 1 1 406.534 3.213 20 0 HGADMO COC(=O)c1ccc(Cl)c(N2CC[C@@H]3[C@@H](C[C@@H](Cn4cccn4)[N@H+]3C(C)C)C2)n1 ZINC001164839644 720553585 /nfs/dbraw/zinc/55/35/85/720553585.db2.gz RDJQBDCNYFRONS-TXPKVOOTSA-N 1 1 417.941 3.096 20 0 HGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@H]2CN(C(F)(F)c3cc(N)cc(Cl)n3)CC[C@@H]21 ZINC001164840185 720559574 /nfs/dbraw/zinc/55/95/74/720559574.db2.gz SBOQOKWMTHRRDP-XIRDDKMYSA-N 1 1 424.927 3.436 20 0 HGADMO COc1cc2ccnc(N3CCc4ncc(C[NH+]5CCCC5)n4CC3)c2cc1OC ZINC001164729527 720567427 /nfs/dbraw/zinc/56/74/27/720567427.db2.gz QCSUQRQNHRCACW-UHFFFAOYSA-N 1 1 407.518 3.107 20 0 HGADMO CCOC(=O)c1c(C)ccnc1N1CC[C@@H]2[C@@H](C[C@@H](Cn3cccn3)[N@H+]2C(C)C)C1 ZINC001164839823 720578517 /nfs/dbraw/zinc/57/85/17/720578517.db2.gz OVUQBVVYQPAMRT-SLFFLAALSA-N 1 1 411.550 3.141 20 0 HGADMO CCOCc1cnc(Cl)nc1N1CC[C@@H]2[C@@H](C[C@@H](Cn3cccn3)[N@H+]2C(C)C)C1 ZINC001164840288 720587221 /nfs/dbraw/zinc/58/72/21/720587221.db2.gz PWRKLWBFFYKWFY-YTQUADARSA-N 1 1 418.973 3.241 20 0 HGADMO COc1cccc2c(N3CC[N@H+]4C[C@H](Oc5cncnc5)C[C@H]4C3)cc(Cl)nc12 ZINC001164743751 720607038 /nfs/dbraw/zinc/60/70/38/720607038.db2.gz QKMRAPJLWLSNOI-LSDHHAIUSA-N 1 1 411.893 3.029 20 0 HGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@@H]2CN(c3ncnc(-c4cccc(F)c4)n3)CC[C@@H]21 ZINC001164841352 720615442 /nfs/dbraw/zinc/61/54/42/720615442.db2.gz RZFXVDWHUVEQBY-GIVPXCGWSA-N 1 1 421.524 3.252 20 0 HGADMO C[N@@H+](Cc1ccccc1)[C@H]1COC2(C1)CCN(c1nccc(N3CCCC3)n1)CC2 ZINC001164840384 720655092 /nfs/dbraw/zinc/65/50/92/720655092.db2.gz MAUZADQJYJJLFZ-OAQYLSRUSA-N 1 1 407.562 3.337 20 0 HGADMO C[N@@H+](Cc1ccccc1)[C@@H]1COC2(C1)CCN(c1nc(Cl)ccc1C(N)=O)CC2 ZINC001164841822 720691347 /nfs/dbraw/zinc/69/13/47/720691347.db2.gz JDRGNKBEXQNNBC-KRWDZBQOSA-N 1 1 414.937 3.094 20 0 HGADMO COc1cnc(N2CC[N@H+]3C[C@H](Oc4cncnc4)C[C@@H]3C2)c2cc(Cl)ccc12 ZINC001164740108 720696817 /nfs/dbraw/zinc/69/68/17/720696817.db2.gz QARIHEZOSRGOIR-HZPDHXFCSA-N 1 1 411.893 3.029 20 0 HGADMO Clc1cnc(Cl)c(N2CC[N@@H+]3C[C@@H](Oc4cncnc4)C[C@H]3C2)c1Cl ZINC001164736831 720706228 /nfs/dbraw/zinc/70/62/28/720706228.db2.gz BKZRKMSQUFPIIC-QWRGUYRKSA-N 1 1 400.697 3.174 20 0 HGADMO Clc1cnc(Cl)c(N2CC[N@H+]3C[C@@H](Oc4cncnc4)C[C@H]3C2)c1Cl ZINC001164736831 720706235 /nfs/dbraw/zinc/70/62/35/720706235.db2.gz BKZRKMSQUFPIIC-QWRGUYRKSA-N 1 1 400.697 3.174 20 0 HGADMO Cc1cc2nc(Cl)c(N3CC[N@H+]4C[C@@H](Oc5cncnc5)C[C@@H]4C3)nc2cc1C ZINC001164742322 720725374 /nfs/dbraw/zinc/72/53/74/720725374.db2.gz OEMRUNCMTDEAAR-CVEARBPZSA-N 1 1 410.909 3.032 20 0 HGADMO FC(F)(c1ccnc(Cl)c1)N1CC[C@@H]2[C@H](C[C@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164748956 720810536 /nfs/dbraw/zinc/81/05/36/720810536.db2.gz SBWRLIJANJRMJQ-KBAYOESNSA-N 1 1 422.911 3.251 20 0 HGADMO CC(C)(c1ccnc(Cl)c1)[N@H+]1C[C@@H]2COC[C@@]2(C(=O)NCCc2ccccc2)C1 ZINC001164853655 720817517 /nfs/dbraw/zinc/81/75/17/720817517.db2.gz RJVPNNQDSITKAF-XXBNENTESA-N 1 1 413.949 3.277 20 0 HGADMO Cc1nc2ccc(F)cc2c(N2CC[C@@H]3[C@H](C[C@@H](Cn4cncn4)[N@H+]3CC3CC3)C2)n1 ZINC001164739626 720820047 /nfs/dbraw/zinc/82/00/47/720820047.db2.gz HZAKBKIRGKBFIF-ZWCUEREDSA-N 1 1 421.524 3.048 20 0 HGADMO Clc1ccc(Cl)c(N2CC[C@@H]3[C@@H](C[C@@H](Cn4cncn4)[N@H+]3CC3CC3)C2)n1 ZINC001164745124 720822691 /nfs/dbraw/zinc/82/26/91/720822691.db2.gz WKSIARVKJTYAQI-YQQAZPJKSA-N 1 1 407.349 3.359 20 0 HGADMO CSc1cc(Cl)ncc1N1CC[C@@H]2[C@H](C[C@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164738358 720824159 /nfs/dbraw/zinc/82/41/59/720824159.db2.gz FBECGFCZGHICCU-BRWVUGGUSA-N 1 1 418.998 3.428 20 0 HGADMO Clc1ccnc(Cl)c1N1CC[C@@H]2[C@@H](C[C@@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164745092 720826308 /nfs/dbraw/zinc/82/63/08/720826308.db2.gz WDOAWEQZFHQVEQ-YQQAZPJKSA-N 1 1 407.349 3.359 20 0 HGADMO COc1ccc2cnc(N3CC[C@@H]4[C@@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)cc2c1 ZINC001164741905 720839723 /nfs/dbraw/zinc/83/97/23/720839723.db2.gz FVJMECHVQATDTJ-QNWVGRARSA-N 1 1 418.545 3.214 20 0 HGADMO COCC[N@H+]1CCO[C@H]2CN(c3nc4ccc(Cl)cc4nc3Cl)CC[C@@H]2C1 ZINC001164851405 720848341 /nfs/dbraw/zinc/84/83/41/720848341.db2.gz GWZBQWJHLPYDRU-DYVFJYSZSA-N 1 1 411.333 3.110 20 0 HGADMO COCC[N@H+]1CCO[C@H]2CN(c3nc(Cl)nc4c(Cl)cccc43)CC[C@@H]2C1 ZINC001164851452 720850951 /nfs/dbraw/zinc/85/09/51/720850951.db2.gz HGHOSPPWIZKBOH-CJNGLKHVSA-N 1 1 411.333 3.110 20 0 HGADMO COCC[N@H+]1CCO[C@@H]2CN(c3nc4ccccc4c(-c4ccccc4)n3)CC[C@@H]2C1 ZINC001164856003 720852514 /nfs/dbraw/zinc/85/25/14/720852514.db2.gz NHJSQBKNPHEUGN-NFBKMPQASA-N 1 1 418.541 3.470 20 0 HGADMO COCC[N@H+]1CCO[C@@H]2CN(c3nc(Cl)cc4c(Cl)ccnc43)CC[C@H]2C1 ZINC001164854009 720852590 /nfs/dbraw/zinc/85/25/90/720852590.db2.gz HYHFMNMQVVQMFH-XJKSGUPXSA-N 1 1 411.333 3.110 20 0 HGADMO COCC[N@H+]1CCO[C@@H]2CN(c3cc(Cl)nc4cc(OC)ccc43)CC[C@@H]2C1 ZINC001164862158 720853988 /nfs/dbraw/zinc/85/39/88/720853988.db2.gz ZEOKMXXLBJXXRB-FOIQADDNSA-N 1 1 405.926 3.070 20 0 HGADMO COCC[N@H+]1CCO[C@@H]2CN(C(F)(F)c3ccc(Cl)c(Cl)n3)CC[C@@H]2C1 ZINC001164854974 720854242 /nfs/dbraw/zinc/85/42/42/720854242.db2.gz LWGHDIUZHPWPGH-TZMCWYRMSA-N 1 1 410.292 3.107 20 0 HGADMO CC(C)(c1ccnc(Cl)c1)N1CC[C@@H]2[C@H](C[C@@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164752855 720861182 /nfs/dbraw/zinc/86/11/82/720861182.db2.gz UTVZFICNOKFJQO-YZGWKJHDSA-N 1 1 414.985 3.437 20 0 HGADMO COCC[N@H+]1CCO[C@@H]2CN(c3nc(Cl)cc4cc(OC)ccc43)CC[C@@H]2C1 ZINC001164851960 720865631 /nfs/dbraw/zinc/86/56/31/720865631.db2.gz BILLHZZNFIDPLS-DNVCBOLYSA-N 1 1 405.926 3.070 20 0 HGADMO COCC[N@H+]1CCO[C@@H]2CN(c3nc(Cl)cc4cc(OC)ccc43)CC[C@H]2C1 ZINC001164851962 720865700 /nfs/dbraw/zinc/86/57/00/720865700.db2.gz BILLHZZNFIDPLS-HNAYVOBHSA-N 1 1 405.926 3.070 20 0 HGADMO Cc1cc(C)nc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COCc2cccnc2)n1 ZINC001164748453 720869765 /nfs/dbraw/zinc/86/97/65/720869765.db2.gz DXOJWWPVYVEGNW-VWNXMTODSA-N 1 1 407.562 3.244 20 0 HGADMO c1cc2ncnc(N3CC[C@@]4(C3)C[N@H+](CC3CC3)C[C@H]4COCc3cccnc3)c2[nH]1 ZINC001164752944 720871124 /nfs/dbraw/zinc/87/11/24/720871124.db2.gz NPFNJOMPFNEXQT-RDPSFJRHSA-N 1 1 418.545 3.108 20 0 HGADMO COCC[N@H+]1CCO[C@@H]2CN(c3cc(C(C)(C)C)nc(C(C)(C)C)n3)CC[C@H]2C1 ZINC001164863102 720873310 /nfs/dbraw/zinc/87/33/10/720873310.db2.gz SNJXKOPMMXYZBQ-ZWKOTPCHSA-N 1 1 404.599 3.245 20 0 HGADMO c1cncc(COC[C@@H]2C[N@@H+](CC3CC3)C[C@@]23CCN(c2ncnc4c2CCC4)C3)c1 ZINC001164755318 720875219 /nfs/dbraw/zinc/87/52/19/720875219.db2.gz WMXKITJJPZKTOO-SQJMNOBHSA-N 1 1 419.573 3.115 20 0 HGADMO Cc1ncc(F)c(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COCc2cccnc2)n1 ZINC001164752915 720879478 /nfs/dbraw/zinc/87/94/78/720879478.db2.gz NLELSHWUZNHXPI-REWPJTCUSA-N 1 1 411.525 3.074 20 0 HGADMO COCC[N@H+]1CCO[C@H]2CN(c3cc(Cl)nc(-c4ccc(F)cc4)n3)CC[C@H]2C1 ZINC001164860542 720880497 /nfs/dbraw/zinc/88/04/97/720880497.db2.gz OURLDEMNHZIMBW-WMZOPIPTSA-N 1 1 420.916 3.110 20 0 HGADMO COCC[N@H+]1CCO[C@@H]2CN(c3nc(Cl)cc4cc(F)c(OC)cc43)CC[C@H]2C1 ZINC001164855958 720892927 /nfs/dbraw/zinc/89/29/27/720892927.db2.gz DSINOWCFLJBYTH-IFXJQAMLSA-N 1 1 423.916 3.209 20 0 HGADMO COc1cc2ncnc(N3CCn4c(C[N@@H+](C)C(C)C)cnc4[C@@H]3C)c2c(OC)c1 ZINC001164864189 720970259 /nfs/dbraw/zinc/97/02/59/720970259.db2.gz ZEZFLMCDBLZCPI-HNNXBMFYSA-N 1 1 410.522 3.265 20 0 HGADMO COc1nc(-c2ccccc2)nc(N2CCn3c(C[N@@H+](C)C(C)C)cnc3[C@H]2C)n1 ZINC001164861636 720974035 /nfs/dbraw/zinc/97/40/35/720974035.db2.gz QBDCPTTZGFMEIS-MRXNPFEDSA-N 1 1 407.522 3.165 20 0 HGADMO Cc1ccc2nc(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@H]4C3)c(Cl)nc2c1 ZINC001164863968 721079958 /nfs/dbraw/zinc/07/99/58/721079958.db2.gz DKYPTTNWOIOMTF-ROUUACIJSA-N 1 1 409.921 3.466 20 0 HGADMO Cc1cccc2c(Cl)nnc(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@H]4C3)c12 ZINC001164866001 721083874 /nfs/dbraw/zinc/08/38/74/721083874.db2.gz QXEGMOWBYNGUMF-ZWKOTPCHSA-N 1 1 409.921 3.466 20 0 HGADMO Fc1cccc(Oc2ccnc(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@H]4C3)n2)c1 ZINC001164880703 721125347 /nfs/dbraw/zinc/12/53/47/721125347.db2.gz XDODDAXTJKZJNT-FPOVZHCZSA-N 1 1 421.476 3.283 20 0 HGADMO CC(C)(C)c1cc(Cl)nc(N2CC[N@H+]3C[C@@H](OCc4cccnc4)C[C@@H]3C2)n1 ZINC001164872620 721127805 /nfs/dbraw/zinc/12/78/05/721127805.db2.gz HXWHLZCVOXFKNA-SJORKVTESA-N 1 1 401.942 3.302 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4cc(C(=O)Nc5ccccc5)ccn4)C[C@H]3C2)cn1 ZINC001164773679 721138846 /nfs/dbraw/zinc/13/88/46/721138846.db2.gz YQDJBKALVQWTLY-NHCUHLMSSA-N 1 1 416.529 3.026 20 0 HGADMO COc1ccc(-c2cc(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@@H]4C3)ncn2)cc1 ZINC001164877017 721154154 /nfs/dbraw/zinc/15/41/54/721154154.db2.gz NWKJAFIURWEICN-IFMALSPDSA-N 1 1 417.513 3.027 20 0 HGADMO Clc1cc(-c2ccncc2)nc(N2CC[N@H+]3C[C@H](OCc4cccnc4)C[C@@H]3C2)n1 ZINC001164880737 721182782 /nfs/dbraw/zinc/18/27/82/721182782.db2.gz XJLHLSBQYMOXNE-RTBURBONSA-N 1 1 422.920 3.067 20 0 HGADMO FC(F)(Oc1ccnc(Cl)c1)N1CC[N@H+]2C[C@H](OCc3cccnc3)C[C@@H]2C1 ZINC001164879586 721183673 /nfs/dbraw/zinc/18/36/73/721183673.db2.gz UDIGHNNDKNNTOB-NVXWUHKLSA-N 1 1 410.852 3.034 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4nc(Cl)nc5c(Cl)nccc54)C[C@H]3C2)cn1 ZINC001164762040 721190397 /nfs/dbraw/zinc/19/03/97/721190397.db2.gz CCTAQZYGCRCHOB-UONOGXRCSA-N 1 1 418.332 3.023 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4ncccc4OCc4ccc(F)cc4)C[C@H]3C2)cn1 ZINC001164770879 721213573 /nfs/dbraw/zinc/21/35/73/721213573.db2.gz PALARRALXAMTLW-LEWJYISDSA-N 1 1 421.520 3.492 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4nccc(SCc5ccccc5)n4)C[C@@H]3C2)cn1 ZINC001164767206 721229054 /nfs/dbraw/zinc/22/90/54/721229054.db2.gz WFNDHPQQKNPDJH-RTWAWAEBSA-N 1 1 420.586 3.461 20 0 HGADMO CCN1C(=O)[C@]2(CC[C@@H]3CN(c4nc(Cl)ccc4C[NH+]4CCCC4)C[C@@H]32)N=C1C ZINC001164875122 721230374 /nfs/dbraw/zinc/23/03/74/721230374.db2.gz WDUVCHXGNUFIGQ-TVTNDZMWSA-N 1 1 415.969 3.196 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4c(Cl)nc(Cl)nc4C4CC4)C[C@H]3C2)cn1 ZINC001164768866 721241502 /nfs/dbraw/zinc/24/15/02/721241502.db2.gz YHVRCTRWGOIEQS-LSDHHAIUSA-N 1 1 407.349 3.353 20 0 HGADMO COc1ccc(-c2ccc(N3CC4(C3)CC[N@@H+](CC3CC3)C4)nn2)c(OC)c1OC ZINC001164774493 721301454 /nfs/dbraw/zinc/30/14/54/721301454.db2.gz DDXNEWKEUJHNBN-UHFFFAOYSA-N 1 1 410.518 3.092 20 0 HGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@@]2(CCCN(c3nccc4ncccc43)C2)C1 ZINC001164778405 721338717 /nfs/dbraw/zinc/33/87/17/721338717.db2.gz VLWDZRVMNVYJJX-QHCPKHFHSA-N 1 1 407.518 3.354 20 0 HGADMO COc1cc(Cl)ncc1N1CCC[C@@]2(C1)COCC[N@@H+](Cc1c(C)noc1C)C2 ZINC001164777837 721343924 /nfs/dbraw/zinc/34/39/24/721343924.db2.gz IPNCBWDQGMITRN-OAQYLSRUSA-N 1 1 420.941 3.467 20 0 HGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@]2(CCCN(c3cc(N)cc(Cl)n3)C2)C1 ZINC001164780057 721344686 /nfs/dbraw/zinc/34/46/86/721344686.db2.gz ZFVSXYCNPKRPIQ-HXUWFJFHSA-N 1 1 405.930 3.041 20 0 HGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@]2(CCCN(c3nccc(C(C)(C)C)n3)C2)C1 ZINC001164776339 721345884 /nfs/dbraw/zinc/34/58/84/721345884.db2.gz AQZRFACAUYVWSQ-HSZRJFAPSA-N 1 1 413.566 3.498 20 0 HGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@]2(CCCN(c3nccc(C(C)(C)C)n3)C2)C1 ZINC001164776339 721345892 /nfs/dbraw/zinc/34/58/92/721345892.db2.gz AQZRFACAUYVWSQ-HSZRJFAPSA-N 1 1 413.566 3.498 20 0 HGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@@]2(CCCN(c3nc(Cl)c(F)cc3N)C2)C1 ZINC001164785242 721360560 /nfs/dbraw/zinc/36/05/60/721360560.db2.gz SSTFQUCMANKGNF-FQEVSTJZSA-N 1 1 423.920 3.180 20 0 HGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2C[C@@H]3[C@H](C2)OCC(=O)N3c2cccc(F)c2)nc1 ZINC001164883226 721366896 /nfs/dbraw/zinc/36/68/96/721366896.db2.gz OINAEMDOLVWHND-VSKRKVRLSA-N 1 1 424.520 3.388 20 0 HGADMO CCC[N@H+]1CCCC[C@@H]1c1ccc(N2CC[C@]3(CC(=O)N(c4cnn(C)c4)C3)C2)nc1 ZINC001164886311 721373749 /nfs/dbraw/zinc/37/37/49/721373749.db2.gz MOEBWCDFPYGWAK-QPPBQGQZSA-N 1 1 422.577 3.386 20 0 HGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@]2(CCCN(c3ncc(C(F)F)cn3)C2)C1 ZINC001164785316 721374067 /nfs/dbraw/zinc/37/40/67/721374067.db2.gz UKQPOCDVRNVBQE-HXUWFJFHSA-N 1 1 407.465 3.138 20 0 HGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@]2(CCCN(c3ncc(C(F)F)cn3)C2)C1 ZINC001164785316 721374071 /nfs/dbraw/zinc/37/40/71/721374071.db2.gz UKQPOCDVRNVBQE-HXUWFJFHSA-N 1 1 407.465 3.138 20 0 HGADMO C[NH+]1CCN(C[C@H]2CCC[C@@]3(CCN(C(F)(F)c4ccnc(Cl)c4)C3)O2)CC1 ZINC001164885630 721382618 /nfs/dbraw/zinc/38/26/18/721382618.db2.gz CVSHCMBBRZJAEI-MJGOQNOKSA-N 1 1 414.928 3.045 20 0 HGADMO C[NH+]1CCN(C[C@H]2CCC[C@]3(CCN(C(F)(F)c4ccnc(Cl)c4)C3)O2)CC1 ZINC001164885628 721382752 /nfs/dbraw/zinc/38/27/52/721382752.db2.gz CVSHCMBBRZJAEI-IEBWSBKVSA-N 1 1 414.928 3.045 20 0 HGADMO C[NH+]1CCN(C[C@@H]2CCC[C@@]3(CCN(c4cc(Oc5ccccc5)ncn4)C3)O2)CC1 ZINC001164886705 721392915 /nfs/dbraw/zinc/39/29/15/721392915.db2.gz FOFLYFVHZQVWKL-URXFXBBRSA-N 1 1 423.561 3.034 20 0 HGADMO O=C(NC1CCCCC1)c1cccnc1N1C[C@H]2C[NH+](Cc3nccs3)C[C@@H]2C1 ZINC001164782189 721394327 /nfs/dbraw/zinc/39/43/27/721394327.db2.gz FDLZRNDGRBSICO-IAGOWNOFSA-N 1 1 411.575 3.169 20 0 HGADMO CCOC(=O)c1cc(Cl)nc(N2C[C@H]3C[NH+](Cc4nccs4)C[C@@H]3C2)c1C ZINC001164788265 721409280 /nfs/dbraw/zinc/40/92/80/721409280.db2.gz RQTRWNXCEQAEFG-ZIAGYGMSSA-N 1 1 406.939 3.245 20 0 HGADMO CCc1c(Cl)nnc(N2CC[C@@]3(C2)CCC[C@@H](CN2CC[NH+](C)CC2)O3)c1CC ZINC001164884071 721413650 /nfs/dbraw/zinc/41/36/50/721413650.db2.gz DAGHYZMTRIIDNT-HTAPYJJXSA-N 1 1 422.017 3.020 20 0 HGADMO C[NH+]1CCN(C[C@H]2CCC[C@@]3(CCN(c4ncc5c(Cl)cccc5n4)C3)O2)CC1 ZINC001164888975 721417186 /nfs/dbraw/zinc/41/71/86/721417186.db2.gz PVXOBPDAQUMTGT-VGSWGCGISA-N 1 1 415.969 3.049 20 0 HGADMO C[NH+]1CCN(C[C@@H]2CCC[C@@]3(CCN(c4ncc5ccc(Cl)cc5n4)C3)O2)CC1 ZINC001164884551 721419157 /nfs/dbraw/zinc/41/91/57/721419157.db2.gz DUUYYIXZKGTTSW-UGKGYDQZSA-N 1 1 415.969 3.049 20 0 HGADMO C[NH+]1CCN(C[C@H]2CCC[C@@]3(CCN(c4ccc5c(Cl)ccnc5n4)C3)O2)CC1 ZINC001164889524 721419774 /nfs/dbraw/zinc/41/97/74/721419774.db2.gz RJEZUUNNRWPRSH-VGSWGCGISA-N 1 1 415.969 3.049 20 0 HGADMO Clc1nc2c(Cl)nccc2c(N2C[C@@H]3C[N@@H+](Cc4nccs4)C[C@@H]3C2)n1 ZINC001164781531 721424344 /nfs/dbraw/zinc/42/43/44/721424344.db2.gz DUUMSAPODOHYPG-PHIMTYICSA-N 1 1 407.330 3.356 20 0 HGADMO Clc1nc2c(Cl)nccc2c(N2C[C@@H]3C[N@H+](Cc4nccs4)C[C@@H]3C2)n1 ZINC001164781531 721424346 /nfs/dbraw/zinc/42/43/46/721424346.db2.gz DUUMSAPODOHYPG-PHIMTYICSA-N 1 1 407.330 3.356 20 0 HGADMO Cc1nc(N2CC[C@@]3(C2)CCC[C@@H](CN2CC[NH+](C)CC2)O3)c(Cl)cc1Cl ZINC001164893121 721428361 /nfs/dbraw/zinc/42/83/61/721428361.db2.gz JBWMCRYMTYXGMG-OXJNMPFZSA-N 1 1 413.393 3.462 20 0 HGADMO CSc1cc(Cl)cnc1N1CC[C@]2(C1)CCC[C@@H](CN1CC[NH+](C)CC1)O2 ZINC001164898297 721429912 /nfs/dbraw/zinc/42/99/12/721429912.db2.gz VQLKUDZYNWPSNZ-PXNSSMCTSA-N 1 1 411.015 3.222 20 0 HGADMO COc1ccc(-c2ccc(N3C[C@@H]4C[N@@H+](Cc5nccs5)C[C@@H]4C3)nn2)c(OC)c1 ZINC001164790968 721431437 /nfs/dbraw/zinc/43/14/37/721431437.db2.gz YTKIFRWYFHWMBI-IYBDPMFKSA-N 1 1 423.542 3.186 20 0 HGADMO COc1ccc(-c2ccc(N3C[C@@H]4C[N@H+](Cc5nccs5)C[C@@H]4C3)nn2)c(OC)c1 ZINC001164790968 721431438 /nfs/dbraw/zinc/43/14/38/721431438.db2.gz YTKIFRWYFHWMBI-IYBDPMFKSA-N 1 1 423.542 3.186 20 0 HGADMO COc1ccc(-c2ccc(N3C[C@H]4C[NH+](Cc5nccs5)C[C@@H]4C3)nn2)c(OC)c1 ZINC001164790966 721431503 /nfs/dbraw/zinc/43/15/03/721431503.db2.gz YTKIFRWYFHWMBI-HZPDHXFCSA-N 1 1 423.542 3.186 20 0 HGADMO Cc1cc(OCc2ccccc2)nc(N2C[C@H]3C[NH+](Cc4nccs4)C[C@@H]3C2)n1 ZINC001164785549 721433834 /nfs/dbraw/zinc/43/38/34/721433834.db2.gz NQDARVRIZQQIOJ-RTBURBONSA-N 1 1 407.543 3.389 20 0 HGADMO CCc1nc2sccc2c(N2CC[C@]3(C2)CCC[C@H](CN2CC[NH+](C)CC2)O3)n1 ZINC001164893046 721443815 /nfs/dbraw/zinc/44/38/15/721443815.db2.gz IUOKZBUWNVXQEK-VGSWGCGISA-N 1 1 415.607 3.019 20 0 HGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1nc(C)nc3ccoc31)CC2 ZINC001164786757 721448365 /nfs/dbraw/zinc/44/83/65/721448365.db2.gz NKKVLGZZQSXZPI-IBGZPJMESA-N 1 1 414.550 3.265 20 0 HGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1ncnc3sccc31)CC2 ZINC001164784480 721448447 /nfs/dbraw/zinc/44/84/47/721448447.db2.gz FSAQZNGSWOOIDL-GOSISDBHSA-N 1 1 416.591 3.425 20 0 HGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1nc(C)nc3[nH]ccc31)CC2 ZINC001164783269 721454078 /nfs/dbraw/zinc/45/40/78/721454078.db2.gz AYPBULDLJVNJLA-LJQANCHMSA-N 1 1 413.566 3.000 20 0 HGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1nc(C)c(C)nc1Cl)CC2 ZINC001164787718 721460524 /nfs/dbraw/zinc/46/05/24/721460524.db2.gz RVIIKRCGXJVABQ-LJQANCHMSA-N 1 1 423.001 3.481 20 0 HGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1nc(C)cnc1Cl)CC2 ZINC001164783916 721461042 /nfs/dbraw/zinc/46/10/42/721461042.db2.gz GJMWAZZLHTYQHC-GOSISDBHSA-N 1 1 408.974 3.172 20 0 HGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1ccc(Cl)c(OC)n1)CC2 ZINC001164784417 721464217 /nfs/dbraw/zinc/46/42/17/721464217.db2.gz HVFXKNQWZILRMG-GOSISDBHSA-N 1 1 423.985 3.478 20 0 HGADMO C[N@@H+](Cc1ccc(N2CCCC[C@@]23CC(=O)N(Cc2cccnc2)C3)nc1)C1CC1 ZINC001164897012 721475914 /nfs/dbraw/zinc/47/59/14/721475914.db2.gz ZLLUETDLSAUSTR-DEOSSOPVSA-N 1 1 405.546 3.232 20 0 HGADMO Cn1cnc2c1nc(Cl)nc2N1CCC2(CC([N@@H+](C)Cc3ccncc3)C2)CC1 ZINC001164792284 721494050 /nfs/dbraw/zinc/49/40/50/721494050.db2.gz MZBGWXLEWBAOOW-UHFFFAOYSA-N 1 1 411.941 3.293 20 0 HGADMO CCOC(=O)c1cnc(N2CCC3(CC([N@@H+](C)Cc4ccncc4)C3)CC2)nc1C ZINC001164792962 721494824 /nfs/dbraw/zinc/49/48/24/721494824.db2.gz WJKGUSLKEBMWOE-UHFFFAOYSA-N 1 1 409.534 3.238 20 0 HGADMO CCOC(=O)c1c(C)ncnc1N1CCC2(CC([N@@H+](C)Cc3ccncc3)C2)CC1 ZINC001164792022 721495934 /nfs/dbraw/zinc/49/59/34/721495934.db2.gz JZZOBXMJKGUINT-UHFFFAOYSA-N 1 1 409.534 3.238 20 0 HGADMO CCOC(=O)c1cnc(Cl)cc1N1CC[N@H+]2C[C@@H](Oc3cccc(F)c3)C[C@H]2C1 ZINC001164900770 721509634 /nfs/dbraw/zinc/50/96/34/721509634.db2.gz UPMJXLAHOJDIBS-RDJZCZTQSA-N 1 1 419.884 3.393 20 0 HGADMO COC(=O)c1cc(Cl)nc(N2CC[N@H+]3C[C@H](Oc4cccc(F)c4)C[C@H]3C2)c1 ZINC001164900660 721514329 /nfs/dbraw/zinc/51/43/29/721514329.db2.gz SORNLRDCRBXZTC-DOTOQJQBSA-N 1 1 405.857 3.003 20 0 HGADMO Cc1nc(Cl)cc(C(F)(F)N2CC[N@H+]3C[C@@H](Oc4cccc(F)c4)C[C@@H]3C2)n1 ZINC001164900722 721519527 /nfs/dbraw/zinc/51/95/27/721519527.db2.gz UIIBTKRANSXKAN-ZBFHGGJFSA-N 1 1 412.843 3.464 20 0 HGADMO COc1cc2ncnc(N3CC[N@H+]4C[C@@H](Oc5cccc(F)c5)C[C@@H]4C3)c2cc1OC ZINC001164900990 721519776 /nfs/dbraw/zinc/51/97/76/721519776.db2.gz VLUKZVTXLUJMKL-AEFFLSMTSA-N 1 1 424.476 3.128 20 0 HGADMO COC(=O)c1cc(Cl)cc(N2CC[N@H+]3C[C@@H](Oc4cccc(F)c4)C[C@@H]3C2)n1 ZINC001164901430 721520719 /nfs/dbraw/zinc/52/07/19/721520719.db2.gz XEWUYJGOTCXPSQ-WBVHZDCISA-N 1 1 405.857 3.003 20 0 HGADMO Cc1cc(C(F)(F)N2CC[N@H+]3C[C@H](Oc4cccc(F)c4)C[C@H]3C2)nc(Cl)n1 ZINC001164900060 721526057 /nfs/dbraw/zinc/52/60/57/721526057.db2.gz NQMQYYMTWWTZDC-GOEBONIOSA-N 1 1 412.843 3.464 20 0 HGADMO Fc1cccc(O[C@@H]2C[C@@H]3CN(c4nc(Cl)nc5c4SCC5)CC[N@H+]3C2)c1 ZINC001164903952 721527160 /nfs/dbraw/zinc/52/71/60/721527160.db2.gz DLAYVFCHLRUCMD-UKRRQHHQSA-N 1 1 406.914 3.259 20 0 HGADMO Fc1cccc(O[C@H]2C[C@@H]3CN(c4nnc(Cl)c5c4CCCC5)CC[N@H+]3C2)c1 ZINC001164903491 721530124 /nfs/dbraw/zinc/53/01/24/721530124.db2.gz CZPYLHOLKLCNHH-WBVHZDCISA-N 1 1 402.901 3.490 20 0 HGADMO CC(C)(C)NC(=O)c1ccc(N2CC[N@H+]3C[C@H](Oc4cccc(F)c4)C[C@H]3C2)nc1 ZINC001164904719 721534628 /nfs/dbraw/zinc/53/46/28/721534628.db2.gz GBYGUXCSQMWERI-AZUAARDMSA-N 1 1 412.509 3.091 20 0 HGADMO COc1nc(-c2ccccc2)nc(N2CC[N@H+]3C[C@@H](Oc4cccc(F)c4)C[C@H]3C2)n1 ZINC001164902669 721541409 /nfs/dbraw/zinc/54/14/09/721541409.db2.gz AWMJRDQWTQMBSY-ICSRJNTNSA-N 1 1 421.476 3.028 20 0 HGADMO CCOc1cc(Cl)nc(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@H]3OCCC[C@@H]32)c1 ZINC001164799064 721550997 /nfs/dbraw/zinc/55/09/97/721550997.db2.gz ALIUVTURERXYMV-WFXMLNOXSA-N 1 1 402.926 3.397 20 0 HGADMO Cc1cc(N2CC[N@H+]3C[C@H](Oc4cccc(F)c4)C[C@H]3C2)nc(-c2ccccn2)n1 ZINC001164906470 721552781 /nfs/dbraw/zinc/55/27/81/721552781.db2.gz JKGMXHZCICPKSG-AZUAARDMSA-N 1 1 405.477 3.328 20 0 HGADMO CC1CCN(c2ccc(N3CC[N@H+]4C[C@H](Oc5cccc(F)c5)C[C@@H]4C3)nn2)CC1 ZINC001164911666 721554961 /nfs/dbraw/zinc/55/49/61/721554961.db2.gz ZKJCFWBXWLRIKU-TZIWHRDSSA-N 1 1 411.525 3.194 20 0 HGADMO Fc1cccc(O[C@@H]2C[C@H]3CN(c4cncc(N5CCCCCC5)n4)CC[N@H+]3C2)c1 ZINC001164903542 721559966 /nfs/dbraw/zinc/55/99/66/721559966.db2.gz CCYWJVDAFZZQBQ-PZJWPPBQSA-N 1 1 411.525 3.338 20 0 HGADMO Fc1cccc(O[C@H]2C[C@H]3CN(c4cc(-c5nc(C6CC6)no5)ccn4)CC[N@H+]3C2)c1 ZINC001164910447 721562887 /nfs/dbraw/zinc/56/28/87/721562887.db2.gz WZIMIDPETLMIQL-ICSRJNTNSA-N 1 1 421.476 3.490 20 0 HGADMO CCCSc1ncnc(N2CC[N@H+]3C[C@H](Oc4cccc(F)c4)C[C@@H]3C2)c1OC ZINC001164904212 721566213 /nfs/dbraw/zinc/56/62/13/721566213.db2.gz DJIZPNFNEZLRPQ-SJLPKXTDSA-N 1 1 418.538 3.468 20 0 HGADMO Fc1cccc(O[C@H]2C[C@@H]3CN(c4nc5c(nc4Cl)CCCC5)CC[N@H+]3C2)c1 ZINC001164910243 721566794 /nfs/dbraw/zinc/56/67/94/721566794.db2.gz WBZZRNNGKPMKIH-WBVHZDCISA-N 1 1 402.901 3.490 20 0 HGADMO CCCN(CCC)c1cc(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@@H]32)ncn1 ZINC001164802910 721567199 /nfs/dbraw/zinc/56/71/99/721567199.db2.gz ISLDEUIWUIXTSY-AWRGLXIESA-N 1 1 424.593 3.366 20 0 HGADMO COc1cc(C)c2ncnc(N3CC[N@H+]4C[C@@H](Oc5cccc(F)c5)C[C@@H]4C3)c2c1 ZINC001164903499 721568724 /nfs/dbraw/zinc/56/87/24/721568724.db2.gz BODFJROYDKXBPS-XLIONFOSSA-N 1 1 408.477 3.428 20 0 HGADMO Cc1ccc(-c2ccc(N3C[C@H]([N@H+](C)Cc4cccnc4)[C@@H]4OCCC[C@@H]43)nn2)o1 ZINC001164810227 721583807 /nfs/dbraw/zinc/58/38/07/721583807.db2.gz VGNJLHUGTJENRA-SXWKCWPCSA-N 1 1 405.502 3.308 20 0 HGADMO Cc1ccc(-c2ccc(N3C[C@H]([N@@H+](C)Cc4cccnc4)[C@@H]4OCCC[C@@H]43)nn2)o1 ZINC001164810227 721583808 /nfs/dbraw/zinc/58/38/08/721583808.db2.gz VGNJLHUGTJENRA-SXWKCWPCSA-N 1 1 405.502 3.308 20 0 HGADMO COC(=O)c1cc(F)cnc1N1CCC(F)(F)[C@]2(CC[N@@H+](Cc3ccccn3)C2)C1 ZINC001164903575 721585429 /nfs/dbraw/zinc/58/54/29/721585429.db2.gz AIWXNFJGNGXVRY-FQEVSTJZSA-N 1 1 420.435 3.140 20 0 HGADMO FC1(F)CCN(c2cc(OCC3CC3)ncn2)C[C@@]12CC[N@@H+](Cc1ccccn1)C2 ZINC001164904823 721711443 /nfs/dbraw/zinc/71/14/43/721711443.db2.gz DGJZLAUGXCGDBT-NRFANRHFSA-N 1 1 415.488 3.398 20 0 HGADMO CN(C)C(=O)C[NH+]1CCC2(CCCN2C(F)(F)c2cc(Cl)nc(Cl)c2)CC1 ZINC001165007408 721730968 /nfs/dbraw/zinc/73/09/68/721730968.db2.gz CKUWYCSOQKLXEL-UHFFFAOYSA-N 1 1 421.319 3.456 20 0 HGADMO CN(C)C(=O)CN1CCC2(CCCN2c2[nH+]c(N3CCCC3)cc3ccccc32)CC1 ZINC001165011002 721746021 /nfs/dbraw/zinc/74/60/21/721746021.db2.gz SFBGDRBSULJPMS-UHFFFAOYSA-N 1 1 421.589 3.358 20 0 HGADMO COC(=O)c1cnc(N2CCc3c(C[N@H+](C)Cc4ccco4)cncc3C2)c(C)c1 ZINC001164908244 721751259 /nfs/dbraw/zinc/75/12/59/721751259.db2.gz GBZJPIAIJAQHDR-UHFFFAOYSA-N 1 1 406.486 3.359 20 0 HGADMO COC(=O)c1cnc(N2CCc3c(C[N@@H+](C)Cc4ccco4)cncc3C2)c(C)c1 ZINC001164908244 721751265 /nfs/dbraw/zinc/75/12/65/721751265.db2.gz GBZJPIAIJAQHDR-UHFFFAOYSA-N 1 1 406.486 3.359 20 0 HGADMO COC(=O)c1cc(N2CCc3c(C[N@H+](C)Cc4ccco4)cncc3C2)ncc1C ZINC001164911709 721756381 /nfs/dbraw/zinc/75/63/81/721756381.db2.gz XPCVYDCWRJXLMO-UHFFFAOYSA-N 1 1 406.486 3.359 20 0 HGADMO COC(=O)c1cc(N2CCc3c(C[N@@H+](C)Cc4ccco4)cncc3C2)ncc1C ZINC001164911709 721756384 /nfs/dbraw/zinc/75/63/84/721756384.db2.gz XPCVYDCWRJXLMO-UHFFFAOYSA-N 1 1 406.486 3.359 20 0 HGADMO C[N@H+](Cc1ccco1)Cc1cncc2c1CCN(c1ncc3ncnc(Cl)c3n1)C2 ZINC001164910766 721758169 /nfs/dbraw/zinc/75/81/69/721758169.db2.gz REPFZQCKVRKXAG-UHFFFAOYSA-N 1 1 421.892 3.256 20 0 HGADMO C[N@@H+](Cc1ccco1)Cc1cncc2c1CCN(c1ncc3ncnc(Cl)c3n1)C2 ZINC001164910766 721758172 /nfs/dbraw/zinc/75/81/72/721758172.db2.gz REPFZQCKVRKXAG-UHFFFAOYSA-N 1 1 421.892 3.256 20 0 HGADMO C[N@H+](Cc1ccco1)Cc1cncc2c1CCN([C@@H](F)Oc1ccc(Cl)nn1)C2 ZINC001164911613 721766470 /nfs/dbraw/zinc/76/64/70/721766470.db2.gz PUMHSOILVNZHSL-HXUWFJFHSA-N 1 1 417.872 3.440 20 0 HGADMO C[N@@H+](Cc1ccco1)Cc1cncc2c1CCN([C@@H](F)Oc1ccc(Cl)nn1)C2 ZINC001164911613 721766473 /nfs/dbraw/zinc/76/64/73/721766473.db2.gz PUMHSOILVNZHSL-HXUWFJFHSA-N 1 1 417.872 3.440 20 0 HGADMO Clc1ccc2ccnc(N3CCO[C@@]4(C3)COCC[N@H+](Cc3cccnc3)C4)c2c1 ZINC001164912713 721778147 /nfs/dbraw/zinc/77/81/47/721778147.db2.gz OVRNBQONTCQJME-QHCPKHFHSA-N 1 1 424.932 3.391 20 0 HGADMO Clc1ccc2ccnc(N3CCO[C@@]4(C3)COCC[N@@H+](Cc3cccnc3)C4)c2c1 ZINC001164912713 721778152 /nfs/dbraw/zinc/77/81/52/721778152.db2.gz OVRNBQONTCQJME-QHCPKHFHSA-N 1 1 424.932 3.391 20 0 HGADMO Clc1cccc2ccnc(N3CCO[C@@]4(C3)COCC[N@H+](Cc3cccnc3)C4)c12 ZINC001164916017 721783900 /nfs/dbraw/zinc/78/39/00/721783900.db2.gz NPVTYEDADIHKHE-QHCPKHFHSA-N 1 1 424.932 3.391 20 0 HGADMO Clc1cccc2ccnc(N3CCO[C@@]4(C3)COCC[N@@H+](Cc3cccnc3)C4)c12 ZINC001164916017 721783903 /nfs/dbraw/zinc/78/39/03/721783903.db2.gz NPVTYEDADIHKHE-QHCPKHFHSA-N 1 1 424.932 3.391 20 0 HGADMO C[C@@H]1CC(=O)Nc2ncnc(N3C[C@@H]4CCC[C@H]([N@@H+](C)Cc5ccccn5)[C@@H]4C3)c21 ZINC001165026517 721813281 /nfs/dbraw/zinc/81/32/81/721813281.db2.gz QYQFXNDNSOYREK-JFRXWTBNSA-N 1 1 406.534 3.054 20 0 HGADMO CCOC(=O)c1cnc(N2C[C@@H]3CCC[C@@H]([N@@H+](C)Cc4ccccn4)[C@H]3C2)c(OC)c1 ZINC001165024231 721817179 /nfs/dbraw/zinc/81/71/79/721817179.db2.gz KAAQAKQEIUTMLT-DZFGPLHGSA-N 1 1 424.545 3.399 20 0 HGADMO C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@H]2CN(c3ncc4ncnc(Cl)c4n3)C[C@H]21 ZINC001165025512 721818273 /nfs/dbraw/zinc/81/82/73/721818273.db2.gz NCKBCHPIQQJJFL-YXJHDRRASA-N 1 1 409.925 3.205 20 0 HGADMO C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@H]2CN(c3ncnc4c3ncn4C3CC3)C[C@H]21 ZINC001165024438 721825036 /nfs/dbraw/zinc/82/50/36/721825036.db2.gz JVRSQVFZMPNRPB-PWIZWCRZSA-N 1 1 403.534 3.293 20 0 HGADMO COc1nc(N2C[C@@H]3CCC[C@H]([N@@H+](C)Cc4ccccn4)[C@@H]3C2)nc2c1ccn2C ZINC001165027003 721830524 /nfs/dbraw/zinc/83/05/24/721830524.db2.gz QSMONAAGPFMQMG-DBVUQKKJSA-N 1 1 406.534 3.109 20 0 HGADMO C[NH+]1CCN(c2nccc(N3CCC(Oc4ccc(F)cc4Cl)CC3)n2)CC1 ZINC001165033463 721880265 /nfs/dbraw/zinc/88/02/65/721880265.db2.gz QBVHSWTWRQOTDT-UHFFFAOYSA-N 1 1 405.905 3.069 20 0 HGADMO Cc1ccc(C[N@H+]2CCOC3(CCN(c4nccc(N5CCCC5)n4)CC3)C2)cc1 ZINC001164938430 721919792 /nfs/dbraw/zinc/91/97/92/721919792.db2.gz OEDBCUNLDKBJCK-UHFFFAOYSA-N 1 1 407.562 3.257 20 0 HGADMO COC(=O)c1cc(C)nc(N2CCC3(CC2)C[N@@H+](Cc2ccc(C)cc2)CCO3)c1 ZINC001164937322 721920976 /nfs/dbraw/zinc/92/09/76/721920976.db2.gz BYBGNNZJYUKBAZ-UHFFFAOYSA-N 1 1 409.530 3.356 20 0 HGADMO COC(=O)c1ccnc(N2CCC3(CC2)C[N@@H+](Cc2ccc(C)cc2)CCO3)c1C ZINC001164939389 721924013 /nfs/dbraw/zinc/92/40/13/721924013.db2.gz LHJZITBBQXAZGT-UHFFFAOYSA-N 1 1 409.530 3.356 20 0 HGADMO Clc1nc2[nH]ccc2c(N2CCC3(CC2)COCC[N@@H+](Cc2ccncc2)C3)n1 ZINC001164961909 722051731 /nfs/dbraw/zinc/05/17/31/722051731.db2.gz YBWWVFXXOSQTCW-UHFFFAOYSA-N 1 1 412.925 3.125 20 0 HGADMO CC(C)(C)Oc1ccnc(N2CCC3(CC2)COCC[N@@H+](Cc2ccncc2)C3)n1 ZINC001164962554 722056234 /nfs/dbraw/zinc/05/62/34/722056234.db2.gz FLGHUYULHIUXSB-UHFFFAOYSA-N 1 1 411.550 3.168 20 0 HGADMO CSc1cnc(Cl)c(N2CCC3(CC2)COCC[N@@H+](Cc2ccncc2)C3)n1 ZINC001164961514 722058724 /nfs/dbraw/zinc/05/87/24/722058724.db2.gz LDDBPCMAZLJDLZ-UHFFFAOYSA-N 1 1 419.982 3.366 20 0 HGADMO c1ccc(-c2ccc(N3CCC4(CC3)COCC[N@H+](Cc3ccncc3)C4)nn2)nc1 ZINC001164959957 722061041 /nfs/dbraw/zinc/06/10/41/722061041.db2.gz AKWBMVPTMVIBLP-UHFFFAOYSA-N 1 1 416.529 3.053 20 0 HGADMO O=C(c1cscn1)N1CC[C@@H]2[C@H]1CCN2c1nc(Cl)ccc1C[NH+]1CCCC1 ZINC001164964512 722064740 /nfs/dbraw/zinc/06/47/40/722064740.db2.gz HEWDDTAYNGJUMG-IAGOWNOFSA-N 1 1 417.966 3.281 20 0 HGADMO FC(F)(c1ccc(Cl)nc1)N1CC[C@@H]2C[N@@H+](Cc3cccnc3)CCO[C@H]2C1 ZINC001164981346 722098682 /nfs/dbraw/zinc/09/86/82/722098682.db2.gz LDPSFBSEVXSMBQ-AEFFLSMTSA-N 1 1 408.880 3.402 20 0 HGADMO Clc1nc2c(c(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)n1)CCCC2 ZINC001164977272 722106294 /nfs/dbraw/zinc/10/62/94/722106294.db2.gz FNLXKACDCJSQBV-XLIONFOSSA-N 1 1 413.953 3.131 20 0 HGADMO Clc1cccc2ncc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)nc12 ZINC001164983506 722106705 /nfs/dbraw/zinc/10/67/05/722106705.db2.gz QNJNVRYHKZSXRX-YLJYHZDGSA-N 1 1 409.921 3.406 20 0 HGADMO c1ccc(Oc2ccnc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)n2)cc1 ZINC001164982319 722107359 /nfs/dbraw/zinc/10/73/59/722107359.db2.gz NMVFDZGZONEXKE-IRLDBZIGSA-N 1 1 417.513 3.391 20 0 HGADMO FC(F)(Oc1ccc(Cl)nc1)N1CC[C@@H]2C[N@@H+](Cc3cccnc3)CCO[C@@H]2C1 ZINC001164978306 722108819 /nfs/dbraw/zinc/10/88/19/722108819.db2.gz OKKUUVULGLIBMY-SJLPKXTDSA-N 1 1 424.879 3.282 20 0 HGADMO Clc1nnc(N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)c2c1CCCC2 ZINC001164970860 722112718 /nfs/dbraw/zinc/11/27/18/722112718.db2.gz AAQIZFWVPWVFFF-XLIONFOSSA-N 1 1 413.953 3.131 20 0 HGADMO Clc1ccc2nc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)ncc2c1 ZINC001164978164 722122449 /nfs/dbraw/zinc/12/24/49/722122449.db2.gz NQRBQGKZUNNZGO-UWJYYQICSA-N 1 1 409.921 3.406 20 0 HGADMO CCc1nc2sccc2c(N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)n1 ZINC001164980959 722150495 /nfs/dbraw/zinc/15/04/95/722150495.db2.gz OFZWXTHKQZPEDM-PKOBYXMFSA-N 1 1 409.559 3.376 20 0 HGADMO CSc1ccc2ncnc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)c2c1 ZINC001164972554 722154228 /nfs/dbraw/zinc/15/42/28/722154228.db2.gz IKCCJTLQNCHQCS-AVRDEDQJSA-N 1 1 421.570 3.474 20 0 HGADMO CCc1nc(N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)c(Cl)nc1C ZINC001164977118 722157416 /nfs/dbraw/zinc/15/74/16/722157416.db2.gz XDOOGRVXRNEYKK-PKOBYXMFSA-N 1 1 401.942 3.123 20 0 HGADMO COc1cc(C)c2ncnc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)c2c1 ZINC001164977127 722158616 /nfs/dbraw/zinc/15/86/16/722158616.db2.gz XGNKTHHMCOIOAQ-UGKGYDQZSA-N 1 1 419.529 3.069 20 0 HGADMO CNC(=O)c1nc(N2CCC[C@]3(CC[N@H+]3Cc3cccc(F)c3)C2)ccc1Cl ZINC001164995674 722203482 /nfs/dbraw/zinc/20/34/82/722203482.db2.gz PAQZSTGZGMIMBJ-NRFANRHFSA-N 1 1 402.901 3.479 20 0 HGADMO COC(OC)c1c(CO)ccnc1N1CCC[C@@]2(CC[N@H+]2Cc2cccc(F)c2)C1 ZINC001164997252 722206074 /nfs/dbraw/zinc/20/60/74/722206074.db2.gz XQFQBZKFEBBYHV-HSZRJFAPSA-N 1 1 415.509 3.249 20 0 HGADMO C[NH+]1CCN(c2ncnc3c2CCN(c2cc(Cl)nc4ccsc42)CC3)CC1 ZINC001164997613 722232417 /nfs/dbraw/zinc/23/24/17/722232417.db2.gz QXSMWIGXGIYQLI-UHFFFAOYSA-N 1 1 414.966 3.097 20 0 HGADMO Cc1c(Cl)ccc2ccc(N3CCc4ncnc(N5CC[NH+](C)CC5)c4CC3)nc21 ZINC001164996732 722236106 /nfs/dbraw/zinc/23/61/06/722236106.db2.gz IOQBATGLZOMUDR-UHFFFAOYSA-N 1 1 422.964 3.344 20 0 HGADMO C[C@](CO)(Cc1ccccc1F)[NH2+]Cc1nc2sc3c(c2c(N)n1)CCCC3 ZINC001176587218 1126149669 /nfs/dbraw/zinc/14/96/69/1126149669.db2.gz HMMPLMDDZINWJX-OAQYLSRUSA-N 1 1 400.523 3.375 20 0 HGADMO C[C@](CO)(Cc1ccc(Br)cc1)[NH2+]Cc1nnc(C(F)(F)F)s1 ZINC001176588621 1126149793 /nfs/dbraw/zinc/14/97/93/1126149793.db2.gz UIXZFGOTABLKSL-CYBMUJFWSA-N 1 1 410.259 3.403 20 0 HGADMO C[C@@](CO)(Cc1ccc(Br)cc1)[NH2+]Cc1nnc(-c2cccc(O)c2)o1 ZINC001198219714 1126155012 /nfs/dbraw/zinc/15/50/12/1126155012.db2.gz RNERQBDCMZISOP-IBGZPJMESA-N 1 1 418.291 3.288 20 0 HGADMO Cc1cncc(-c2nc(C[NH2+][C@](C)(CO)Cc3ccc(Br)cc3)no2)c1 ZINC001308117762 1126163555 /nfs/dbraw/zinc/16/35/55/1126163555.db2.gz LYINYBGGKQUSDM-IBGZPJMESA-N 1 1 417.307 3.286 20 0 HGADMO COc1ccc(C[C@@](C)(CO)[NH2+]Cc2nnc(-c3cccc(Cl)c3)o2)cc1OC ZINC001560185625 1126209934 /nfs/dbraw/zinc/20/99/34/1126209934.db2.gz WJIRRBGLQSFRQZ-NRFANRHFSA-N 1 1 417.893 3.491 20 0 HGADMO Cc1noc([C@@H]2C[C@@H]3CCN(c4nc(Cl)ccc4C[NH+]4CCCC4)C[C@@H]3O2)n1 ZINC001164648047 719299775 /nfs/dbraw/zinc/29/97/75/719299775.db2.gz FQIOFNKJKNQWOY-XIRDDKMYSA-N 1 1 403.914 3.379 20 0 HGADMO CC(C)n1nc(C[NH+](C)C)c2c1CN(c1cncc(OCc3ccccc3)n1)CC2 ZINC001164646766 719308412 /nfs/dbraw/zinc/30/84/12/719308412.db2.gz GVEOPYOAHPZZHE-UHFFFAOYSA-N 1 1 406.534 3.457 20 0 HGADMO CC(C)n1nc(C[NH+](C)C)c2c1CN(c1nc(-c3cccnc3)nc3c1CCC3)CC2 ZINC001164653641 719316566 /nfs/dbraw/zinc/31/65/66/719316566.db2.gz YOPRUZSTOXCHDP-UHFFFAOYSA-N 1 1 417.561 3.429 20 0 HGADMO C[NH+]1CCC(Oc2ccnc(N3CCO[C@@H]4[C@@H](OCC5CCCC5)CC[C@@H]43)c2)CC1 ZINC001164662107 719343971 /nfs/dbraw/zinc/34/39/71/719343971.db2.gz NEDPXZALSQKJPU-FIXSFTCYSA-N 1 1 415.578 3.498 20 0 HGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2C[C@H](C(=O)N3CCCC3)C[C@@H]3OCC[C@H]32)nc1 ZINC001164679416 719544534 /nfs/dbraw/zinc/54/45/34/719544534.db2.gz ZXSOFUJDVQGBFG-YSFYHYPLSA-N 1 1 412.578 3.235 20 0 HGADMO CNC(=O)C[N@H+]1CCCC12CCN(C(F)(F)c1nc3ccccc3nc1Cl)CC2 ZINC001164687439 719727779 /nfs/dbraw/zinc/72/77/79/719727779.db2.gz XKMIIHXQIPZQJI-UHFFFAOYSA-N 1 1 423.895 3.009 20 0 HGADMO CNC(=O)C[N@H+]1CCCC12CCN(c1nc(C)nc3sc4c(c31)CCCC4)CC2 ZINC001164690236 719740570 /nfs/dbraw/zinc/74/05/70/719740570.db2.gz WLSRSTZRLALVMM-UHFFFAOYSA-N 1 1 413.591 3.059 20 0 HGADMO CNC(=O)C[N@H+]1CCCC12CCN(C(F)(F)C1(c3ccc(Cl)nc3)CC1)CC2 ZINC001164690924 719754456 /nfs/dbraw/zinc/75/44/56/719754456.db2.gz IXANYTCPIYLRKY-UHFFFAOYSA-N 1 1 412.912 3.036 20 0 HGADMO CCOC(=O)c1cc(C)nc(N2CCC3(CCC[N@H+]3Cc3csc(C)n3)CC2)n1 ZINC001164694093 719806477 /nfs/dbraw/zinc/80/64/77/719806477.db2.gz USHNOWWYXWQWKP-UHFFFAOYSA-N 1 1 415.563 3.362 20 0 HGADMO Cc1nc(C[N@H+]2CCCC23CCN(c2ccnc(-n4ccccc4=O)n2)CC3)cs1 ZINC001164693726 719814714 /nfs/dbraw/zinc/81/47/14/719814714.db2.gz YJSZBJJBMZJINF-UHFFFAOYSA-N 1 1 422.558 3.027 20 0 HGADMO c1csc(C[N@H+]2CCOC3(CCN(c4cc(OCC5CC5)ncn4)CC3)C2)c1 ZINC001164698162 719894253 /nfs/dbraw/zinc/89/42/53/719894253.db2.gz PCOLKOMEZNNOCN-UHFFFAOYSA-N 1 1 400.548 3.198 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1nc(Cl)nc3ccc(OC)cc31)C2 ZINC001164806701 720067878 /nfs/dbraw/zinc/06/78/78/720067878.db2.gz CZRAGUULRXMHCF-AOMKIAJQSA-N 1 1 416.953 3.477 20 0 HGADMO CCOC(=O)c1cnc(Cl)cc1N1CC[C@]2(C1)C[N@@H+](CC1CC1)C[C@@H]2COC ZINC001164809743 720069617 /nfs/dbraw/zinc/06/96/17/720069617.db2.gz JTEUMGUEMNZPKX-IIBYNOLFSA-N 1 1 407.942 3.096 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(C(F)(F)c1nc(C)cc(Cl)n1)C2 ZINC001164808466 720074525 /nfs/dbraw/zinc/07/45/25/720074525.db2.gz HNKACJFYGKLUHU-MAUKXSAKSA-N 1 1 400.901 3.168 20 0 HGADMO CCC[N@H+]1CCCC[C@@H]1c1ccc(N2CC[C@@H]3[C@H]2CC(=O)N3c2cnn(C)c2)nc1 ZINC001164711313 720076419 /nfs/dbraw/zinc/07/64/19/720076419.db2.gz LJWZBAURNXBAQN-NJDAHSKKSA-N 1 1 408.550 3.136 20 0 HGADMO COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1ncnc3[nH]cc(C)c31)CC2 ZINC001164710024 720093183 /nfs/dbraw/zinc/09/31/83/720093183.db2.gz FQTXASCLBOPQCU-LJQANCHMSA-N 1 1 406.534 3.169 20 0 HGADMO COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1nc(C)ccc1C(=O)OC)CC2 ZINC001164711624 720099780 /nfs/dbraw/zinc/09/97/80/720099780.db2.gz RSYZWPYZZWESGR-HXUWFJFHSA-N 1 1 424.545 3.079 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1nccc3cc(C(=O)OC)ccc31)C2 ZINC001164811111 720103255 /nfs/dbraw/zinc/10/32/55/720103255.db2.gz LKQZIQSLEWFUJS-GBXCKJPGSA-N 1 1 409.530 3.206 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1ccc3cc(C(=O)OC)ccc3n1)C2 ZINC001164813285 720105682 /nfs/dbraw/zinc/10/56/82/720105682.db2.gz QAIKOXWVALCBNM-YKSBVNFPSA-N 1 1 409.530 3.206 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(C(F)(F)COc1ccnc(Cl)c1)C2 ZINC001164812033 720110192 /nfs/dbraw/zinc/11/01/92/720110192.db2.gz OBLBPSQNMKJCCW-QFBILLFUSA-N 1 1 415.912 3.387 20 0 HGADMO COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1c(Cl)nncc1OC)CC2 ZINC001164718078 720116780 /nfs/dbraw/zinc/11/67/80/720116780.db2.gz RLELJDPBQCNVDP-KRWDZBQOSA-N 1 1 417.941 3.041 20 0 HGADMO COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1cc(C)cc(C(=O)OC)n1)CC2 ZINC001164719610 720127045 /nfs/dbraw/zinc/12/70/45/720127045.db2.gz ZOGHEVMCKVZWGJ-HXUWFJFHSA-N 1 1 424.545 3.079 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(C(F)(F)c1cc(N)cc(Cl)n1)C2 ZINC001164816230 720129287 /nfs/dbraw/zinc/12/92/87/720129287.db2.gz YOLYTZNMKNFIEW-KDOFPFPSSA-N 1 1 400.901 3.047 20 0 HGADMO CCOC(=O)c1nc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COC)ccc1Cl ZINC001164815075 720150738 /nfs/dbraw/zinc/15/07/38/720150738.db2.gz HWCQOWSZGLJGGP-IIBYNOLFSA-N 1 1 407.942 3.096 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1ccc(-c3ccc(OC)cc3)nn1)C2 ZINC001164817195 720164710 /nfs/dbraw/zinc/16/47/10/720164710.db2.gz OTCRJFQTJMZFGJ-RDPSFJRHSA-N 1 1 408.546 3.337 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1cc(-c3ccc(OC)cc3)ncn1)C2 ZINC001164817858 720175110 /nfs/dbraw/zinc/17/51/10/720175110.db2.gz QNHPFGMKNFGVBP-HYBUGGRVSA-N 1 1 408.546 3.337 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1cc(-c3nc(C(C)C)no3)ccn1)C2 ZINC001164820243 720184711 /nfs/dbraw/zinc/18/47/11/720184711.db2.gz ZVRWIEUFNGPLRZ-AUSIDOKSSA-N 1 1 411.550 3.440 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1ccc3c(cc(OC)cc3OC)n1)C2 ZINC001164815188 720194841 /nfs/dbraw/zinc/19/48/41/720194841.db2.gz WWCCQCFEMAOHKJ-HOYKHHGWSA-N 1 1 411.546 3.437 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1ccc3c(cc(OC)cc3OC)n1)C2 ZINC001164815192 720194903 /nfs/dbraw/zinc/19/49/03/720194903.db2.gz WWCCQCFEMAOHKJ-MHECFPHRSA-N 1 1 411.546 3.437 20 0 HGADMO CCCSc1ncnc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COC)c1OC ZINC001164812949 720200647 /nfs/dbraw/zinc/20/06/47/720200647.db2.gz NJWFQCURLJXEFK-UTKZUKDTSA-N 1 1 406.596 3.172 20 0 HGADMO CC(C)[N@@H+](C)Cc1cc(=O)n2c(n1)CN(c1nc(Cl)cc3[nH]ccc31)CCC2 ZINC001164811518 720216055 /nfs/dbraw/zinc/21/60/55/720216055.db2.gz JDTJVSCOPFLRLS-UHFFFAOYSA-N 1 1 400.914 3.024 20 0 HGADMO COc1ccc2cnc(N3CCCn4c(=O)cc(C[N@@H+](C)C(C)C)nc4C3)cc2c1 ZINC001164813983 720230055 /nfs/dbraw/zinc/23/00/55/720230055.db2.gz SPVLHKOIBXINHK-UHFFFAOYSA-N 1 1 407.518 3.051 20 0 HGADMO CCOC(=O)c1ccc2ncnc(N3CC[C@@H]4[C@@H]3CC[N@H+]4Cc3cccnc3)c2c1 ZINC001164725352 720385757 /nfs/dbraw/zinc/38/57/57/720385757.db2.gz MTGQAMCJLNXUQJ-RTWAWAEBSA-N 1 1 403.486 3.055 20 0 HGADMO CN(C)c1ccc(-c2ccnc(N3CC[C@H]4[C@H]3CC[N@H+]4Cc3cccnc3)n2)cc1 ZINC001164732822 720421322 /nfs/dbraw/zinc/42/13/22/720421322.db2.gz OINXKEGMBDRKQV-XZOQPEGZSA-N 1 1 400.530 3.458 20 0 HGADMO CC1CCN(C(=O)c2ccc(N3CC[C@H]4[C@@H]3CC[N@H+]4Cc3cccnc3)nc2)CC1 ZINC001164734523 720436410 /nfs/dbraw/zinc/43/64/10/720436410.db2.gz SYKTXNDIVCFIFE-VXKWHMMOSA-N 1 1 405.546 3.202 20 0 HGADMO FC(F)(c1nc2ccc(Cl)nc2[nH]1)N1CC[C@H]2[C@H]1CC[N@@H+]2Cc1cccnc1 ZINC001164727140 720453095 /nfs/dbraw/zinc/45/30/95/720453095.db2.gz DCKMXLAIIGRKSF-LSDHHAIUSA-N 1 1 404.852 3.404 20 0 HGADMO FC(F)(c1nc2ccc(Cl)nc2[nH]1)N1CC[C@H]2[C@H]1CC[N@H+]2Cc1cccnc1 ZINC001164727140 720453104 /nfs/dbraw/zinc/45/31/04/720453104.db2.gz DCKMXLAIIGRKSF-LSDHHAIUSA-N 1 1 404.852 3.404 20 0 HGADMO Cc1cnc(N2CC[C@@H]3[C@H](C[C@@H](Cn4cccn4)[N@@H+]3C(C)C)C2)nc1NCC1CC1 ZINC001164836534 720504862 /nfs/dbraw/zinc/50/48/62/720504862.db2.gz MXTPSYUJSWEXIA-QHAWAJNXSA-N 1 1 409.582 3.181 20 0 HGADMO COC(=O)c1cc(Cl)nc(N2CC[C@@H]3[C@H](C[C@H](Cn4cccn4)[N@H+]3C(C)C)C2)c1 ZINC001164835788 720512766 /nfs/dbraw/zinc/51/27/66/720512766.db2.gz LJTVLUJZNAWZQI-KZNAEPCWSA-N 1 1 417.941 3.096 20 0 HGADMO COC(=O)c1cc(N2CC[C@@H]3[C@H](C[C@H](Cn4cccn4)[N@H+]3C(C)C)C2)ncc1Cl ZINC001164839033 720513134 /nfs/dbraw/zinc/51/31/34/720513134.db2.gz RZWUJGGVJDFNQB-GPMSIDNRSA-N 1 1 417.941 3.096 20 0 HGADMO CC(C)[N@@H+]1[C@@H]2CCN(c3ncnc4nc(Cl)ccc43)C[C@@H]2C[C@H]1Cn1cccn1 ZINC001164834623 720517633 /nfs/dbraw/zinc/51/76/33/720517633.db2.gz GSRLUYKAYDQKHV-XYJFISCASA-N 1 1 411.941 3.253 20 0 HGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@@H]2CN(c3ncnc4nc(Cl)ccc43)CC[C@@H]21 ZINC001164834619 720518325 /nfs/dbraw/zinc/51/83/25/720518325.db2.gz GSRLUYKAYDQKHV-RYRKJORJSA-N 1 1 411.941 3.253 20 0 HGADMO CCOC(=O)c1cnc(N2CC[C@@H]3[C@H](C[C@@H](Cn4cccn4)[N@H+]3C(C)C)C2)c(C)c1 ZINC001164837114 720525255 /nfs/dbraw/zinc/52/52/55/720525255.db2.gz NQBIZDUDJYCQSX-QHAWAJNXSA-N 1 1 411.550 3.141 20 0 HGADMO CC(C)[N@@H+]1[C@@H]2CCN(c3nc4ncccc4nc3Cl)C[C@H]2C[C@H]1Cn1cccn1 ZINC001164843070 720542223 /nfs/dbraw/zinc/54/22/23/720542223.db2.gz ZWDCCNHNKQQDFU-SOLBZPMBSA-N 1 1 411.941 3.253 20 0 HGADMO CSc1cnc(Cl)nc1N1CC[C@@H]2[C@@H](C[C@@H](Cn3cccn3)[N@H+]2C(C)C)C1 ZINC001164833577 720550713 /nfs/dbraw/zinc/55/07/13/720550713.db2.gz AIKRECWEVJRADS-HRCADAONSA-N 1 1 406.987 3.426 20 0 HGADMO COc1nc(N2CC[C@@H]3[C@H](C[C@@H](Cn4cccn4)[N@H+]3C(C)C)C2)nc2ccccc21 ZINC001164833629 720557106 /nfs/dbraw/zinc/55/71/06/720557106.db2.gz AYPQMDKMTCWTHR-LVCYWYKZSA-N 1 1 406.534 3.213 20 0 HGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@@H]2CN(C(F)(F)c3cc(N)cc(Cl)n3)CC[C@@H]21 ZINC001164840184 720560094 /nfs/dbraw/zinc/56/00/94/720560094.db2.gz SBOQOKWMTHRRDP-PVAVHDDUSA-N 1 1 424.927 3.436 20 0 HGADMO CC(C)[N@@H+]1[C@@H]2CCN(c3cc(C(=O)NC(C)(C)C)ccn3)C[C@H]2C[C@H]1Cn1cccn1 ZINC001164839577 720577932 /nfs/dbraw/zinc/57/79/32/720577932.db2.gz QPEIECHPGTVSBS-QHAWAJNXSA-N 1 1 424.593 3.184 20 0 HGADMO CC(C)[N@@H+]1[C@@H]2CCN(c3ccnc(-c4nccs4)n3)C[C@H]2C[C@H]1Cn1cccn1 ZINC001164843202 720648066 /nfs/dbraw/zinc/64/80/66/720648066.db2.gz VDZAAXFRFAMZDO-FGTMMUONSA-N 1 1 409.563 3.174 20 0 HGADMO COc1cnc(SC)nc1N1CCC2(C[C@H]([N@@H+](C)Cc3ccccc3)CO2)CC1 ZINC001164838813 720663220 /nfs/dbraw/zinc/66/32/20/720663220.db2.gz HRCBAJSXCQQBNS-SFHVURJKSA-N 1 1 414.575 3.467 20 0 HGADMO Clc1cccc2c1nc(Cl)nc2N1CC[N@H+]2C[C@H](Oc3cncnc3)C[C@@H]2C1 ZINC001164742030 720682459 /nfs/dbraw/zinc/68/24/59/720682459.db2.gz VLTQBIZZYKXHFY-CHWSQXEVSA-N 1 1 417.300 3.069 20 0 HGADMO CC(C)c1nc(N(C)C)nc(N2CCC3(C[C@@H]([N@@H+](C)Cc4ccccc4)CO3)CC2)n1 ZINC001164842624 720698205 /nfs/dbraw/zinc/69/82/05/720698205.db2.gz LSRAGLGRZGYMAO-HXUWFJFHSA-N 1 1 424.593 3.321 20 0 HGADMO C[N@@H+](Cc1ccccc1)[C@@H]1COC2(C1)CCN(c1ncc(OC(F)F)cn1)CC2 ZINC001164839865 720699216 /nfs/dbraw/zinc/69/92/16/720699216.db2.gz CJZQSTKPVBMBHX-KRWDZBQOSA-N 1 1 404.461 3.338 20 0 HGADMO COc1cnc2c(c1)ncnc2N1CCC2(C[C@@H]([N@@H+](C)Cc3ccccc3)CO2)CC1 ZINC001164839363 720707195 /nfs/dbraw/zinc/70/71/95/720707195.db2.gz LLNINIMVPAUBEL-LJQANCHMSA-N 1 1 419.529 3.293 20 0 HGADMO COc1cc2cnc(Cl)cc2cc1N1CC[N@H+]2C[C@H](Oc3cncnc3)C[C@H]2C1 ZINC001164749822 720807536 /nfs/dbraw/zinc/80/75/36/720807536.db2.gz UPKWFEQHBRGWQG-DLBZAZTESA-N 1 1 411.893 3.029 20 0 HGADMO Clc1cc(Cl)nc(N2CC[C@@H]3[C@H](C[C@@H](Cn4cncn4)[N@H+]3CC3CC3)C2)c1 ZINC001164748929 720810384 /nfs/dbraw/zinc/81/03/84/720810384.db2.gz RXKMCVBQGOYUTL-HYVNUMGLSA-N 1 1 407.349 3.359 20 0 HGADMO Clc1cc(Cl)nc(N2CC[C@@H]3[C@@H](C[C@@H](Cn4cncn4)[N@H+]3CC3CC3)C2)c1 ZINC001164748924 720810416 /nfs/dbraw/zinc/81/04/16/720810416.db2.gz RXKMCVBQGOYUTL-BHYGNILZSA-N 1 1 407.349 3.359 20 0 HGADMO Clc1ccnc2c1ccnc2N1CC[C@@H]2[C@@H](C[C@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164738785 720815497 /nfs/dbraw/zinc/81/54/97/720815497.db2.gz GLOIGAXYFNIEFE-SQGPQFPESA-N 1 1 423.952 3.254 20 0 HGADMO Clc1cc2ccnc(N3CC[C@@H]4[C@@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)c2cn1 ZINC001164738447 720821705 /nfs/dbraw/zinc/82/17/05/720821705.db2.gz FWHHSZVUHFEUTJ-CMKODMSKSA-N 1 1 423.952 3.254 20 0 HGADMO CSc1cc(Cl)ncc1N1CC[C@@H]2[C@@H](C[C@@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164738361 720823899 /nfs/dbraw/zinc/82/38/99/720823899.db2.gz FBECGFCZGHICCU-YESZJQIVSA-N 1 1 418.998 3.428 20 0 HGADMO COCC[N@H+]1CCO[C@H]2CN(c3nc(Cl)nc4ccc(Cl)cc43)CC[C@H]2C1 ZINC001164847924 720832412 /nfs/dbraw/zinc/83/24/12/720832412.db2.gz KYKAGDUIVXLSIR-GUYCJALGSA-N 1 1 411.333 3.110 20 0 HGADMO Fc1ccc2cc(N3CC[C@@H]4[C@@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)ncc2c1 ZINC001164749579 720850111 /nfs/dbraw/zinc/85/01/11/720850111.db2.gz WELZPMATJQDJFZ-ILWGZMRPSA-N 1 1 406.509 3.345 20 0 HGADMO Cc1cc(N2CC[C@@H]3[C@@H](C[C@@H](Cn4cncn4)[N@H+]3CC3CC3)C2)nc(-c2ccco2)n1 ZINC001164751204 720851402 /nfs/dbraw/zinc/85/14/02/720851402.db2.gz QRLMAOUVEKKAED-SLFFLAALSA-N 1 1 419.533 3.016 20 0 HGADMO COCC[N@H+]1CCO[C@H]2CN(c3ncc(OC)c4ccc(Cl)cc43)CC[C@@H]2C1 ZINC001164853125 720855572 /nfs/dbraw/zinc/85/55/72/720855572.db2.gz GNDAZGGNGDGEAD-QRWLVFNGSA-N 1 1 405.926 3.070 20 0 HGADMO COCC[N@H+]1CCO[C@H]2CN(c3nc(C)nc4sc5c(c43)CCCC5)CC[C@@H]2C1 ZINC001164852944 720873795 /nfs/dbraw/zinc/87/37/95/720873795.db2.gz AREQQEACDCQVDM-AEFFLSMTSA-N 1 1 416.591 3.052 20 0 HGADMO CCOc1ccnc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COCc2cccnc2)n1 ZINC001164756817 720884047 /nfs/dbraw/zinc/88/40/47/720884047.db2.gz RDHHMVALLICLTI-XUZZJYLKSA-N 1 1 423.561 3.025 20 0 HGADMO CC(C)[N@@H+](C)Cc1cnc2n1CCN(c1ncccc1C(=O)N1CCCCC1)[C@H]2C ZINC001164859809 720927002 /nfs/dbraw/zinc/92/70/02/720927002.db2.gz QAWCNLSLRRAMRB-SFHVURJKSA-N 1 1 410.566 3.326 20 0 HGADMO c1cncc(COC[C@H]2C[N@@H+](CC3CC3)C[C@@]23CCN(c2cc4c(nn2)CCC4)C3)c1 ZINC001164747943 720929204 /nfs/dbraw/zinc/92/92/04/720929204.db2.gz FAADHLXQEPNGCG-RCZVLFRGSA-N 1 1 419.573 3.115 20 0 HGADMO c1cncc(COC[C@H]2C[N@@H+](CC3CC3)C[C@]23CCN(c2cc4c(nn2)CCC4)C3)c1 ZINC001164747947 720929819 /nfs/dbraw/zinc/92/98/19/720929819.db2.gz FAADHLXQEPNGCG-RDGATRHJSA-N 1 1 419.573 3.115 20 0 HGADMO COC(=O)c1ccc2c(c1)ncnc2N1CCn2c(C[N@@H+](C)C(C)C)cnc2[C@@H]1C ZINC001164856571 720931449 /nfs/dbraw/zinc/93/14/49/720931449.db2.gz KKGARJWGPUUQLN-HNNXBMFYSA-N 1 1 408.506 3.034 20 0 HGADMO CC(C)N(C)Cc1cnc2n1CCN(c1cccc(OCC[NH+]3CCCC3)n1)[C@@H]2C ZINC001164860367 720990160 /nfs/dbraw/zinc/99/01/60/720990160.db2.gz NCRMJUFXVZKZGK-LJQANCHMSA-N 1 1 412.582 3.174 20 0 HGADMO CC[N@H+]1CCCC[C@H]1c1ccc(N2CCc3ncc(Cn4cccn4)n3CC2)nc1 ZINC001164862013 721033564 /nfs/dbraw/zinc/03/35/64/721033564.db2.gz JXOGISVSEKZXBF-NRFANRHFSA-N 1 1 405.550 3.133 20 0 HGADMO FC(F)(N1CCc2[nH+]cc(Cn3cccn3)n2CC1)C1(c2ccc(Cl)nc2)CC1 ZINC001164864101 721034760 /nfs/dbraw/zinc/03/47/60/721034760.db2.gz XTGGIPGXOWMEFZ-UHFFFAOYSA-N 1 1 418.879 3.359 20 0 HGADMO Clc1cc(-c2ccncc2)c(N2CC[N@H+]3C[C@H](OCc4cccnc4)C[C@H]3C2)nn1 ZINC001164869564 721057017 /nfs/dbraw/zinc/05/70/17/721057017.db2.gz UHWCUCKUBBDTHD-RBUKOAKNSA-N 1 1 422.920 3.067 20 0 HGADMO c1ccc(Oc2ccnc(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@H]4C3)n2)cc1 ZINC001164868812 721066375 /nfs/dbraw/zinc/06/63/75/721066375.db2.gz QRKSRRTVAUPFAW-FPOVZHCZSA-N 1 1 403.486 3.144 20 0 HGADMO Cc1cccc2c1nc(Cl)nc2N1CC[N@H+]2C[C@H](OCc3cccnc3)C[C@H]2C1 ZINC001164866577 721072953 /nfs/dbraw/zinc/07/29/53/721072953.db2.gz FRKOQZOTJDTGIV-ZWKOTPCHSA-N 1 1 409.921 3.466 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(C(F)(F)c4cnc(Cl)nc4Cl)C[C@@H]3C2)cn1 ZINC001164772615 721077531 /nfs/dbraw/zinc/07/75/31/721077531.db2.gz VFWJQXRZNREDML-STQMWFEESA-N 1 1 417.291 3.020 20 0 HGADMO Clc1nc2c(c(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@@H]4C3)n1)CCCCC2 ZINC001164866967 721081395 /nfs/dbraw/zinc/08/13/95/721081395.db2.gz VRXLBUUMFSVPSS-QZTJIDSGSA-N 1 1 413.953 3.274 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4ccc(-c5ccc(Cl)cc5)nn4)C[C@H]3C2)cn1 ZINC001164766623 721086845 /nfs/dbraw/zinc/08/68/45/721086845.db2.gz KYSNERGQJCIDDL-RBUKOAKNSA-N 1 1 408.937 3.489 20 0 HGADMO Cc1cc(Cl)nc(C(F)(F)N2CC[N@H+]3C[C@H](OCc4cccnc4)C[C@@H]3C2)c1 ZINC001164865463 721103170 /nfs/dbraw/zinc/10/31/70/721103170.db2.gz LNCIFLSDHBVEQT-IAGOWNOFSA-N 1 1 408.880 3.463 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4nc(Cl)nc5c4CCCCC5)C[C@@H]3C2)cn1 ZINC001164773260 721120909 /nfs/dbraw/zinc/12/09/09/721120909.db2.gz XOASRQFQZMHGJK-IRXDYDNUSA-N 1 1 400.958 3.091 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(C(F)(F)c4c[nH]c5nc(Cl)ccc45)C[C@H]3C2)cn1 ZINC001164771376 721133928 /nfs/dbraw/zinc/13/39/28/721133928.db2.gz SKZCVBFYUDRPFM-HUUCEWRRSA-N 1 1 420.895 3.453 20 0 HGADMO CCc1nc(Cl)c(N2CC[N@@H+]3C[C@H](OCc4cccnc4)C[C@@H]3C2)c(Cl)n1 ZINC001164871567 721158451 /nfs/dbraw/zinc/15/84/51/721158451.db2.gz FLJULTQRZVKRRL-HUUCEWRRSA-N 1 1 408.333 3.221 20 0 HGADMO CCc1nc(Cl)c(N2CC[N@H+]3C[C@H](OCc4cccnc4)C[C@@H]3C2)c(Cl)n1 ZINC001164871567 721158461 /nfs/dbraw/zinc/15/84/61/721158461.db2.gz FLJULTQRZVKRRL-HUUCEWRRSA-N 1 1 408.333 3.221 20 0 HGADMO Fc1ccc(Oc2ccnc(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@@H]4C3)n2)cc1 ZINC001164871076 721160857 /nfs/dbraw/zinc/16/08/57/721160857.db2.gz DHVWITMWQXVJGS-TZIWHRDSSA-N 1 1 421.476 3.283 20 0 HGADMO Cc1cc(N2CC[N@H+]3C[C@@H](OCc4cccnc4)C[C@@H]3C2)nc(-c2ccsc2)n1 ZINC001164875294 721161512 /nfs/dbraw/zinc/16/15/12/721161512.db2.gz KTQCVGRJUYTFEF-UXHICEINSA-N 1 1 407.543 3.388 20 0 HGADMO Fc1ccc2c(Cl)nnc(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@@H]4C3)c2c1 ZINC001164878980 721168972 /nfs/dbraw/zinc/16/89/72/721168972.db2.gz RDHUHKQGKVBLLR-IAGOWNOFSA-N 1 1 413.884 3.297 20 0 HGADMO CC(C)n1ccc2c1nc(Cl)nc2N1C[C@@H]2C[N@H+](Cc3cnn(C)c3)CC[C@@H]2C1 ZINC001164771441 721185489 /nfs/dbraw/zinc/18/54/89/721185489.db2.gz PVBLRPXTMJMCMD-SJORKVTESA-N 1 1 413.957 3.357 20 0 HGADMO c1cc2c(nc(C3CCC3)nc2N2CC[N@H+]3C[C@H](OCc4cccnc4)C[C@@H]3C2)[nH]1 ZINC001164866780 721197374 /nfs/dbraw/zinc/19/73/74/721197374.db2.gz CWLAKOYSROGSCH-RTBURBONSA-N 1 1 404.518 3.100 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4cc(SCc5ccccc5)ncn4)C[C@H]3C2)cn1 ZINC001164769130 721223607 /nfs/dbraw/zinc/22/36/07/721223607.db2.gz LTHOJZYGUHIPQB-LEWJYISDSA-N 1 1 420.586 3.461 20 0 HGADMO CCN1C(=O)[C@]2(CC[C@H]3CN(c4nc(Cl)ccc4C[NH+]4CCCC4)C[C@@H]32)N=C1C ZINC001164875121 721230150 /nfs/dbraw/zinc/23/01/50/721230150.db2.gz WDUVCHXGNUFIGQ-SGXKBVARSA-N 1 1 415.969 3.196 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4c(F)ccc5c(Cl)ncnc54)C[C@H]3C2)cn1 ZINC001164764883 721243689 /nfs/dbraw/zinc/24/36/89/721243689.db2.gz QIIOSFGVGYSOLM-HUUCEWRRSA-N 1 1 400.889 3.114 20 0 HGADMO Clc1nc2c(ncn2[C@@H]2CCCCO2)c(N2CC3(C2)CC[N@@H+](CC2CC2)C3)n1 ZINC001164772038 721287954 /nfs/dbraw/zinc/28/79/54/721287954.db2.gz CVHAOUPIWZRGIZ-HNNXBMFYSA-N 1 1 402.930 3.101 20 0 HGADMO COc1ccc(Cn2cc3[nH]c(N4CC5(C4)CC[N@@H+](CC4CC4)C5)ccc-3c2=O)cc1 ZINC001164770543 721296028 /nfs/dbraw/zinc/29/60/28/721296028.db2.gz TWZYDUKCKFGSLV-UHFFFAOYSA-N 1 1 418.541 3.168 20 0 HGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@@]2(CCCN(c3ncnc4sccc43)C2)C1 ZINC001164778390 721332023 /nfs/dbraw/zinc/33/20/23/721332023.db2.gz VAYFDLGIZDDHAA-NRFANRHFSA-N 1 1 413.547 3.415 20 0 HGADMO CCOc1cccc(N2CCC[C@]3(C2)COCC[N@@H+](Cc2c(C)noc2C)C3)n1 ZINC001164777792 721346748 /nfs/dbraw/zinc/34/67/48/721346748.db2.gz HXOGUSXBNSUKNX-QFIPXVFZSA-N 1 1 400.523 3.204 20 0 HGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@@]2(CCCN(c3ncc(N)cc3Cl)C2)C1 ZINC001164778228 721351866 /nfs/dbraw/zinc/35/18/66/721351866.db2.gz LOGVWIOADSCGSB-FQEVSTJZSA-N 1 1 405.930 3.041 20 0 HGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@]2(CCCN(c3nccc4ncsc43)C2)C1 ZINC001164784338 721360685 /nfs/dbraw/zinc/36/06/85/721360685.db2.gz RJARNHRYGBJTHH-OAQYLSRUSA-N 1 1 413.547 3.415 20 0 HGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@]2(CCCN(c3ncc4c(n3)CCCC4)C2)C1 ZINC001164780267 721371663 /nfs/dbraw/zinc/37/16/63/721371663.db2.gz FHMOQUFZMFOTTK-HSZRJFAPSA-N 1 1 411.550 3.079 20 0 HGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@]2(CCCN(c3ncc4c(n3)CCCC4)C2)C1 ZINC001164780267 721371672 /nfs/dbraw/zinc/37/16/72/721371672.db2.gz FHMOQUFZMFOTTK-HSZRJFAPSA-N 1 1 411.550 3.079 20 0 HGADMO CCc1cc(Cl)nc(N2CCC[C@@]3(C2)COCC[N@H+](Cc2c(C)noc2C)C3)n1 ZINC001164782582 721372881 /nfs/dbraw/zinc/37/28/81/721372881.db2.gz MJXYOBHDIZNENM-OAQYLSRUSA-N 1 1 419.957 3.416 20 0 HGADMO CCc1cc(Cl)nc(N2CCC[C@@]3(C2)COCC[N@@H+](Cc2c(C)noc2C)C3)n1 ZINC001164782582 721372886 /nfs/dbraw/zinc/37/28/86/721372886.db2.gz MJXYOBHDIZNENM-OAQYLSRUSA-N 1 1 419.957 3.416 20 0 HGADMO COc1ccc2nc(Cl)nc(N3C[C@@H]4C[N@@H+](Cc5nccs5)C[C@@H]4C3)c2c1 ZINC001164779905 721389199 /nfs/dbraw/zinc/38/91/99/721389199.db2.gz DQLCYIVOUBGGJB-BETUJISGSA-N 1 1 401.923 3.317 20 0 HGADMO COc1ccc2nc(Cl)nc(N3C[C@@H]4C[N@H+](Cc5nccs5)C[C@@H]4C3)c2c1 ZINC001164779905 721389200 /nfs/dbraw/zinc/38/92/00/721389200.db2.gz DQLCYIVOUBGGJB-BETUJISGSA-N 1 1 401.923 3.317 20 0 HGADMO C[NH+]1CCN(C[C@@H]2CCC[C@@]3(CCN(c4nccc5c(Cl)ccnc54)C3)O2)CC1 ZINC001164888475 721390739 /nfs/dbraw/zinc/39/07/39/721390739.db2.gz JJHSVDBEJZGZFS-JTSKRJEESA-N 1 1 415.969 3.049 20 0 HGADMO C[NH+]1CCN(C[C@H]2CCC[C@]3(CCN(c4nnc(Cl)c5ccsc54)C3)O2)CC1 ZINC001164889319 721395216 /nfs/dbraw/zinc/39/52/16/721395216.db2.gz LSAJFJMVHNTTBB-FOIQADDNSA-N 1 1 421.998 3.110 20 0 HGADMO C[NH+]1CCN(C[C@@H]2CCC[C@]3(CCN(c4nc5ccccc5nc4Cl)C3)O2)CC1 ZINC001164885690 721402721 /nfs/dbraw/zinc/40/27/21/721402721.db2.gz HAWCRWROMBMIKG-HTAPYJJXSA-N 1 1 415.969 3.049 20 0 HGADMO CSc1cc(Cl)ncc1N1CC[C@@]2(C1)CCC[C@H](CN1CC[NH+](C)CC1)O2 ZINC001164885240 721403952 /nfs/dbraw/zinc/40/39/52/721403952.db2.gz GIUCPGWHHDAIRZ-OXQOHEQNSA-N 1 1 411.015 3.222 20 0 HGADMO C[NH+]1CCN(C[C@H]2CCC[C@]3(CCN(c4ncc5cc(Cl)ccc5n4)C3)O2)CC1 ZINC001164887195 721416317 /nfs/dbraw/zinc/41/63/17/721416317.db2.gz LJQWWMRZAJWMEC-DENIHFKCSA-N 1 1 415.969 3.049 20 0 HGADMO C[NH+]1CCN(C[C@H]2CCC[C@@]3(CCN(c4ncc5ccc(Cl)cc5n4)C3)O2)CC1 ZINC001164884547 721418848 /nfs/dbraw/zinc/41/88/48/721418848.db2.gz DUUYYIXZKGTTSW-KNQAVFIVSA-N 1 1 415.969 3.049 20 0 HGADMO CSc1cc(Cl)cnc1N1CC[C@@]2(C1)CCC[C@@H](CN1CC[NH+](C)CC1)O2 ZINC001164898294 721430118 /nfs/dbraw/zinc/43/01/18/721430118.db2.gz VQLKUDZYNWPSNZ-FXAWDEMLSA-N 1 1 411.015 3.222 20 0 HGADMO Cc1nc(C2CC2)nc(Cl)c1N1CC[C@]2(C1)CCC[C@@H](CN1CC[NH+](C)CC1)O2 ZINC001164895372 721438048 /nfs/dbraw/zinc/43/80/48/721438048.db2.gz OCJCIDIORRNUHZ-AVRDEDQJSA-N 1 1 420.001 3.081 20 0 HGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1nc(Cl)ncc1F)CC2 ZINC001164784394 721450117 /nfs/dbraw/zinc/45/01/17/721450117.db2.gz FCKRXFDQXRDIIV-MRXNPFEDSA-N 1 1 412.937 3.003 20 0 HGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1cnc(Cl)cc1OC)CC2 ZINC001164786008 721455703 /nfs/dbraw/zinc/45/57/03/721455703.db2.gz LXACVJWPHYLLLK-SFHVURJKSA-N 1 1 423.985 3.478 20 0 HGADMO CCOc1ccc(N2CCC3(C[C@H](COCC4CC4)[N@@H+](CCOC)C3)CC2)nc1 ZINC001164789338 721457420 /nfs/dbraw/zinc/45/74/20/721457420.db2.gz UUKIHAPGJXKFKO-HXUWFJFHSA-N 1 1 403.567 3.214 20 0 HGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1ccc3ncccc3n1)CC2 ZINC001164784650 721458312 /nfs/dbraw/zinc/45/83/12/721458312.db2.gz JGBGVMTZBPEDRK-FQEVSTJZSA-N 1 1 410.562 3.364 20 0 HGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1nnc(Cl)cc1F)CC2 ZINC001164784365 721459771 /nfs/dbraw/zinc/45/97/71/721459771.db2.gz HMLYJUGJZWDJEP-MRXNPFEDSA-N 1 1 412.937 3.003 20 0 HGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1ncc(N)cc1Cl)CC2 ZINC001164784414 721459942 /nfs/dbraw/zinc/45/99/42/721459942.db2.gz HUUBQGVGGLOHEN-SFHVURJKSA-N 1 1 408.974 3.051 20 0 HGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1ncc(C3CC3)cn1)CC2 ZINC001164783558 721460235 /nfs/dbraw/zinc/46/02/35/721460235.db2.gz DLOLHNYNFASEDR-NRFANRHFSA-N 1 1 400.567 3.088 20 0 HGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1nc(C)c(C)nc1Cl)CC2 ZINC001164787714 721460345 /nfs/dbraw/zinc/46/03/45/721460345.db2.gz RVIIKRCGXJVABQ-IBGZPJMESA-N 1 1 423.001 3.481 20 0 HGADMO CC[N@H+]1CCCC[C@H]1c1ccc(N2Cc3nccn3C[C@H](Cn3cccn3)C2)nc1 ZINC001164897687 721487657 /nfs/dbraw/zinc/48/76/57/721487657.db2.gz UACBSNVKUHXKBG-FPOVZHCZSA-N 1 1 405.550 3.358 20 0 HGADMO C[N@H+](Cc1ccncc1)C1CC2(C1)CCN(c1cccc(N3CCOCC3)n1)CC2 ZINC001164796266 721498672 /nfs/dbraw/zinc/49/86/72/721498672.db2.gz OYNBPMYUQUFFRV-UHFFFAOYSA-N 1 1 407.562 3.194 20 0 HGADMO C[N@@H+](Cc1ccncc1)C1CC2(C1)CCN(c1cccc(N3CCOCC3)n1)CC2 ZINC001164796266 721498675 /nfs/dbraw/zinc/49/86/75/721498675.db2.gz OYNBPMYUQUFFRV-UHFFFAOYSA-N 1 1 407.562 3.194 20 0 HGADMO Fc1c[nH]c2nc(Cl)nc(N3CC[N@H+]4C[C@H](Oc5cccc(F)c5)C[C@@H]4C3)c12 ZINC001164896897 721510298 /nfs/dbraw/zinc/51/02/98/721510298.db2.gz CAXBLMZKZXVFDN-TZMCWYRMSA-N 1 1 405.836 3.231 20 0 HGADMO Fc1cccc(O[C@@H]2C[C@H]3CN(c4nc(Cl)nc5c4CSC5)CC[N@H+]3C2)c1 ZINC001164901621 721524146 /nfs/dbraw/zinc/52/41/46/721524146.db2.gz XTMLLXBEJAVHFX-DZGCQCFKSA-N 1 1 406.914 3.358 20 0 HGADMO COC(=O)c1nc(N2CC[N@H+]3C[C@H](Oc4cccc(F)c4)C[C@H]3C2)ccc1Cl ZINC001164906362 721532227 /nfs/dbraw/zinc/53/22/27/721532227.db2.gz KDDJYQZDBFGJLH-GOEBONIOSA-N 1 1 405.857 3.003 20 0 HGADMO Nc1cc(Cl)ncc1C(F)(F)N1CC[N@H+]2C[C@@H](Oc3cccc(F)c3)C[C@H]2C1 ZINC001164907718 721536348 /nfs/dbraw/zinc/53/63/48/721536348.db2.gz OCKVSSSIUJDIAW-ZFWWWQNUSA-N 1 1 412.843 3.343 20 0 HGADMO CCOC(=O)c1cnc(N2CC[N@H+]3C[C@@H](Oc4cccc(F)c4)C[C@@H]3C2)c(Cl)c1 ZINC001164907161 721536884 /nfs/dbraw/zinc/53/68/84/721536884.db2.gz MJHKSDGYAFPVNA-AEFFLSMTSA-N 1 1 419.884 3.393 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2nc(Cl)nc3c2CCCC3)[C@H]2CCCO[C@H]12 ZINC001164799883 721538285 /nfs/dbraw/zinc/53/82/85/721538285.db2.gz BOXOOSUBTLDUDZ-ZCNNSNEGSA-N 1 1 413.953 3.272 20 0 HGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2ncnc3[nH]c4ccccc4c32)[C@H]2CCCO[C@@H]12 ZINC001164800394 721559883 /nfs/dbraw/zinc/55/98/83/721559883.db2.gz FJYLHKCUUCKVCY-TUNNFDKTSA-N 1 1 414.513 3.374 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2ncnc3[nH]c4ccccc4c32)[C@H]2CCCO[C@@H]12 ZINC001164800394 721559886 /nfs/dbraw/zinc/55/98/86/721559886.db2.gz FJYLHKCUUCKVCY-TUNNFDKTSA-N 1 1 414.513 3.374 20 0 HGADMO COc1cc2c(cc1F)ncnc2N1C[C@H]([N@@H+](C)Cc2cccnc2)[C@H]2OCCC[C@H]21 ZINC001164809864 721566165 /nfs/dbraw/zinc/56/61/65/721566165.db2.gz XPHDLIIFFGOUHV-URVUXULASA-N 1 1 423.492 3.041 20 0 HGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(C(F)(F)c2cnc(Cl)c(N)c2)[C@@H]2CCCO[C@@H]12 ZINC001164806679 721573957 /nfs/dbraw/zinc/57/39/57/721573957.db2.gz QQUDIXWSOBIKFJ-KZNAEPCWSA-N 1 1 423.895 3.125 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(C(F)(F)c2cnc(Cl)c(N)c2)[C@@H]2CCCO[C@@H]12 ZINC001164806679 721573959 /nfs/dbraw/zinc/57/39/59/721573959.db2.gz QQUDIXWSOBIKFJ-KZNAEPCWSA-N 1 1 423.895 3.125 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2ccc(-c3ccncc3)cn2)[C@@H]2CCCO[C@H]12 ZINC001164805841 721575235 /nfs/dbraw/zinc/57/52/35/721575235.db2.gz PCXBLCZYNNWHMY-AKFKNWHVSA-N 1 1 401.514 3.407 20 0 HGADMO Cc1cc(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@H]3OCCC[C@@H]32)nc(-c2ccncc2)n1 ZINC001164806224 721575672 /nfs/dbraw/zinc/57/56/72/721575672.db2.gz PJLNNGMAOSBEMX-FUDKSRODSA-N 1 1 416.529 3.110 20 0 HGADMO Cc1cc(C(F)(F)N2C[C@H]([N@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@@H]32)c(Cl)nn1 ZINC001164802484 721580003 /nfs/dbraw/zinc/58/00/03/721580003.db2.gz GEXKWNJWULEOHW-OKZBNKHCSA-N 1 1 423.895 3.247 20 0 HGADMO Cc1cc(C(F)(F)N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@@H]32)c(Cl)nn1 ZINC001164802484 721580006 /nfs/dbraw/zinc/58/00/06/721580006.db2.gz GEXKWNJWULEOHW-OKZBNKHCSA-N 1 1 423.895 3.247 20 0 HGADMO FC1(F)CCN(c2nccc(N3CCCC3)n2)C[C@]12CC[N@@H+](Cc1ccccn1)C2 ZINC001164905135 721582667 /nfs/dbraw/zinc/58/26/67/721582667.db2.gz SPHIEJASABZIEE-OAQYLSRUSA-N 1 1 414.504 3.210 20 0 HGADMO COc1ccc2nc(N3C[C@H]([N@@H+](C)Cc4cccnc4)[C@@H]4OCCC[C@@H]43)c(C)nc2c1 ZINC001164811880 721582876 /nfs/dbraw/zinc/58/28/76/721582876.db2.gz YUUMHQSVQGEFAW-RJGXRXQPSA-N 1 1 419.529 3.210 20 0 HGADMO COCOc1ccc(N2CCC(F)(F)[C@@]3(CC[N@@H+](Cc4ccccn4)C3)C2)nc1 ZINC001164908736 721706713 /nfs/dbraw/zinc/70/67/13/721706713.db2.gz YVAZSYSSAVVALW-HXUWFJFHSA-N 1 1 404.461 3.197 20 0 HGADMO CC(C)Oc1nccnc1N1CCC(F)(F)[C@@]2(CC[N@@H+](Cc3ccccn3)C2)C1 ZINC001164912279 721731199 /nfs/dbraw/zinc/73/11/99/721731199.db2.gz NPUHIVPTUQYHII-HXUWFJFHSA-N 1 1 403.477 3.397 20 0 HGADMO Cc1ccc(Cl)nc1C(F)(F)N1CCCC12CC[NH+](CC(=O)N(C)C)CC2 ZINC001165011332 721739946 /nfs/dbraw/zinc/73/99/46/721739946.db2.gz VMQYVWKBPHIDOW-UHFFFAOYSA-N 1 1 400.901 3.111 20 0 HGADMO COC(=O)c1cc(C)cc(N2CCc3c(C[N@H+](C)Cc4ccco4)cncc3C2)n1 ZINC001164909001 721757277 /nfs/dbraw/zinc/75/72/77/721757277.db2.gz BQWXVHHZQQCLEN-UHFFFAOYSA-N 1 1 406.486 3.359 20 0 HGADMO COC(=O)c1cc(C)cc(N2CCc3c(C[N@@H+](C)Cc4ccco4)cncc3C2)n1 ZINC001164909001 721757283 /nfs/dbraw/zinc/75/72/83/721757283.db2.gz BQWXVHHZQQCLEN-UHFFFAOYSA-N 1 1 406.486 3.359 20 0 HGADMO C[N@H+](Cc1ccco1)Cc1cncc2c1CCN([C@H](F)Oc1cncc(Cl)n1)C2 ZINC001164910480 721764446 /nfs/dbraw/zinc/76/44/46/721764446.db2.gz GKCHNGCWKPZXGK-FQEVSTJZSA-N 1 1 417.872 3.440 20 0 HGADMO C[N@@H+](Cc1ccco1)Cc1cncc2c1CCN([C@H](F)Oc1cncc(Cl)n1)C2 ZINC001164910480 721764448 /nfs/dbraw/zinc/76/44/48/721764448.db2.gz GKCHNGCWKPZXGK-FQEVSTJZSA-N 1 1 417.872 3.440 20 0 HGADMO Cc1cc(Cl)nc(N2C[C@@H]3CCC[C@@H]([N@@H+](C)Cc4ccccn4)[C@H]3C2)c1C(N)=O ZINC001165024697 721801483 /nfs/dbraw/zinc/80/14/83/721801483.db2.gz MRIGYDCUUOKQAZ-RYQLBKOJSA-N 1 1 413.953 3.274 20 0 HGADMO C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@@H]2CN(c3ccc(C(=O)NC4CC4)cn3)C[C@H]21 ZINC001165027404 721814477 /nfs/dbraw/zinc/81/44/77/721814477.db2.gz URGGWCZXMYSATC-STZQEDGTSA-N 1 1 405.546 3.106 20 0 HGADMO CN(C)CC[N@H+]1CC[C@H]2[C@H]1CCN2c1ccc(-c2ccc(C3OCCCO3)cc2)cn1 ZINC001164923633 721874470 /nfs/dbraw/zinc/87/44/70/721874470.db2.gz JEVAMZGMYJGOPJ-PKTZIBPZSA-N 1 1 422.573 3.399 20 0 HGADMO C[NH+](C)CCN1CC[C@H]2[C@H]1CCN2c1ccc(-c2ccc(C3OCCCO3)cc2)cn1 ZINC001164923633 721874471 /nfs/dbraw/zinc/87/44/71/721874471.db2.gz JEVAMZGMYJGOPJ-PKTZIBPZSA-N 1 1 422.573 3.399 20 0 HGADMO Cc1c(C)n(Cc2ccccc2)c2ncnc(N3CC[C@@H]4[C@@H]3CC[N@@H+]4CCN(C)C)c12 ZINC001164931503 721878880 /nfs/dbraw/zinc/87/88/80/721878880.db2.gz FZQSEFTZNABTRU-YADHBBJMSA-N 1 1 418.589 3.311 20 0 HGADMO Cc1c(C)n(Cc2ccccc2)c2ncnc(N3CC[C@@H]4[C@@H]3CCN4CC[NH+](C)C)c12 ZINC001164931503 721878882 /nfs/dbraw/zinc/87/88/82/721878882.db2.gz FZQSEFTZNABTRU-YADHBBJMSA-N 1 1 418.589 3.311 20 0 HGADMO C[C@H]1CCc2c(sc3nc(C[NH+]4CCCCC4)nc(N4CCNC(=O)[C@@H]4C)c23)C1 ZINC001165036141 721883800 /nfs/dbraw/zinc/88/38/00/721883800.db2.gz JVNORPWLUHPAPC-GJZGRUSLSA-N 1 1 413.591 3.127 20 0 HGADMO CN(C)CC[N@@H+]1CC[C@@H]2[C@@H]1CCN2[C@H](F)Oc1cccc(-c2ccc(Cl)nn2)c1 ZINC001164935080 721883881 /nfs/dbraw/zinc/88/38/81/721883881.db2.gz VQOUEYJSAKYDIN-ZVDOUQERSA-N 1 1 419.932 3.139 20 0 HGADMO CN(C)CC[N@H+]1CC[C@@H]2[C@@H]1CCN2[C@H](F)Oc1cccc(-c2ccc(Cl)nn2)c1 ZINC001164935080 721883882 /nfs/dbraw/zinc/88/38/82/721883882.db2.gz VQOUEYJSAKYDIN-ZVDOUQERSA-N 1 1 419.932 3.139 20 0 HGADMO Cc1ccc(Oc2nc(Cl)ncc2N2CC[C@H]3[C@H]2CC[N@H+]3CCN(C)C)cc1 ZINC001164933629 721888339 /nfs/dbraw/zinc/88/83/39/721888339.db2.gz NMCWHDFLNQKVGG-ZWKOTPCHSA-N 1 1 401.942 3.445 20 0 HGADMO Cc1ccc(Oc2nc(Cl)ncc2N2CC[C@H]3[C@H]2CC[N@@H+]3CCN(C)C)cc1 ZINC001164933629 721888340 /nfs/dbraw/zinc/88/83/40/721888340.db2.gz NMCWHDFLNQKVGG-ZWKOTPCHSA-N 1 1 401.942 3.445 20 0 HGADMO COc1ccccc1Oc1nc(Cl)ncc1N1CC[C@H]2[C@@H]1CC[N@@H+]2CCN(C)C ZINC001164934414 721889290 /nfs/dbraw/zinc/88/92/90/721889290.db2.gz RLNUGAATSIFHJM-HOTGVXAUSA-N 1 1 417.941 3.146 20 0 HGADMO COc1ccccc1Oc1nc(Cl)ncc1N1CC[C@H]2[C@@H]1CC[N@H+]2CCN(C)C ZINC001164934414 721889291 /nfs/dbraw/zinc/88/92/91/721889291.db2.gz RLNUGAATSIFHJM-HOTGVXAUSA-N 1 1 417.941 3.146 20 0 HGADMO COC(=O)c1cc(N2CCC3(CC2)C[N@@H+](Cc2ccc(C)cc2)CCO3)ncc1C ZINC001164939532 721928171 /nfs/dbraw/zinc/92/81/71/721928171.db2.gz MDDCNWHXORJRDJ-UHFFFAOYSA-N 1 1 409.530 3.356 20 0 HGADMO COc1ccc2nc(N3CCC4(CC3)C(=O)NCC[N@H+]4Cc3ccccc3)ccc2c1 ZINC001164945669 721972816 /nfs/dbraw/zinc/97/28/16/721972816.db2.gz PQVHBHMGUMGGIN-UHFFFAOYSA-N 1 1 416.525 3.214 20 0 HGADMO COc1ccc2nc(N3CCC4(CC3)C(=O)NCC[N@@H+]4Cc3ccccc3)ccc2c1 ZINC001164945669 721972819 /nfs/dbraw/zinc/97/28/19/721972819.db2.gz PQVHBHMGUMGGIN-UHFFFAOYSA-N 1 1 416.525 3.214 20 0 HGADMO Cc1ccc(Cl)c(O[C@@H]2CCCN(c3ccnc(N4CC[NH+](C)CC4)n3)C2)c1 ZINC001165050494 721979861 /nfs/dbraw/zinc/97/98/61/721979861.db2.gz TUELFUFWTGNREI-QGZVFWFLSA-N 1 1 401.942 3.238 20 0 HGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2CC[C@@]3(C2)C[C@H](NC(=O)N(C)C)CCO3)nc1 ZINC001164954101 722010754 /nfs/dbraw/zinc/01/07/54/722010754.db2.gz IFKISUYRFHJCKC-VIZSFHNOSA-N 1 1 415.582 3.028 20 0 HGADMO COC(=O)c1cnc(Cl)cc1N1CCC2(CC[N@@H+](Cc3cccnc3)C2)CC1 ZINC001164954312 722012719 /nfs/dbraw/zinc/01/27/19/722012719.db2.gz KEHGAXJKXSAWEK-UHFFFAOYSA-N 1 1 400.910 3.409 20 0 HGADMO COC(=O)c1cc(N2CCC3(CC[N@@H+](Cc4cccnc4)C3)CC2)ncc1Cl ZINC001164955574 722013115 /nfs/dbraw/zinc/01/31/15/722013115.db2.gz WTELMEABAYDUMY-UHFFFAOYSA-N 1 1 400.910 3.409 20 0 HGADMO CCOC(=O)c1ncnc(Cl)c1N1CCC2(CC[N@@H+](Cc3cccnc3)C2)CC1 ZINC001164955875 722021282 /nfs/dbraw/zinc/02/12/82/722021282.db2.gz QJKODHPWDDUWDG-UHFFFAOYSA-N 1 1 415.925 3.194 20 0 HGADMO Cc1cnc(N2CCC3(CC2)COCC[N@@H+](Cc2ccncc2)C3)nc1NCC1CC1 ZINC001164959619 722052002 /nfs/dbraw/zinc/05/20/02/722052002.db2.gz NANJBKZHDDCLDT-UHFFFAOYSA-N 1 1 422.577 3.121 20 0 HGADMO COc1cc(Cl)nc(N2CCC3(CC2)COCC[N@@H+](Cc2ccncc2)C3)c1 ZINC001164962183 722055335 /nfs/dbraw/zinc/05/53/35/722055335.db2.gz AVMGVAUWFSOEHI-UHFFFAOYSA-N 1 1 402.926 3.258 20 0 HGADMO Fc1ccc2cnnc(N3CCC4(CC3)COCC[N@@H+](Cc3ccncc3)C4)c2c1 ZINC001164963207 722056595 /nfs/dbraw/zinc/05/65/95/722056595.db2.gz INFRLCACLNUHBD-UHFFFAOYSA-N 1 1 407.493 3.283 20 0 HGADMO COc1ccc2nc(N3CCC4(CC3)COCC[N@@H+](Cc3ccncc3)C4)ncc2c1 ZINC001164963854 722056981 /nfs/dbraw/zinc/05/69/81/722056981.db2.gz OIMQJHTUHGFYRM-UHFFFAOYSA-N 1 1 419.529 3.152 20 0 HGADMO CCC[N@H+]1CCCC[C@@H]1c1ccc(N2CCCn3c(Cn4cccn4)nnc3C2)nc1 ZINC001164971819 722089114 /nfs/dbraw/zinc/08/91/14/722089114.db2.gz DOSXWZDTIOZXDW-HXUWFJFHSA-N 1 1 420.565 3.265 20 0 HGADMO CN(C)C(=O)N[C@@H]1c2ccccc2[C@@H]2CN(c3ccc(C[N@@H+](C)C4CC4)cn3)C[C@@H]21 ZINC001164985854 722098107 /nfs/dbraw/zinc/09/81/07/722098107.db2.gz XFFVRTQIIRDTCB-QNWVGRARSA-N 1 1 405.546 3.222 20 0 HGADMO Clc1ccnc2c1ccnc2N1CC[C@H]2C[N@@H+](Cc3cccnc3)CCO[C@H]2C1 ZINC001164975478 722104722 /nfs/dbraw/zinc/10/47/22/722104722.db2.gz BZHNETSATLJWKM-PXNSSMCTSA-N 1 1 409.921 3.406 20 0 HGADMO Cc1nc(Cl)cc(C(F)(F)N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)n1 ZINC001164985711 722105528 /nfs/dbraw/zinc/10/55/28/722105528.db2.gz WGTJXLIJJFZDAL-IRXDYDNUSA-N 1 1 423.895 3.106 20 0 HGADMO Clc1cnc2nc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)ccc2c1 ZINC001164975634 722112635 /nfs/dbraw/zinc/11/26/35/722112635.db2.gz KDMRWLVWCUJOCF-ICSRJNTNSA-N 1 1 409.921 3.406 20 0 HGADMO Clc1ccc2cc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)ncc2n1 ZINC001164979166 722122373 /nfs/dbraw/zinc/12/23/73/722122373.db2.gz PJXQEVRHFQIUAQ-QUCCMNQESA-N 1 1 409.921 3.406 20 0 HGADMO COc1ccc2ccc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)nc2c1 ZINC001164975122 722126700 /nfs/dbraw/zinc/12/67/00/722126700.db2.gz JSRICIXEIPKPEU-REWPJTCUSA-N 1 1 404.514 3.366 20 0 HGADMO COc1ccc2cnc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)cc2c1 ZINC001164980965 722132416 /nfs/dbraw/zinc/13/24/16/722132416.db2.gz OGLNRLBBEMEMMR-OFNKIYASSA-N 1 1 404.514 3.366 20 0 HGADMO CC(C)n1ccc2c1ncnc2N1CC[C@H]2C[N@@H+](Cc3cccnc3)CCO[C@H]2C1 ZINC001164978883 722136769 /nfs/dbraw/zinc/13/67/69/722136769.db2.gz KHWUULDLYNDEBK-FPOVZHCZSA-N 1 1 406.534 3.135 20 0 HGADMO c1cncc(C[N@H+]2CCO[C@@H]3CN(c4ncnc5sc6c(c54)CCC6)CC[C@@H]3C2)c1 ZINC001164980363 722138851 /nfs/dbraw/zinc/13/88/51/722138851.db2.gz NFSIRPJQQMFSEX-IEBWSBKVSA-N 1 1 421.570 3.302 20 0 HGADMO CCc1nc(Cl)c(N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)c(Cl)n1 ZINC001164972645 722146205 /nfs/dbraw/zinc/14/62/05/722146205.db2.gz AFYNKMXTJQDTRO-HZPDHXFCSA-N 1 1 422.360 3.468 20 0 HGADMO Cc1cc(N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)nc(-c2ccco2)n1 ZINC001164983864 722147247 /nfs/dbraw/zinc/14/72/47/722147247.db2.gz VWQMEYOWTNZJAR-PZJWPPBQSA-N 1 1 405.502 3.167 20 0 HGADMO c1ccc(Oc2nccnc2N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)cc1 ZINC001164985067 722150302 /nfs/dbraw/zinc/15/03/02/722150302.db2.gz ZBHOIRAUXMTCAV-UNMCSNQZSA-N 1 1 417.513 3.391 20 0 HGADMO Cc1nc(CN2CCO[C@H]3CCN(c4[nH+]cnc5[nH]c(C)c(C)c54)CC[C@H]32)cs1 ZINC001164985917 722182389 /nfs/dbraw/zinc/18/23/89/722182389.db2.gz CFHWYULYKXUJLL-MSOLQXFVSA-N 1 1 412.563 3.209 20 0 HGADMO NC(=O)c1nc(Cl)nc(Cl)c1N1CCC[C@]2(CC[N@@H+]2Cc2cccc(F)c2)C1 ZINC001164996217 722201647 /nfs/dbraw/zinc/20/16/47/722201647.db2.gz RQVHFCRJRJKLLB-IBGZPJMESA-N 1 1 424.307 3.266 20 0 HGADMO NC(=O)c1nc(Cl)nc(Cl)c1N1CCC[C@]2(CC[N@H+]2Cc2cccc(F)c2)C1 ZINC001164996217 722201654 /nfs/dbraw/zinc/20/16/54/722201654.db2.gz RQVHFCRJRJKLLB-IBGZPJMESA-N 1 1 424.307 3.266 20 0 HGADMO CNC(=O)c1nc(N2CCC[C@@]3(CC[N@H+]3Cc3cccc(F)c3)C2)ccc1Cl ZINC001164995676 722203597 /nfs/dbraw/zinc/20/35/97/722203597.db2.gz PAQZSTGZGMIMBJ-OAQYLSRUSA-N 1 1 402.901 3.479 20 0 HGADMO CN1CCOc2c(Cl)nnc(N3CCC[C@@]4(CC[N@H+]4Cc4cccc(F)c4)C3)c21 ZINC001164996326 722206833 /nfs/dbraw/zinc/20/68/33/722206833.db2.gz UAPRYNPBPBUCQF-OAQYLSRUSA-N 1 1 417.916 3.343 20 0 HGADMO C[NH+]1CCN(c2ncnc3c2CCN(c2nccc4c(Cl)cccc42)CC3)CC1 ZINC001164996616 722232679 /nfs/dbraw/zinc/23/26/79/722232679.db2.gz GZUSQJYXQIKTQC-UHFFFAOYSA-N 1 1 408.937 3.035 20 0 HGADMO CC(C)CN1c2ccccc2[C@H]2CN(c3ccnc(N4CC[NH+](C)CC4)n3)CC[C@H]21 ZINC001165005686 722245751 /nfs/dbraw/zinc/24/57/51/722245751.db2.gz VQQMAPZVKSQTAQ-IFMALSPDSA-N 1 1 406.578 3.067 20 0 HGADMO CN(C)c1nc(C[NH2+][C@@H](CO)Cc2ccc(F)cc2)c(Cl)n1-c1ccccc1 ZINC000802647888 1126110610 /nfs/dbraw/zinc/11/06/10/1126110610.db2.gz RMDQXIBVRBQBRA-QGZVFWFLSA-N 1 1 402.901 3.424 20 0 HGADMO Cc1ccc(C[C@H](CO)[NH2+]Cc2c(Cl)cccc2N2CCN(C)CC2)cc1C ZINC001461549523 1126195256 /nfs/dbraw/zinc/19/52/56/1126195256.db2.gz LKYBBHNEIBWTLS-HXUWFJFHSA-N 1 1 401.982 3.402 20 0 HGADMO CCOC(=O)[C@@]12CCO[C@H]1CCN(c1ccc3c(n1)CC[N@H+](Cc1ccccc1)C3)C2 ZINC001164432025 718974053 /nfs/dbraw/zinc/97/40/53/718974053.db2.gz DUCBTJSQKPIJRF-WIOPSUGQSA-N 1 1 421.541 3.188 20 0 HGADMO CCOC(=O)c1cnc(Cl)nc1N1CCC[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]21 ZINC001164618346 719054307 /nfs/dbraw/zinc/05/43/07/719054307.db2.gz ARROWSZYROQLHK-FUHWJXTLSA-N 1 1 400.910 3.408 20 0 HGADMO CCOC(=O)c1cnc(Cl)nc1N1CCC[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21 ZINC001164618348 719054458 /nfs/dbraw/zinc/05/44/58/719054458.db2.gz ARROWSZYROQLHK-WMZOPIPTSA-N 1 1 400.910 3.408 20 0 HGADMO NC(=O)c1ccc(C(F)(F)N2CCC[C@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)nc1Cl ZINC001164626577 719055762 /nfs/dbraw/zinc/05/57/62/719055762.db2.gz SFZDTRFCUXHOAL-RDJZCZTQSA-N 1 1 420.891 3.480 20 0 HGADMO NC(=O)c1cc(Cl)ncc1C(F)(F)N1CCC[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]21 ZINC001164631687 719093949 /nfs/dbraw/zinc/09/39/49/719093949.db2.gz ZCRFENRSUBQYKN-MAUKXSAKSA-N 1 1 420.891 3.480 20 0 HGADMO CCOC(=O)c1ccc(Cl)nc1-c1ccc(F)cc1N1C[C@@H]2[C@H](C1)OCC[N@H+]2C ZINC001164669213 719412426 /nfs/dbraw/zinc/41/24/26/719412426.db2.gz LIODOHVHCRMKBU-MSOLQXFVSA-N 1 1 419.884 3.237 20 0 HGADMO CCOC(=O)c1ccc(Cl)nc1-c1ccc(F)cc1N1C[C@H]2OCC[N@@H+](C)[C@@H]2C1 ZINC001164669214 719412914 /nfs/dbraw/zinc/41/29/14/719412914.db2.gz LIODOHVHCRMKBU-QZTJIDSGSA-N 1 1 419.884 3.237 20 0 HGADMO C[N@H+]1CCO[C@H]2CN(c3nc(-c4cccnc4)nc4sc5c(c43)CCCC5)C[C@H]21 ZINC000301684048 719433453 /nfs/dbraw/zinc/43/34/53/719433453.db2.gz WIDIEGFCNZTWRM-SJORKVTESA-N 1 1 407.543 3.151 20 0 HGADMO CNC(=O)C[N@H+]1CCCC12CCN(c1cc3nc(Cl)cnc3cc1Cl)CC2 ZINC001164685021 719716242 /nfs/dbraw/zinc/71/62/42/719716242.db2.gz QAGCMZCAUBWLAR-UHFFFAOYSA-N 1 1 408.333 3.117 20 0 HGADMO C[N@@H+](Cc1ccc(N2CCC3(CC2)CN(c2ccccc2)C(=O)CO3)nc1)C1CC1 ZINC001164696976 719836924 /nfs/dbraw/zinc/83/69/24/719836924.db2.gz VUVAGOWPRCDKDM-UHFFFAOYSA-N 1 1 406.530 3.078 20 0 HGADMO COC(=O)[C@]1(C)C[C@H]([NH+]2CCOCC2)CCN1c1cc(F)cc2ccc(Cl)nc21 ZINC001164704712 719854972 /nfs/dbraw/zinc/85/49/72/719854972.db2.gz SLNIYNQBDRPONI-IERDGZPVSA-N 1 1 421.900 3.260 20 0 HGADMO COCc1cc(N2CCC3(CC2)C[N@@H+](Cc2cccs2)CCO3)nc(SC)n1 ZINC001164695283 719892043 /nfs/dbraw/zinc/89/20/43/719892043.db2.gz LGMSONTVEPXGHC-UHFFFAOYSA-N 1 1 420.604 3.278 20 0 HGADMO CN(C)c1cc(Cl)nc(N2CCC3(CC2)C[N@H+](Cc2cccs2)CCO3)n1 ZINC001164697611 719893357 /nfs/dbraw/zinc/89/33/57/719893357.db2.gz LXZLPQQYYCQARB-UHFFFAOYSA-N 1 1 407.971 3.129 20 0 HGADMO CN(C)c1cc(Cl)nc(N2CCC3(CC2)C[N@@H+](Cc2cccs2)CCO3)n1 ZINC001164697611 719893360 /nfs/dbraw/zinc/89/33/60/719893360.db2.gz LXZLPQQYYCQARB-UHFFFAOYSA-N 1 1 407.971 3.129 20 0 HGADMO c1csc(C[N@H+]2CCOC3(CCN(c4cc(-c5ccccn5)ncn4)CC3)C2)c1 ZINC001164706272 719899674 /nfs/dbraw/zinc/89/96/74/719899674.db2.gz GPGVHHRIUDNMFB-UHFFFAOYSA-N 1 1 407.543 3.472 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1nc(Cl)nc3[nH]cc(Cl)c31)C2 ZINC001164812710 720070103 /nfs/dbraw/zinc/07/01/03/720070103.db2.gz RHNNGVGZWAEJQS-DJJJIMSYSA-N 1 1 410.349 3.449 20 0 HGADMO CCC[N@H+]1CCCC[C@@H]1c1ccc(N2CC[C@H]3[C@@H]2CC(=O)N3c2cnn(C)c2)nc1 ZINC001164711309 720076230 /nfs/dbraw/zinc/07/62/30/720076230.db2.gz LJWZBAURNXBAQN-HKBOAZHASA-N 1 1 408.550 3.136 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1nccc3ccc(C(=O)OC)cc31)C2 ZINC001164811072 720103833 /nfs/dbraw/zinc/10/38/33/720103833.db2.gz LEJHWRGKKUDIDM-YKSBVNFPSA-N 1 1 409.530 3.206 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(C(F)(F)c1ccc(OC)nc1Cl)C2 ZINC001164811734 720111882 /nfs/dbraw/zinc/11/18/82/720111882.db2.gz NBJURTGXLJSHMH-DNVCBOLYSA-N 1 1 415.912 3.473 20 0 HGADMO COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1ncnc3cc(C)[nH]c31)CC2 ZINC001164719112 720125284 /nfs/dbraw/zinc/12/52/84/720125284.db2.gz WHIJLEZBYKDYSS-IBGZPJMESA-N 1 1 406.534 3.169 20 0 HGADMO COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1cc(C)cc(C(=O)OC)n1)CC2 ZINC001164719608 720126397 /nfs/dbraw/zinc/12/63/97/720126397.db2.gz ZOGHEVMCKVZWGJ-FQEVSTJZSA-N 1 1 424.545 3.079 20 0 HGADMO CCN(CC)c1cncc(N2CCC3(C[C@H](COC)[N@@H+](Cc4ccccn4)C3)CC2)n1 ZINC001164712245 720130083 /nfs/dbraw/zinc/13/00/83/720130083.db2.gz LRNFTGFNVFYQHF-OAQYLSRUSA-N 1 1 424.593 3.225 20 0 HGADMO CCOC(=O)c1c(C)cc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COC)nc1C ZINC001164816163 720130451 /nfs/dbraw/zinc/13/04/51/720130451.db2.gz XZPFRTWTTYDDDO-WMZHIEFXSA-N 1 1 401.551 3.060 20 0 HGADMO CCSc1cncc(N2CCC3(C[C@H](COC)[N@@H+](Cc4ccccn4)C3)CC2)n1 ZINC001164710499 720147744 /nfs/dbraw/zinc/14/77/44/720147744.db2.gz BZSIKJKTKVEQGO-LJQANCHMSA-N 1 1 413.591 3.491 20 0 HGADMO COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1ncc3c(n1)CCCC3)CC2 ZINC001164713885 720151841 /nfs/dbraw/zinc/15/18/41/720151841.db2.gz TXMPYVKADLXDOD-OAQYLSRUSA-N 1 1 407.562 3.258 20 0 HGADMO COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1ncc(C(F)F)cn1)CC2 ZINC001164714390 720152745 /nfs/dbraw/zinc/15/27/45/720152745.db2.gz WSUYHQBHMSWDAJ-GOSISDBHSA-N 1 1 403.477 3.317 20 0 HGADMO COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1nc(C)nc(OC)c1C)CC2 ZINC001164711757 720152899 /nfs/dbraw/zinc/15/28/99/720152899.db2.gz JSJDQAOPNAUBPN-HXUWFJFHSA-N 1 1 411.550 3.005 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1nccc(-c3ccccc3OC)n1)C2 ZINC001164816658 720174260 /nfs/dbraw/zinc/17/42/60/720174260.db2.gz LZMLEUFFLCMMAL-NTKDMRAZSA-N 1 1 408.546 3.337 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1cc3cc(OC)c(OC)cc3cn1)C2 ZINC001164818873 720178315 /nfs/dbraw/zinc/17/83/15/720178315.db2.gz VEDDOQHULFCSKO-HYBUGGRVSA-N 1 1 411.546 3.437 20 0 HGADMO CC(C)[N@@H+](C)Cc1cc(=O)n2c(n1)CN(c1cncc(-c3ccc(F)cc3)n1)CCC2 ZINC001164816442 720244197 /nfs/dbraw/zinc/24/41/97/720244197.db2.gz JNURFNOTISVXEO-UHFFFAOYSA-N 1 1 422.508 3.090 20 0 HGADMO Cc1nc(CN2C(=O)CC[C@@H]3[C@@H]2CCN3c2ccc(C[N@H+](C)C3CC3)cn2)cs1 ZINC001164816037 720259618 /nfs/dbraw/zinc/25/96/18/720259618.db2.gz FOTVAYGUBNJJJB-UXHICEINSA-N 1 1 411.575 3.211 20 0 HGADMO CCOC(=O)c1c(C)nc(Cl)cc1N1CC[C@@H]2[C@H]1CC[N@H+]2Cc1cccnc1 ZINC001164730327 720364525 /nfs/dbraw/zinc/36/45/25/720364525.db2.gz WSAJSNJLEXCPET-IAGOWNOFSA-N 1 1 400.910 3.468 20 0 HGADMO COC(=O)c1ccc(C(F)(F)N2CC[C@H]3[C@@H]2CC[N@@H+]3Cc2cccnc2)c(Cl)n1 ZINC001164722115 720377566 /nfs/dbraw/zinc/37/75/66/720377566.db2.gz BXKPGAWBNQLPCN-IRXDYDNUSA-N 1 1 422.863 3.315 20 0 HGADMO COC(=O)c1ccc(C(F)(F)N2CC[C@H]3[C@@H]2CC[N@H+]3Cc2cccnc2)c(Cl)n1 ZINC001164722115 720377572 /nfs/dbraw/zinc/37/75/72/720377572.db2.gz BXKPGAWBNQLPCN-IRXDYDNUSA-N 1 1 422.863 3.315 20 0 HGADMO COC(=O)c1ccc(C(F)(F)N2CC[C@H]3[C@H]2CC[N@@H+]3Cc2cccnc2)c(Cl)n1 ZINC001164722112 720377634 /nfs/dbraw/zinc/37/76/34/720377634.db2.gz BXKPGAWBNQLPCN-DLBZAZTESA-N 1 1 422.863 3.315 20 0 HGADMO COC(=O)c1ccc(C(F)(F)N2CC[C@H]3[C@H]2CC[N@H+]3Cc2cccnc2)c(Cl)n1 ZINC001164722112 720377637 /nfs/dbraw/zinc/37/76/37/720377637.db2.gz BXKPGAWBNQLPCN-DLBZAZTESA-N 1 1 422.863 3.315 20 0 HGADMO CCN(CC)C(=O)c1cc(Cl)nc(N2CC[C@H]3[C@H]2CC[N@H+]3Cc2cccnc2)c1 ZINC001164731318 720395537 /nfs/dbraw/zinc/39/55/37/720395537.db2.gz ZCBVOBMYAUTLJQ-RBUKOAKNSA-N 1 1 413.953 3.465 20 0 HGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2C[C@@H]3COC[C@@H](CC(=O)NC(C)C)[C@H]3C2)nc1 ZINC001164827197 720424380 /nfs/dbraw/zinc/42/43/80/720424380.db2.gz RSKNOZVCWKERNL-GXRSIYKFSA-N 1 1 414.594 3.242 20 0 HGADMO COC(=O)c1cnc(Cl)c(C(F)(F)N2CC[C@@H]3[C@H]2CC[N@@H+]3Cc2cccnc2)c1 ZINC001164734398 720426339 /nfs/dbraw/zinc/42/63/39/720426339.db2.gz RXWXSZNJYVOLCW-IAGOWNOFSA-N 1 1 422.863 3.315 20 0 HGADMO COC(=O)c1cnc(Cl)c(C(F)(F)N2CC[C@@H]3[C@H]2CC[N@H+]3Cc2cccnc2)c1 ZINC001164734398 720426345 /nfs/dbraw/zinc/42/63/45/720426345.db2.gz RXWXSZNJYVOLCW-IAGOWNOFSA-N 1 1 422.863 3.315 20 0 HGADMO COC(=O)c1ccc(Cl)nc1N1CC[C@@H]2[C@@H](C[C@@H](Cn3cccn3)[N@H+]2C(C)C)C1 ZINC001164841122 720507681 /nfs/dbraw/zinc/50/76/81/720507681.db2.gz XOEWGPSJTKEDDM-XYJFISCASA-N 1 1 417.941 3.096 20 0 HGADMO COC(=O)c1cc(Cl)cnc1N1CC[C@@H]2[C@H](C[C@@H](Cn3cccn3)[N@H+]2C(C)C)C1 ZINC001164833283 720511914 /nfs/dbraw/zinc/51/19/14/720511914.db2.gz CSFDUCMGNNPBAD-HHXXYDBFSA-N 1 1 417.941 3.096 20 0 HGADMO COC(=O)c1c(Cl)ccnc1N1CC[C@@H]2[C@H](C[C@H](Cn3cccn3)[N@H+]2C(C)C)C1 ZINC001164840070 720512773 /nfs/dbraw/zinc/51/27/73/720512773.db2.gz WHBXIDSVFSPAQO-JFIYKMOQSA-N 1 1 417.941 3.096 20 0 HGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@H]2CN(c3nnc(Cl)c4ccncc43)CC[C@@H]21 ZINC001164841571 720516955 /nfs/dbraw/zinc/51/69/55/720516955.db2.gz YZEMEADUTLKVMX-BXWFABGCSA-N 1 1 411.941 3.253 20 0 HGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@@H]2CN(c3nc(Cl)nc4cnccc43)CC[C@@H]21 ZINC001164834912 720528206 /nfs/dbraw/zinc/52/82/06/720528206.db2.gz IFEAFYPKEXZQMK-GJYPPUQNSA-N 1 1 411.941 3.253 20 0 HGADMO COc1ccc2ncc(N3CC[C@@H]4[C@H](C[C@H](Cn5cccn5)[N@H+]4C(C)C)C3)nc2c1 ZINC001164838083 720546091 /nfs/dbraw/zinc/54/60/91/720546091.db2.gz NUULEVMRVRDWOT-JBYIUTFZSA-N 1 1 406.534 3.213 20 0 HGADMO CC(C)[N@@H+]1[C@@H]2CCN(c3nc(Cl)nc4ncsc43)C[C@H]2C[C@H]1Cn1cccn1 ZINC001164838502 720548377 /nfs/dbraw/zinc/54/83/77/720548377.db2.gz ODFPUEYPFPJFCE-QLFBSQMISA-N 1 1 417.970 3.314 20 0 HGADMO CCOC(=O)/C=C/c1ccc(N2CC[C@@H]3[C@H](C[C@@H](Cn4cccn4)[N@H+]3C(C)C)C2)nc1 ZINC001164838549 720567631 /nfs/dbraw/zinc/56/76/31/720567631.db2.gz OLFNMUDEAJOVRW-JUAZRNHOSA-N 1 1 423.561 3.232 20 0 HGADMO CCOC(=O)/C=C\c1ccc(N2CC[C@@H]3[C@H](C[C@@H](Cn4cccn4)[N@H+]3C(C)C)C2)nc1 ZINC001164838547 720568468 /nfs/dbraw/zinc/56/84/68/720568468.db2.gz OLFNMUDEAJOVRW-FHAIDQQUSA-N 1 1 423.561 3.232 20 0 HGADMO COC(OC)c1cc(C)cnc1N1CC[C@@H]2[C@H](C[C@H](Cn3cccn3)[N@H+]2C(C)C)C1 ZINC001164843526 720582276 /nfs/dbraw/zinc/58/22/76/720582276.db2.gz XSPNSLIFWXATEU-SFHLNBCPSA-N 1 1 413.566 3.256 20 0 HGADMO FC(F)(c1cnc(Cl)c(Cl)c1)N1CC[N@@H+]2C[C@@H](Oc3cncnc3)C[C@@H]2C1 ZINC001164746983 720619948 /nfs/dbraw/zinc/61/99/48/720619948.db2.gz YUZOUNQHQREHBH-OLZOCXBDSA-N 1 1 416.259 3.065 20 0 HGADMO FC(F)(c1cnc(Cl)c(Cl)c1)N1CC[N@H+]2C[C@@H](Oc3cncnc3)C[C@@H]2C1 ZINC001164746983 720619949 /nfs/dbraw/zinc/61/99/49/720619949.db2.gz YUZOUNQHQREHBH-OLZOCXBDSA-N 1 1 416.259 3.065 20 0 HGADMO FC(F)(c1cnc(Cl)c(Cl)c1)N1CC[N@@H+]2C[C@@H](Oc3cncnc3)C[C@H]2C1 ZINC001164746989 720619961 /nfs/dbraw/zinc/61/99/61/720619961.db2.gz YUZOUNQHQREHBH-STQMWFEESA-N 1 1 416.259 3.065 20 0 HGADMO FC(F)(c1cnc(Cl)c(Cl)c1)N1CC[N@H+]2C[C@@H](Oc3cncnc3)C[C@H]2C1 ZINC001164746989 720619965 /nfs/dbraw/zinc/61/99/65/720619965.db2.gz YUZOUNQHQREHBH-STQMWFEESA-N 1 1 416.259 3.065 20 0 HGADMO CC(C)[N@@H+]1[C@@H]2CCN(c3cc(N4CCC[C@@H](C)C4)ncn3)C[C@H]2C[C@H]1Cn1cccn1 ZINC001164836252 720624512 /nfs/dbraw/zinc/62/45/12/720624512.db2.gz FNPIOQHVEOSFQR-YUMYIRISSA-N 1 1 423.609 3.287 20 0 HGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@H]2CN(c3cncc(N4CCCCCC4)n3)CC[C@@H]21 ZINC001164839610 720625091 /nfs/dbraw/zinc/62/50/91/720625091.db2.gz NYBYWXPBASPHJJ-FKBYEOEOSA-N 1 1 423.609 3.431 20 0 HGADMO CC(C)OC(=O)c1cccnc1N1CC[C@@H]2[C@@H](C[C@H](Cn3cccn3)[N@H+]2C(C)C)C1 ZINC001164835184 720636882 /nfs/dbraw/zinc/63/68/82/720636882.db2.gz AMEVVDWEWHTWDK-QKNQBKEWSA-N 1 1 411.550 3.221 20 0 HGADMO Clc1cc(Cl)c(N2CC[N@@H+]3C[C@H](Oc4cncnc4)C[C@H]3C2)c(Cl)n1 ZINC001164738198 720658140 /nfs/dbraw/zinc/65/81/40/720658140.db2.gz IMEIDNSGMMLAFK-WDEREUQCSA-N 1 1 400.697 3.174 20 0 HGADMO Clc1cc(Cl)c(N2CC[N@H+]3C[C@H](Oc4cncnc4)C[C@H]3C2)c(Cl)n1 ZINC001164738198 720658152 /nfs/dbraw/zinc/65/81/52/720658152.db2.gz IMEIDNSGMMLAFK-WDEREUQCSA-N 1 1 400.697 3.174 20 0 HGADMO C[N@@H+](Cc1ccccc1)[C@@H]1COC2(C1)CCN(c1nc(Cl)nc3c1COC3)CC2 ZINC001164843833 720678084 /nfs/dbraw/zinc/67/80/84/720678084.db2.gz RHHBVRMDTVOYPC-KRWDZBQOSA-N 1 1 414.937 3.420 20 0 HGADMO Clc1cccc2c1nc(Cl)nc2N1CC[N@H+]2C[C@H](Oc3cncnc3)C[C@H]2C1 ZINC001164742032 720681515 /nfs/dbraw/zinc/68/15/15/720681515.db2.gz VLTQBIZZYKXHFY-QWHCGFSZSA-N 1 1 417.300 3.069 20 0 HGADMO COc1cnnc(Cl)c1N1CCC2(C[C@H]([N@@H+](C)Cc3ccccc3)CO2)CC1 ZINC001164842715 720688548 /nfs/dbraw/zinc/68/85/48/720688548.db2.gz MXWDDCGKYRLTQL-KRWDZBQOSA-N 1 1 402.926 3.399 20 0 HGADMO FC(F)(c1ccc(Cl)c(Cl)n1)N1CC[N@@H+]2C[C@@H](Oc3cncnc3)C[C@@H]2C1 ZINC001164738983 720693013 /nfs/dbraw/zinc/69/30/13/720693013.db2.gz LVMFKITUDQNXFK-NEPJUHHUSA-N 1 1 416.259 3.065 20 0 HGADMO FC(F)(c1ccc(Cl)c(Cl)n1)N1CC[N@H+]2C[C@@H](Oc3cncnc3)C[C@@H]2C1 ZINC001164738983 720693017 /nfs/dbraw/zinc/69/30/17/720693017.db2.gz LVMFKITUDQNXFK-NEPJUHHUSA-N 1 1 416.259 3.065 20 0 HGADMO CCOC(=O)c1ncnc(N2CCC3(C[C@@H]([N@@H+](C)Cc4ccccc4)CO3)CC2)c1C ZINC001164841952 720696847 /nfs/dbraw/zinc/69/68/47/720696847.db2.gz KMJWNFNOOLQHRO-HXUWFJFHSA-N 1 1 424.545 3.222 20 0 HGADMO C[N@@H+](Cc1ccccc1)[C@H]1COC2(C1)CCN(c1c(Cl)nccc1C(N)=O)CC2 ZINC001164836500 720724949 /nfs/dbraw/zinc/72/49/49/720724949.db2.gz BNOHZWZQASMXQV-QGZVFWFLSA-N 1 1 414.937 3.094 20 0 HGADMO FC(F)(Sc1ccc(Cl)nc1)N1CC[N@@H+]2C[C@H](Oc3cncnc3)C[C@H]2C1 ZINC001164748343 720803549 /nfs/dbraw/zinc/80/35/49/720803549.db2.gz QTOKFSAMLVLWKP-QWHCGFSZSA-N 1 1 413.881 3.005 20 0 HGADMO FC(F)(Sc1ccc(Cl)nc1)N1CC[N@H+]2C[C@H](Oc3cncnc3)C[C@H]2C1 ZINC001164748343 720803551 /nfs/dbraw/zinc/80/35/51/720803551.db2.gz QTOKFSAMLVLWKP-QWHCGFSZSA-N 1 1 413.881 3.005 20 0 HGADMO FC(F)(c1cccc(Cl)n1)N1CC[C@@H]2[C@H](C[C@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164745417 720810672 /nfs/dbraw/zinc/81/06/72/720810672.db2.gz KHRDDZWVJNFEQV-BRWVUGGUSA-N 1 1 422.911 3.251 20 0 HGADMO Clc1ccc2nc(N3CC[C@@H]4[C@@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)cnc2c1 ZINC001164740693 720823479 /nfs/dbraw/zinc/82/34/79/720823479.db2.gz KRUFUBVFLXKJAA-DJPFJPOOSA-N 1 1 423.952 3.254 20 0 HGADMO Fc1ccc2nc(N3CC[C@@H]4[C@@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)ccc2c1 ZINC001164744448 720824575 /nfs/dbraw/zinc/82/45/75/720824575.db2.gz UGFTVTGNNCDOOT-RCZSKKKRSA-N 1 1 406.509 3.345 20 0 HGADMO Clc1ccnc2cc(N3CC[C@@H]4[C@@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)ncc12 ZINC001164742112 720826215 /nfs/dbraw/zinc/82/62/15/720826215.db2.gz PWMYTJAHZKZCJG-CSODHUTKSA-N 1 1 423.952 3.254 20 0 HGADMO Clc1ccc2cc(N3CC[C@@H]4[C@@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)ncc2n1 ZINC001164741187 720831291 /nfs/dbraw/zinc/83/12/91/720831291.db2.gz MAJVJDJBWFDXLT-NLWGTHIKSA-N 1 1 423.952 3.254 20 0 HGADMO Clc1cc2cc[nH]c2nc1N1CC[C@@H]2[C@H](C[C@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164741148 720835421 /nfs/dbraw/zinc/83/54/21/720835421.db2.gz DGUOBVABMMREBP-ZHALLVOQSA-N 1 1 411.941 3.139 20 0 HGADMO c1csc(-c2ccc(N3CC[C@@H]4[C@H](C[C@@H](Cn5cncn5)[N@@H+]4CC4CC4)C3)nn2)c1 ZINC001164751126 720836120 /nfs/dbraw/zinc/83/61/20/720836120.db2.gz YNPRRLRFRVPDRM-WSTZPKSXSA-N 1 1 421.574 3.176 20 0 HGADMO Fc1cccc2ccc(N3CC[C@@H]4[C@@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)nc12 ZINC001164742377 720841553 /nfs/dbraw/zinc/84/15/53/720841553.db2.gz GEODDBNWWGOUSX-IRFCIJBXSA-N 1 1 406.509 3.345 20 0 HGADMO c1ncn(C[C@H]2C[C@H]3CN(c4cc(-c5ccccc5)ncn4)CC[C@H]3[N@H+]2CC2CC2)n1 ZINC001164748955 720845648 /nfs/dbraw/zinc/84/56/48/720845648.db2.gz VERXEFRJKQKEDI-QZNHQXDQSA-N 1 1 415.545 3.115 20 0 HGADMO Cc1ccc(-c2ccc(N3CC[C@@H]4[C@@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)nn2)o1 ZINC001164749709 720852416 /nfs/dbraw/zinc/85/24/16/720852416.db2.gz OBPMVHRDWPYYQP-QKNQBKEWSA-N 1 1 419.533 3.016 20 0 HGADMO c1cc(-c2ccc(N3CC[C@@H]4[C@H](C[C@@H](Cn5cncn5)[N@@H+]4CC4CC4)C3)nn2)cs1 ZINC001164749685 720855389 /nfs/dbraw/zinc/85/53/89/720855389.db2.gz OAWZZMMJLBJXLD-SVFBPWRDSA-N 1 1 421.574 3.176 20 0 HGADMO COCC[N@H+]1CCO[C@H]2CN(c3cncc(Sc4cccc(C)c4)n3)CC[C@H]2C1 ZINC001164860270 720869418 /nfs/dbraw/zinc/86/94/18/720869418.db2.gz WEFLGGXFHJEMCV-ICSRJNTNSA-N 1 1 414.575 3.110 20 0 HGADMO Cc1cnc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COCc2cccnc2)c(C)n1 ZINC001164754340 720871628 /nfs/dbraw/zinc/87/16/28/720871628.db2.gz RHJXZHVSEXJUQY-UPVQGACJSA-N 1 1 407.562 3.244 20 0 HGADMO CCOc1ccc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COCc2cccnc2)nn1 ZINC001164750517 720873561 /nfs/dbraw/zinc/87/35/61/720873561.db2.gz JFRNTRAUSXXHJM-XUZZJYLKSA-N 1 1 423.561 3.025 20 0 HGADMO COc1cccnc1N1CC[C@]2(C1)C[N@@H+](CC1CC1)C[C@@H]2COCc1cccnc1 ZINC001164747142 720877976 /nfs/dbraw/zinc/87/79/76/720877976.db2.gz ABSYKTWNNYCIFE-ZJSXRUAMSA-N 1 1 408.546 3.240 20 0 HGADMO COc1cccc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COCc2cccnc2)n1 ZINC001164753498 720878079 /nfs/dbraw/zinc/87/80/79/720878079.db2.gz PQVZCULIIHRDSL-XUZZJYLKSA-N 1 1 408.546 3.240 20 0 HGADMO COCc1ccnc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COCc2cccnc2)c1 ZINC001164757186 720883065 /nfs/dbraw/zinc/88/30/65/720883065.db2.gz UEVPINJZCKAJIR-ZCYQVOJMSA-N 1 1 422.573 3.378 20 0 HGADMO CCc1cc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COCc2cccnc2)nc(C)n1 ZINC001164755919 720897229 /nfs/dbraw/zinc/89/72/29/720897229.db2.gz NFSIOQBUNMEOHB-DHLKQENFSA-N 1 1 421.589 3.498 20 0 HGADMO CC(C)[N@@H+](C)Cc1cnc2n1CCN(c1cc(NC(=O)OC(C)(C)C)ncn1)[C@H]2C ZINC001164861488 720937020 /nfs/dbraw/zinc/93/70/20/720937020.db2.gz SRASFXSNKPEMHW-HNNXBMFYSA-N 1 1 415.542 3.442 20 0 HGADMO CCOC(=O)c1ccc2ncnc(N3CCn4c(C[N@@H+](C)C(C)C)cnc4[C@@H]3C)c2c1 ZINC001164861463 720962024 /nfs/dbraw/zinc/96/20/24/720962024.db2.gz SQPRTTOGVGVHFW-INIZCTEOSA-N 1 1 422.533 3.424 20 0 HGADMO COC(=O)/C=C/c1cc2cc[nH]c2c(N2CCn3c(C[N@@H+](C)C(C)C)cnc3[C@H]2C)n1 ZINC001164859663 720987225 /nfs/dbraw/zinc/98/72/25/720987225.db2.gz KZAGSZJKXGLYOZ-FYCOFBDGSA-N 1 1 422.533 3.367 20 0 HGADMO COC(=O)/C=C\c1cc2cc[nH]c2c(N2CCn3c(C[N@@H+](C)C(C)C)cnc3[C@H]2C)n1 ZINC001164859667 720988382 /nfs/dbraw/zinc/98/83/82/720988382.db2.gz KZAGSZJKXGLYOZ-MWWKQMNYSA-N 1 1 422.533 3.367 20 0 HGADMO Cc1cc(C(F)(F)N2CC[N@H+]3C[C@@H](OCc4cccnc4)C[C@@H]3C2)cc(Cl)n1 ZINC001164867679 721049227 /nfs/dbraw/zinc/04/92/27/721049227.db2.gz JQYCFIBYZLDMJZ-MSOLQXFVSA-N 1 1 408.880 3.463 20 0 HGADMO COc1cc(C(F)(F)N2CC[N@H+]3C[C@H](OCc4cccnc4)C[C@H]3C2)cc(Cl)n1 ZINC001164867784 721054126 /nfs/dbraw/zinc/05/41/26/721054126.db2.gz KLJXYCWRMSQCDR-DLBZAZTESA-N 1 1 424.879 3.163 20 0 HGADMO FC(F)(Oc1cccnc1Cl)N1CC[N@H+]2C[C@H](OCc3cccnc3)C[C@@H]2C1 ZINC001164867956 721064866 /nfs/dbraw/zinc/06/48/66/721064866.db2.gz LJIGDVYBRKNOMS-HZPDHXFCSA-N 1 1 410.852 3.034 20 0 HGADMO Cc1ccc2nc(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@@H]4C3)c(Cl)nc2c1 ZINC001164863963 721080787 /nfs/dbraw/zinc/08/07/87/721080787.db2.gz DKYPTTNWOIOMTF-QZTJIDSGSA-N 1 1 409.921 3.466 20 0 HGADMO Cc1cc(Cl)ncc1C(F)(F)N1CC[N@H+]2C[C@H](OCc3cccnc3)C[C@@H]2C1 ZINC001164865567 721089798 /nfs/dbraw/zinc/08/97/98/721089798.db2.gz NBWPYCJUCBIDNA-IAGOWNOFSA-N 1 1 408.880 3.463 20 0 HGADMO Cc1ccc(Cl)nc1C(F)(F)N1CC[N@H+]2C[C@@H](OCc3cccnc3)C[C@@H]2C1 ZINC001164864560 721109053 /nfs/dbraw/zinc/10/90/53/721109053.db2.gz GGSVBLCBVINJRS-SJORKVTESA-N 1 1 408.880 3.463 20 0 HGADMO Fc1cccc(Oc2ccnc(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@@H]4C3)n2)c1 ZINC001164880702 721126523 /nfs/dbraw/zinc/12/65/23/721126523.db2.gz XDODDAXTJKZJNT-CTNGQTDRSA-N 1 1 421.476 3.283 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4cccc(-c5cccc(Cl)n5)n4)C[C@H]3C2)cn1 ZINC001164770589 721136962 /nfs/dbraw/zinc/13/69/62/721136962.db2.gz RBYZKEKVQINFTO-QZTJIDSGSA-N 1 1 408.937 3.489 20 0 HGADMO COc1ccc(-c2ccc(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@@H]4C3)nn2)cc1 ZINC001164870245 721140104 /nfs/dbraw/zinc/14/01/04/721140104.db2.gz CAMNNGDAKQUJSU-IFMALSPDSA-N 1 1 417.513 3.027 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4ncnc5c4ccn5C4CCCC4)C[C@@H]3C2)cn1 ZINC001164771342 721144253 /nfs/dbraw/zinc/14/42/53/721144253.db2.gz SGJFEEGYZVNDSB-MOPGFXCFSA-N 1 1 405.550 3.238 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4cncc(Oc5cccc(F)c5)n4)C[C@@H]3C2)cn1 ZINC001164768289 721170211 /nfs/dbraw/zinc/17/02/11/721170211.db2.gz KTYMVLFZTLIHOQ-MSOLQXFVSA-N 1 1 408.481 3.100 20 0 HGADMO COc1cc2nc(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@@H]4C3)ccc2c(OC)c1 ZINC001164872703 721181319 /nfs/dbraw/zinc/18/13/19/721181319.db2.gz IEIORFVVCCCCLH-UYAOXDASSA-N 1 1 420.513 3.127 20 0 HGADMO CCOc1ccc(-c2ccc(N3C[C@@H]4CC[N@@H+](Cc5cnn(C)c5)C[C@H]4C3)nn2)cc1 ZINC001164770103 721217844 /nfs/dbraw/zinc/21/78/44/721217844.db2.gz NBCPWSSIWJCMJX-SFTDATJTSA-N 1 1 418.545 3.234 20 0 HGADMO Cc1cnc(N2C[C@@H]3CC[N@H+](Cc4cnn(C)c4)C[C@@H]3C2)nc1-c1ccccc1F ZINC001164762511 721238904 /nfs/dbraw/zinc/23/89/04/721238904.db2.gz LASHFJIZMPGZBA-RBUKOAKNSA-N 1 1 406.509 3.283 20 0 HGADMO CN(C)C1=NOC2(C1)CCN(c1ccc3c(n1)CC[N@H+](Cc1ccccc1)C3)CC2 ZINC001164880473 721326216 /nfs/dbraw/zinc/32/62/16/721326216.db2.gz XOXKXEOWJWONFW-UHFFFAOYSA-N 1 1 405.546 3.274 20 0 HGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@@]2(CCCN(c3nccc(C(C)(C)C)n3)C2)C1 ZINC001164776343 721346098 /nfs/dbraw/zinc/34/60/98/721346098.db2.gz AQZRFACAUYVWSQ-QHCPKHFHSA-N 1 1 413.566 3.498 20 0 HGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@@]2(CCCN(c3nccc(C(C)(C)C)n3)C2)C1 ZINC001164776343 721346101 /nfs/dbraw/zinc/34/61/01/721346101.db2.gz AQZRFACAUYVWSQ-QHCPKHFHSA-N 1 1 413.566 3.498 20 0 HGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@]2(CCCN(c3ccc4cccnc4n3)C2)C1 ZINC001164777310 721347733 /nfs/dbraw/zinc/34/77/33/721347733.db2.gz FZBALCFTVFQVIU-HSZRJFAPSA-N 1 1 407.518 3.354 20 0 HGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@]2(CCCN(c3ncnc4c3CCCC4)C2)C1 ZINC001164778202 721347898 /nfs/dbraw/zinc/34/78/98/721347898.db2.gz KWEURQKTPLVFFW-HSZRJFAPSA-N 1 1 411.550 3.079 20 0 HGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@]2(CCCN(c3ncnc4c3CCCC4)C2)C1 ZINC001164778202 721347904 /nfs/dbraw/zinc/34/79/04/721347904.db2.gz KWEURQKTPLVFFW-HSZRJFAPSA-N 1 1 411.550 3.079 20 0 HGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@]2(CCCN(c3cc4ccccc4nn3)C2)C1 ZINC001164779984 721351872 /nfs/dbraw/zinc/35/18/72/721351872.db2.gz XVDDGXYEFXUFKB-HSZRJFAPSA-N 1 1 407.518 3.354 20 0 HGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@]2(CCCN(c3cc4ccccc4nn3)C2)C1 ZINC001164779984 721351875 /nfs/dbraw/zinc/35/18/75/721351875.db2.gz XVDDGXYEFXUFKB-HSZRJFAPSA-N 1 1 407.518 3.354 20 0 HGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@]2(CCCN(c3nccc4cnccc43)C2)C1 ZINC001164787010 721358205 /nfs/dbraw/zinc/35/82/05/721358205.db2.gz WZGVLYDGFYNRMT-HSZRJFAPSA-N 1 1 407.518 3.354 20 0 HGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@@]2(CCCN(c3nccc(C(F)F)n3)C2)C1 ZINC001164780029 721363424 /nfs/dbraw/zinc/36/34/24/721363424.db2.gz CMCOBPGPISHIKB-FQEVSTJZSA-N 1 1 407.465 3.138 20 0 HGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@@]2(CCCN(c3nccc(C(F)F)n3)C2)C1 ZINC001164780029 721363428 /nfs/dbraw/zinc/36/34/28/721363428.db2.gz CMCOBPGPISHIKB-FQEVSTJZSA-N 1 1 407.465 3.138 20 0 HGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@@]2(CCCN(c3ncc4c(n3)CCCC4)C2)C1 ZINC001164780268 721372364 /nfs/dbraw/zinc/37/23/64/721372364.db2.gz FHMOQUFZMFOTTK-QHCPKHFHSA-N 1 1 411.550 3.079 20 0 HGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@@]2(CCCN(c3ncc4c(n3)CCCC4)C2)C1 ZINC001164780268 721372367 /nfs/dbraw/zinc/37/23/67/721372367.db2.gz FHMOQUFZMFOTTK-QHCPKHFHSA-N 1 1 411.550 3.079 20 0 HGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@]2(CCCN(c3ccc(Cl)c(N)n3)C2)C1 ZINC001164785388 721375637 /nfs/dbraw/zinc/37/56/37/721375637.db2.gz SCAKNWAVZIVHCB-HXUWFJFHSA-N 1 1 405.930 3.041 20 0 HGADMO C[NH+]1CCN(C[C@H]2CCC[C@@]3(CCN(C(F)(F)c4cccc(Cl)n4)C3)O2)CC1 ZINC001164894574 721381992 /nfs/dbraw/zinc/38/19/92/721381992.db2.gz ZDFRDEBACHWHNJ-APWZRJJASA-N 1 1 414.928 3.045 20 0 HGADMO C[NH+]1CCN(C[C@H]2CCC[C@@]3(CCN(c4nnc(Cl)c5ccsc54)C3)O2)CC1 ZINC001164889323 721395740 /nfs/dbraw/zinc/39/57/40/721395740.db2.gz LSAJFJMVHNTTBB-QRWLVFNGSA-N 1 1 421.998 3.110 20 0 HGADMO C[NH+]1CCN(C[C@H]2CCC[C@]3(CCN(c4cnc5cc(Cl)ccc5n4)C3)O2)CC1 ZINC001164883510 721402796 /nfs/dbraw/zinc/40/27/96/721402796.db2.gz AHMPDAYZXPAVBO-XMSQKQJNSA-N 1 1 415.969 3.049 20 0 HGADMO CCOC(=O)c1c(C)cc(Cl)nc1N1C[C@@H]2C[NH+](Cc3nccs3)C[C@H]2C1 ZINC001164782908 721403553 /nfs/dbraw/zinc/40/35/53/721403553.db2.gz HAIZNDMPQAVIIX-KBPBESRZSA-N 1 1 406.939 3.245 20 0 HGADMO CSc1cc(Cl)ncc1N1CC[C@]2(C1)CCC[C@@H](CN1CC[NH+](C)CC1)O2 ZINC001164885224 721403889 /nfs/dbraw/zinc/40/38/89/721403889.db2.gz GIUCPGWHHDAIRZ-JXFKEZNVSA-N 1 1 411.015 3.222 20 0 HGADMO COc1ccc2nc(N3CC[C@@]4(C3)CCC[C@H](CN3CC[NH+](C)CC3)O4)cc(C)c2c1 ZINC001164893016 721412054 /nfs/dbraw/zinc/41/20/54/721412054.db2.gz ZVXZWKVQNNHBNI-PXDATVDWSA-N 1 1 424.589 3.317 20 0 HGADMO CCOC(=O)c1cc2ccccc2nc1N1C[C@@H]2C[N@@H+](Cc3nccs3)C[C@@H]2C1 ZINC001164781759 721417929 /nfs/dbraw/zinc/41/79/29/721417929.db2.gz DTLIVUBIKIDINA-CALCHBBNSA-N 1 1 408.527 3.436 20 0 HGADMO CCOC(=O)c1cc2ccccc2nc1N1C[C@@H]2C[N@H+](Cc3nccs3)C[C@@H]2C1 ZINC001164781759 721417932 /nfs/dbraw/zinc/41/79/32/721417932.db2.gz DTLIVUBIKIDINA-CALCHBBNSA-N 1 1 408.527 3.436 20 0 HGADMO C[NH+]1CCN(C[C@@H]2CCC[C@]3(CCN(c4cccc(OC(C)(C)C)n4)C3)O2)CC1 ZINC001164891458 721419096 /nfs/dbraw/zinc/41/90/96/721419096.db2.gz WHUJHLYROGXRRE-WMZHIEFXSA-N 1 1 402.583 3.024 20 0 HGADMO COC(=O)c1nc(N2C[C@H]3C[NH+](Cc4nccs4)C[C@@H]3C2)c2ccccc2c1OC ZINC001164781974 721431986 /nfs/dbraw/zinc/43/19/86/721431986.db2.gz DXUPQCCMECXUQF-HUUCEWRRSA-N 1 1 424.526 3.055 20 0 HGADMO Cc1cc(N2C[C@H]3C[NH+](Cc4nccs4)C[C@@H]3C2)nc(NC(=O)c2ccccc2)n1 ZINC001164791257 721433247 /nfs/dbraw/zinc/43/32/47/721433247.db2.gz ZSKNLLMVRXIXPJ-QZTJIDSGSA-N 1 1 420.542 3.062 20 0 HGADMO CCCc1cncnc1N1CCC2(C[C@H](COCC3CC3)[N@@H+](CCOC)C2)CC1 ZINC001164789838 721458517 /nfs/dbraw/zinc/45/85/17/721458517.db2.gz XQKHYJLPFSYGBI-OAQYLSRUSA-N 1 1 402.583 3.163 20 0 HGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1nccc3ncsc31)CC2 ZINC001164785511 721464041 /nfs/dbraw/zinc/46/40/41/721464041.db2.gz LVRXORYLIBOGBW-SFHVURJKSA-N 1 1 416.591 3.425 20 0 HGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1cc(C)nc(C3CC3)n1)CC2 ZINC001164791723 721468583 /nfs/dbraw/zinc/46/85/83/721468583.db2.gz XZTYEZXCLCKKKC-OAQYLSRUSA-N 1 1 414.594 3.396 20 0 HGADMO C[N@@H+](Cc1ccncc1)C1CC2(C1)CCN(c1nc(Cl)c(F)cc1C(N)=O)CC2 ZINC001164791366 721492846 /nfs/dbraw/zinc/49/28/46/721492846.db2.gz BRGODHYIKBRQRJ-UHFFFAOYSA-N 1 1 417.916 3.249 20 0 HGADMO COC(=O)c1nc(Cl)cc(N2CCC3(CC([N@@H+](C)Cc4ccncc4)C3)CC2)n1 ZINC001164795052 721502537 /nfs/dbraw/zinc/50/25/37/721502537.db2.gz BRDHHPOCZWSQAJ-UHFFFAOYSA-N 1 1 415.925 3.193 20 0 HGADMO COc1nc(N2CCC3(CC([N@@H+](C)Cc4ccncc4)C3)CC2)nc2c1ccn2C ZINC001164795578 721503956 /nfs/dbraw/zinc/50/39/56/721503956.db2.gz LRPFPDHYIBBBRB-UHFFFAOYSA-N 1 1 406.534 3.253 20 0 HGADMO COc1cc2ncc(N3CC[N@H+]4C[C@H](Oc5cccc(F)c5)C[C@H]4C3)nc2cc1OC ZINC001164905201 721531008 /nfs/dbraw/zinc/53/10/08/721531008.db2.gz GNPSHJCHAWJTJF-FUHWJXTLSA-N 1 1 424.476 3.128 20 0 HGADMO COc1cc2ncnc(N3CC[N@H+]4C[C@H](Oc5cccc(F)c5)C[C@@H]4C3)c2c(OC)c1 ZINC001164903455 721538060 /nfs/dbraw/zinc/53/80/60/721538060.db2.gz CRPOTYRRGPBHER-VQIMIIECSA-N 1 1 424.476 3.128 20 0 HGADMO CSc1nc2ncnc(N3CC[N@H+]4C[C@H](Oc5cccc(F)c5)C[C@H]4C3)c2s1 ZINC001164909325 721545306 /nfs/dbraw/zinc/54/53/06/721545306.db2.gz RLAYZLUSALVLOV-DZGCQCFKSA-N 1 1 417.535 3.289 20 0 HGADMO CC(C)(C)NC(=O)c1ccnc(N2CC[N@H+]3C[C@H](Oc4cccc(F)c4)C[C@@H]3C2)c1 ZINC001164903475 721546353 /nfs/dbraw/zinc/54/63/53/721546353.db2.gz CWXFKZIINIJVAT-UYAOXDASSA-N 1 1 412.509 3.091 20 0 HGADMO CCOC(=O)c1nc(N2CC[N@H+]3C[C@H](Oc4cccc(F)c4)C[C@H]3C2)ccc1Cl ZINC001164902979 721547360 /nfs/dbraw/zinc/54/73/60/721547360.db2.gz BPDYEWRHLJPOAB-DOTOQJQBSA-N 1 1 419.884 3.393 20 0 HGADMO Cc1nc(-c2ccncc2)cc(N2CC[N@H+]3C[C@H](Oc4cccc(F)c4)C[C@H]3C2)n1 ZINC001164909711 721558137 /nfs/dbraw/zinc/55/81/37/721558137.db2.gz UPMBTXSAPYDAQD-PZJWPPBQSA-N 1 1 405.477 3.328 20 0 HGADMO COc1ccc2nc(N3CC[N@H+]4C[C@@H](Oc5cccc(F)c5)C[C@@H]4C3)c(C)nc2c1 ZINC001164910346 721558742 /nfs/dbraw/zinc/55/87/42/721558742.db2.gz WJHBFNMACODGLV-XLIONFOSSA-N 1 1 408.477 3.428 20 0 HGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(C(F)(F)c2cc(N)cc(Cl)n2)[C@@H]2CCCO[C@H]12 ZINC001164800327 721561880 /nfs/dbraw/zinc/56/18/80/721561880.db2.gz DUTDRUMLUHUJHL-MDZRGWNJSA-N 1 1 423.895 3.125 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(C(F)(F)c2cc(N)cc(Cl)n2)[C@@H]2CCCO[C@H]12 ZINC001164800327 721561884 /nfs/dbraw/zinc/56/18/84/721561884.db2.gz DUTDRUMLUHUJHL-MDZRGWNJSA-N 1 1 423.895 3.125 20 0 HGADMO CCOC(=O)c1c(C)cc(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@H]3OCCC[C@@H]32)nc1C ZINC001164805405 721562596 /nfs/dbraw/zinc/56/25/96/721562596.db2.gz NRVPBORBNQNGEZ-JTAQYXEDSA-N 1 1 424.545 3.138 20 0 HGADMO COC(=O)c1cc(Cl)c(N2CC[N@H+]3C[C@H](Oc4cccc(F)c4)C[C@@H]3C2)nc1C ZINC001164907561 721564151 /nfs/dbraw/zinc/56/41/51/721564151.db2.gz OLTOQGGEBWCJKN-NVXWUHKLSA-N 1 1 419.884 3.311 20 0 HGADMO COC(=O)c1cc(Cl)c(N2CC[N@H+]3C[C@H](Oc4cccc(F)c4)C[C@H]3C2)nc1C ZINC001164907560 721564473 /nfs/dbraw/zinc/56/44/73/721564473.db2.gz OLTOQGGEBWCJKN-DOTOQJQBSA-N 1 1 419.884 3.311 20 0 HGADMO CSc1cc(N2CC[N@H+]3C[C@H](Oc4cccc(F)c4)C[C@@H]3C2)nc(SC)n1 ZINC001164907225 721566309 /nfs/dbraw/zinc/56/63/09/721566309.db2.gz MWLAYWIKSNVDQC-GDBMZVCRSA-N 1 1 406.552 3.401 20 0 HGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(C(F)(F)c2cnc(Cl)c(N)c2)[C@H]2CCCO[C@H]12 ZINC001164806677 721573904 /nfs/dbraw/zinc/57/39/04/721573904.db2.gz QQUDIXWSOBIKFJ-KSZLIROESA-N 1 1 423.895 3.125 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(C(F)(F)c2cnc(Cl)c(N)c2)[C@H]2CCCO[C@H]12 ZINC001164806677 721573908 /nfs/dbraw/zinc/57/39/08/721573908.db2.gz QQUDIXWSOBIKFJ-KSZLIROESA-N 1 1 423.895 3.125 20 0 HGADMO CCN(C)c1cc(C)nc(N2CCC(F)(F)[C@]3(CC[N@H+](Cc4ccccn4)C3)C2)n1 ZINC001164902216 721582957 /nfs/dbraw/zinc/58/29/57/721582957.db2.gz DEOCWQMMILXQNE-NRFANRHFSA-N 1 1 416.520 3.374 20 0 HGADMO CCN(C)c1cc(C)nc(N2CCC(F)(F)[C@]3(CC[N@@H+](Cc4ccccn4)C3)C2)n1 ZINC001164902216 721582960 /nfs/dbraw/zinc/58/29/60/721582960.db2.gz DEOCWQMMILXQNE-NRFANRHFSA-N 1 1 416.520 3.374 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2nc(C3CCC3)nc3[nH]ccc32)[C@H]2CCCO[C@@H]12 ZINC001164802540 721591569 /nfs/dbraw/zinc/59/15/69/721591569.db2.gz GGVYOQJWIPSKAY-PWRODBHTSA-N 1 1 418.545 3.489 20 0 HGADMO Cc1nc(N(C)C)nc2c1COC[C@@]21CC[N@H+](C(C)(C)c2ccnc(Cl)c2)C1 ZINC001164801228 721606915 /nfs/dbraw/zinc/60/69/15/721606915.db2.gz GEKFILYMUONVIA-NRFANRHFSA-N 1 1 401.942 3.308 20 0 HGADMO C[C@@H]1CC(=O)Nc2ncnc(N3CCc4c(C[N@H+](C)Cc5ccco5)cncc4C3)c21 ZINC001164909571 721755763 /nfs/dbraw/zinc/75/57/63/721755763.db2.gz IBYSIQQALNYAIJ-OAHLLOKOSA-N 1 1 418.501 3.105 20 0 HGADMO C[C@@H]1CC(=O)Nc2ncnc(N3CCc4c(C[N@@H+](C)Cc5ccco5)cncc4C3)c21 ZINC001164909571 721755765 /nfs/dbraw/zinc/75/57/65/721755765.db2.gz IBYSIQQALNYAIJ-OAHLLOKOSA-N 1 1 418.501 3.105 20 0 HGADMO COc1cnc(N2C[C@@H]3CCC[C@H]([N@@H+](C)Cc4ccccn4)[C@H]3C2)nc1NC(C)C ZINC001165024453 721798128 /nfs/dbraw/zinc/79/81/28/721798128.db2.gz LBOFVLSYHXEEIF-IHPCNDPISA-N 1 1 410.566 3.437 20 0 HGADMO CC(C)OC(=O)c1ccc(N2C[C@@H]3CCC[C@@H]([N@@H+](C)Cc4ccccn4)[C@H]3C2)nn1 ZINC001165027344 721805443 /nfs/dbraw/zinc/80/54/43/721805443.db2.gz VNRKOXDODYOKJX-HFSMHLIXSA-N 1 1 409.534 3.174 20 0 HGADMO CC(C)OC(=O)c1ccc(N2C[C@@H]3CCC[C@H]([N@@H+](C)Cc4ccccn4)[C@H]3C2)nn1 ZINC001165027337 721805526 /nfs/dbraw/zinc/80/55/26/721805526.db2.gz VNRKOXDODYOKJX-CUWPLCDZSA-N 1 1 409.534 3.174 20 0 HGADMO CCOC(=O)c1cc(C)nc(N2C[C@@H]3CCC[C@@H]([N@@H+](C)Cc4ccccn4)[C@H]3C2)n1 ZINC001165023412 721806867 /nfs/dbraw/zinc/80/68/67/721806867.db2.gz JSWIZNUVYXTZCE-HFSMHLIXSA-N 1 1 409.534 3.094 20 0 HGADMO C[N@@H+](Cc1ccc(N2CCO[C@@H]3[C@@H](COCc4nccs4)CC[C@@H]32)nc1)C1CC1 ZINC001164916707 721811159 /nfs/dbraw/zinc/81/11/59/721811159.db2.gz ITXWOPNJKNJTLN-ZWCUEREDSA-N 1 1 414.575 3.333 20 0 HGADMO C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@@H]2CN(c3cc(C(=O)N4CCCC4)ccn3)C[C@H]21 ZINC001165026131 721819119 /nfs/dbraw/zinc/81/91/19/721819119.db2.gz PHSGHJNCGZXCHK-YMPZKCBVSA-N 1 1 419.573 3.450 20 0 HGADMO CON(C)C(=O)c1cc(C)cnc1N1C[C@@H]2CCC[C@@H]([N@@H+](C)Cc3ccccn3)[C@@H]2C1 ZINC001165023591 721820029 /nfs/dbraw/zinc/82/00/29/721820029.db2.gz ICNDTQNOARCCCW-VLCRHTCISA-N 1 1 423.561 3.155 20 0 HGADMO C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@@H]2CN(c3cc(N4CCSCC4)ncn3)C[C@@H]21 ZINC001165025652 721827936 /nfs/dbraw/zinc/82/79/36/721827936.db2.gz NFDIDNQRUIJKDH-HLAWJBBLSA-N 1 1 424.618 3.162 20 0 HGADMO COC(=O)c1ccc(-c2ccc(N3CC[C@H]4[C@@H]3CC[N@H+]4CCN(C)C)nc2C)cc1 ZINC001164922386 721876669 /nfs/dbraw/zinc/87/66/69/721876669.db2.gz GKFZZNBRNCROKP-VXKWHMMOSA-N 1 1 408.546 3.058 20 0 HGADMO COC(=O)c1ccc(-c2ccc(N3CC[C@H]4[C@@H]3CCN4CC[NH+](C)C)nc2C)cc1 ZINC001164922386 721876671 /nfs/dbraw/zinc/87/66/71/721876671.db2.gz GKFZZNBRNCROKP-VXKWHMMOSA-N 1 1 408.546 3.058 20 0 HGADMO CN(C)CC[N@@H+]1CC[C@@H]2[C@H]1CCN2c1ccc(C(=O)Nc2cccc(Cl)c2)cn1 ZINC001164933345 721880173 /nfs/dbraw/zinc/88/01/73/721880173.db2.gz MICBUYXZXVUQEF-WOJBJXKFSA-N 1 1 413.953 3.202 20 0 HGADMO CN(C)CC[N@H+]1CC[C@@H]2[C@H]1CCN2c1ccc(C(=O)Nc2cccc(Cl)c2)cn1 ZINC001164933345 721880174 /nfs/dbraw/zinc/88/01/74/721880174.db2.gz MICBUYXZXVUQEF-WOJBJXKFSA-N 1 1 413.953 3.202 20 0 HGADMO CN(C)CC[N@@H+]1CC[C@@H]2[C@H]1CCN2c1cnc(Cl)nc1Oc1ccccc1F ZINC001164935562 721888496 /nfs/dbraw/zinc/88/84/96/721888496.db2.gz XSPPVCCOVIMWIU-HZPDHXFCSA-N 1 1 405.905 3.276 20 0 HGADMO CN(C)CC[N@H+]1CC[C@@H]2[C@H]1CCN2c1cnc(Cl)nc1Oc1ccccc1F ZINC001164935562 721888497 /nfs/dbraw/zinc/88/84/97/721888497.db2.gz XSPPVCCOVIMWIU-HZPDHXFCSA-N 1 1 405.905 3.276 20 0 HGADMO F[C@@H](Oc1cccc(-c2ccc(Cl)nn2)c1)N1CC[NH+](C[C@@H]2CCCO2)CC1 ZINC001165043459 721920748 /nfs/dbraw/zinc/92/07/48/721920748.db2.gz KJVISTKPTAJIFE-FXAWDEMLSA-N 1 1 406.889 3.226 20 0 HGADMO CCOC(=O)Cc1cccnc1N1CCC2(CC1)C[N@@H+](Cc1ccc(C)cc1)CCO2 ZINC001164939382 721922982 /nfs/dbraw/zinc/92/29/82/721922982.db2.gz KZFRVKNCNQVPIW-UHFFFAOYSA-N 1 1 423.557 3.367 20 0 HGADMO Cc1ccc(C[N@H+]2CCOC3(CCN(c4ccc(C(=O)NC5CC5)cn4)CC3)C2)cc1 ZINC001164938927 721927409 /nfs/dbraw/zinc/92/74/09/721927409.db2.gz CAWRDOWKFWHWGP-UHFFFAOYSA-N 1 1 420.557 3.154 20 0 HGADMO CC(=O)N1CC[C@@]2(c3ccccc3)CCN(c3ccc(C[N@H+](C)C4CC4)cn3)C[C@@H]12 ZINC001164947816 721967733 /nfs/dbraw/zinc/96/77/33/721967733.db2.gz RNIUQHIOUGNEQR-ILBGXUMGSA-N 1 1 404.558 3.445 20 0 HGADMO CCc1cc2c(ccnc2N2CCC3(CC2)C(=O)NCC[N@H+]3Cc2ccccc2)o1 ZINC001164948967 721981199 /nfs/dbraw/zinc/98/11/99/721981199.db2.gz NSSFSNKWEWVEOU-UHFFFAOYSA-N 1 1 404.514 3.361 20 0 HGADMO CCc1cc2c(ccnc2N2CCC3(CC2)C(=O)NCC[N@@H+]3Cc2ccccc2)o1 ZINC001164948967 721981201 /nfs/dbraw/zinc/98/12/01/721981201.db2.gz NSSFSNKWEWVEOU-UHFFFAOYSA-N 1 1 404.514 3.361 20 0 HGADMO Cc1nc2c(nc(Cl)nc2N2CCC3(CC[N@@H+](Cc4cccnc4)C3)CC2)n1C ZINC001164955624 722021118 /nfs/dbraw/zinc/02/11/18/722021118.db2.gz KTDKDPVCCVYMJT-UHFFFAOYSA-N 1 1 411.941 3.213 20 0 HGADMO Cc1[nH]c2ncnc(N3CCC4(CC3)COCC[N@@H+](Cc3ccncc3)C4)c2c1C ZINC001164963930 722056921 /nfs/dbraw/zinc/05/69/21/722056921.db2.gz PUUGKOOOSCQUSP-UHFFFAOYSA-N 1 1 406.534 3.089 20 0 HGADMO c1csc(-c2nccc(N3CCC4(CC3)COCC[N@H+](Cc3ccncc3)C4)n2)n1 ZINC001164962862 722062432 /nfs/dbraw/zinc/06/24/32/722062432.db2.gz AIINNFFUIFYENY-UHFFFAOYSA-N 1 1 422.558 3.114 20 0 HGADMO CCOC(=O)c1c(Cl)c2ccccc2nc1N1C[C@@H]2C[N@H+](CC3CC3)C[C@H](C1)O2 ZINC001164967835 722075160 /nfs/dbraw/zinc/07/51/60/722075160.db2.gz YTUVSVJHTPKGSR-IYBDPMFKSA-N 1 1 415.921 3.364 20 0 HGADMO Cc1nc(Cl)cc(C(F)(F)N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)n1 ZINC001164985705 722105590 /nfs/dbraw/zinc/10/55/90/722105590.db2.gz WGTJXLIJJFZDAL-IAGOWNOFSA-N 1 1 423.895 3.106 20 0 HGADMO Clc1cccc2c1ncnc2N1CC[C@@H]2C[N@@H+](Cc3cccnc3)CCO[C@@H]2C1 ZINC001164981613 722106298 /nfs/dbraw/zinc/10/62/98/722106298.db2.gz LTMDNGATOPXPNO-YLJYHZDGSA-N 1 1 409.921 3.406 20 0 HGADMO Cc1nc2ccc(F)cc2c(N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)n1 ZINC001164984673 722107822 /nfs/dbraw/zinc/10/78/22/722107822.db2.gz TWXHELHCSBGPOQ-XMSQKQJNSA-N 1 1 407.493 3.200 20 0 HGADMO Cc1nc2ccc(F)cc2c(N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)n1 ZINC001164984672 722108047 /nfs/dbraw/zinc/10/80/47/722108047.db2.gz TWXHELHCSBGPOQ-PGRDOPGGSA-N 1 1 407.493 3.200 20 0 HGADMO Clc1ncnc2scc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)c21 ZINC001164974091 722110544 /nfs/dbraw/zinc/11/05/44/722110544.db2.gz ILJLCQFZKBKCNA-WBVHZDCISA-N 1 1 415.950 3.467 20 0 HGADMO Clc1ccc2cnc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)nc2c1 ZINC001164981015 722125786 /nfs/dbraw/zinc/12/57/86/722125786.db2.gz RXZJGVYTNBTKFP-RXVVDRJESA-N 1 1 409.921 3.406 20 0 HGADMO Clc1ccnc2cnc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)cc12 ZINC001164978362 722127692 /nfs/dbraw/zinc/12/76/92/722127692.db2.gz OMNLZPWNSWMVHC-DYESRHJHSA-N 1 1 409.921 3.406 20 0 HGADMO c1csc(-c2ccc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)nn2)c1 ZINC001164982537 722128272 /nfs/dbraw/zinc/12/82/72/722128272.db2.gz WYVWJZFNFRZKMS-UYAOXDASSA-N 1 1 407.543 3.327 20 0 HGADMO CCCN(CCC)c1cc(N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)ncn1 ZINC001164975197 722131628 /nfs/dbraw/zinc/13/16/28/722131628.db2.gz FNBQVZQZRGRNNN-YADHBBJMSA-N 1 1 424.593 3.225 20 0 HGADMO Clc1ccnc2ccc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)nc12 ZINC001164978087 722135622 /nfs/dbraw/zinc/13/56/22/722135622.db2.gz JQUUOAADWVJPOI-YLJYHZDGSA-N 1 1 409.921 3.406 20 0 HGADMO c1ccc(-c2cnc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)cn2)cc1 ZINC001164978018 722140610 /nfs/dbraw/zinc/14/06/10/722140610.db2.gz JDTVVWJOZZOWFH-GGAORHGYSA-N 1 1 401.514 3.266 20 0 HGADMO c1cncc(C[N@H+]2CCO[C@H]3CN(c4nccc5c6c([nH]c54)CCC6)CC[C@@H]3C2)c1 ZINC001164971195 722153854 /nfs/dbraw/zinc/15/38/54/722153854.db2.gz BCMJXPGGJVTUHP-GCJKJVERSA-N 1 1 403.530 3.174 20 0 HGADMO c1cncc(C[N@H+]2CCO[C@H]3CN(c4nccc5c6c([nH]c54)CCC6)CC[C@H]3C2)c1 ZINC001164971192 722153982 /nfs/dbraw/zinc/15/39/82/722153982.db2.gz BCMJXPGGJVTUHP-AVRDEDQJSA-N 1 1 403.530 3.174 20 0 HGADMO Fc1cccc(CN2CC[C@]23CCCN(c2nc(Cl)nc4c2CC[NH2+]C4)C3)c1 ZINC001164993651 722194193 /nfs/dbraw/zinc/19/41/93/722194193.db2.gz GTQYALCZVFSHBM-NRFANRHFSA-N 1 1 401.917 3.160 20 0 HGADMO COC(=O)c1nc(Cl)cc(N2CCC[C@]3(CC[N@H+]3Cc3cccc(F)c3)C2)n1 ZINC001164996549 722210556 /nfs/dbraw/zinc/21/05/56/722210556.db2.gz NVVWLYBSICRXFX-FQEVSTJZSA-N 1 1 404.873 3.301 20 0 HGADMO COc1ccc(C[C@@](C)(CO)[NH2+]Cc2nc(-c3ccc(F)c(F)c3)no2)cc1OC ZINC001473840516 1126201136 /nfs/dbraw/zinc/20/11/36/1126201136.db2.gz ZNCGXTKFGGSMOU-NRFANRHFSA-N 1 1 419.428 3.115 20 0 HGADMO COc1ccc(C[C@](C)(CO)[NH2+]Cc2nnc(-c3cccc(Cl)c3)o2)cc1OC ZINC001560185626 1126209990 /nfs/dbraw/zinc/20/99/90/1126209990.db2.gz WJIRRBGLQSFRQZ-OAQYLSRUSA-N 1 1 417.893 3.491 20 0 HGADMO C[C@@H]1CN(c2cc(NS(=O)(=O)c3ccc(Cl)nc3)ccc2F)[C@@H](C)C[N@@H+]1C ZINC001164638428 719244718 /nfs/dbraw/zinc/24/47/18/719244718.db2.gz YVRRNYXBJPLHHK-OLZOCXBDSA-N 1 1 412.918 3.204 20 0 HGADMO C[C@@H]1CN(c2cc(NS(=O)(=O)c3ccc(Cl)nc3)ccc2F)[C@@H](C)C[N@H+]1C ZINC001164638428 719244719 /nfs/dbraw/zinc/24/47/19/719244719.db2.gz YVRRNYXBJPLHHK-OLZOCXBDSA-N 1 1 412.918 3.204 20 0 HGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2C[C@@H]3CCCO[C@@H]3[C@@H](N3CCCC3=O)C2)nc1 ZINC001164646041 719305757 /nfs/dbraw/zinc/30/57/57/719305757.db2.gz AVLUJUXDMCANRD-XARGGIHNSA-N 1 1 412.578 3.235 20 0 HGADMO CC(C)n1nc(C[NH+](C)C)c2c1CN(c1nc(-c3ccccc3)nc(N(C)C)n1)CC2 ZINC001164647649 719312213 /nfs/dbraw/zinc/31/22/13/719312213.db2.gz DRBQWUUBXHIBIQ-UHFFFAOYSA-N 1 1 420.565 3.006 20 0 HGADMO Cc1cc(NC(=O)c2cccnc2N2CCc3c(C[NH+](C)C)nn(C(C)C)c3C2)no1 ZINC001164651332 719314688 /nfs/dbraw/zinc/31/46/88/719314688.db2.gz JALSSLGZAMOENO-UHFFFAOYSA-N 1 1 423.521 3.032 20 0 HGADMO CC(C)n1nc(C[NH+](C)C)c2c1CN(c1cc(-c3nc(C4CC4)no3)ccn1)CC2 ZINC001164652869 719316857 /nfs/dbraw/zinc/31/68/57/719316857.db2.gz RYWSPQGBXISOOC-UHFFFAOYSA-N 1 1 407.522 3.411 20 0 HGADMO CCCSc1ncnc(N2CCc3c(C[NH+](C)C)nn(C(C)C)c3C2)c1OC ZINC001164649243 719317748 /nfs/dbraw/zinc/31/77/48/719317748.db2.gz AQEXJBHKJNHOFB-UHFFFAOYSA-N 1 1 404.584 3.389 20 0 HGADMO CCn1nnc2c1[C@@H](COC)CN(c1ccc3c(n1)CC[N@H+](Cc1ccccc1)C3)C2 ZINC001164663071 719360660 /nfs/dbraw/zinc/36/06/60/719360660.db2.gz HUMJKXKGFIHIEX-HXUWFJFHSA-N 1 1 418.545 3.002 20 0 HGADMO CN(C[C@@H](O)CO)c1nc(C[NH+]2CCCCC2)nc2scc(-c3cccs3)c21 ZINC001164672621 719366127 /nfs/dbraw/zinc/36/61/27/719366127.db2.gz ZFCUZRFZJURFAY-CQSZACIVSA-N 1 1 418.588 3.195 20 0 HGADMO CNC(=O)C[N@H+]1CCCC12CCN(c1cc(F)ccc1-c1ccc(Cl)nn1)CC2 ZINC001164690206 719747583 /nfs/dbraw/zinc/74/75/83/719747583.db2.gz UYTHUHJLMAIRBX-UHFFFAOYSA-N 1 1 417.916 3.117 20 0 HGADMO COC(=O)c1cnc(Cl)nc1N1CCC2(CCC[N@H+]2Cc2csc(C)n2)CC1 ZINC001164693251 719803888 /nfs/dbraw/zinc/80/38/88/719803888.db2.gz RBOFFRPWYTZVPC-UHFFFAOYSA-N 1 1 421.954 3.317 20 0 HGADMO Cc1nc(C[N@@H+]2CCCC23CCN(c2nc(C(C)C)nc(N(C)C)n2)CC3)cs1 ZINC001164693970 719810248 /nfs/dbraw/zinc/81/02/48/719810248.db2.gz SUAYEOHMXZZGRO-UHFFFAOYSA-N 1 1 415.611 3.461 20 0 HGADMO Cc1cn(-c2ccc(N3CCC4(CCC[N@@H+]4Cc4csc(C)n4)CC3)nn2)cn1 ZINC001164691316 719811256 /nfs/dbraw/zinc/81/12/56/719811256.db2.gz FVLGOMSFWKREMU-UHFFFAOYSA-N 1 1 409.563 3.371 20 0 HGADMO COC(=O)[C@]1(C)C[C@@H]([NH+]2CCOCC2)CCN1c1cc(Cl)nc2ccccc21 ZINC001164702640 719837893 /nfs/dbraw/zinc/83/78/93/719837893.db2.gz OLGDVLIBZISAGB-BTYIYWSLSA-N 1 1 403.910 3.121 20 0 HGADMO COC(=O)[C@]1(C)C[C@@H]([NH+]2CCOCC2)CCN1c1cc(Cl)nc2ccc(F)cc21 ZINC001164701083 719847247 /nfs/dbraw/zinc/84/72/47/719847247.db2.gz LXLHTVQTPFTHBQ-BTYIYWSLSA-N 1 1 421.900 3.260 20 0 HGADMO COC(=O)[C@@]1(C)C[C@H]([NH+]2CCOCC2)CCN1c1cc(Cl)nc2cc(C)ccc21 ZINC001164701032 719858621 /nfs/dbraw/zinc/85/86/21/719858621.db2.gz JBIXAVMBBPVMLW-OPAMFIHVSA-N 1 1 417.937 3.429 20 0 HGADMO COC(=O)[C@]1(C)C[C@@H]([NH+]2CCOCC2)CCN1c1nc(Cl)cc2ccc(C)cc21 ZINC001164700573 719861741 /nfs/dbraw/zinc/86/17/41/719861741.db2.gz ICTJGUOMJOCDEU-JTSKRJEESA-N 1 1 417.937 3.429 20 0 HGADMO CCOC(=O)c1c(C)nc(Cl)cc1N1CC[C@@]2(C1)C[N@@H+](CC1CC1)C[C@H]2COC ZINC001164809754 720098387 /nfs/dbraw/zinc/09/83/87/720098387.db2.gz JXZIUWCJWLXVTA-JTSKRJEESA-N 1 1 421.969 3.405 20 0 HGADMO COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1nccc(C(=O)OC)c1C)CC2 ZINC001164717331 720107524 /nfs/dbraw/zinc/10/75/24/720107524.db2.gz NELAJFMVJVQLKM-HXUWFJFHSA-N 1 1 424.545 3.079 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1nccc(OCc3ccccc3)n1)C2 ZINC001164808611 720113595 /nfs/dbraw/zinc/11/35/95/720113595.db2.gz FWDWISWXQAFTJD-QPPBQGQZSA-N 1 1 408.546 3.240 20 0 HGADMO COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1ncnc3c1CCCC3)CC2 ZINC001164719446 720114111 /nfs/dbraw/zinc/11/41/11/720114111.db2.gz WXNAMPSMWCLTHY-FQEVSTJZSA-N 1 1 407.562 3.258 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1ccc(C(=O)OC(C)(C)C)cn1)C2 ZINC001164810009 720115410 /nfs/dbraw/zinc/11/54/10/720115410.db2.gz JELHBDCQDSUIQE-XXBNENTESA-N 1 1 401.551 3.222 20 0 HGADMO COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1nnc(Cl)cc1F)CC2 ZINC001164716901 720118980 /nfs/dbraw/zinc/11/89/80/720118980.db2.gz LISLJXODEQGPLT-MRXNPFEDSA-N 1 1 405.905 3.172 20 0 HGADMO CCOC(=O)c1c(C)cc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COC)nc1C ZINC001164816164 720130711 /nfs/dbraw/zinc/13/07/11/720130711.db2.gz XZPFRTWTTYDDDO-XXBNENTESA-N 1 1 401.551 3.060 20 0 HGADMO COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1ncc(Cl)cc1N)CC2 ZINC001164710399 720136464 /nfs/dbraw/zinc/13/64/64/720136464.db2.gz AVIMJDZTBRGMBM-SFHVURJKSA-N 1 1 401.942 3.220 20 0 HGADMO COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1nccc3nc(C)cnc31)CC2 ZINC001164713045 720150177 /nfs/dbraw/zinc/15/01/77/720150177.db2.gz PMUIFYZWRPXDOK-FQEVSTJZSA-N 1 1 418.545 3.236 20 0 HGADMO CCOC(=O)c1nc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COC)ccc1Cl ZINC001164815074 720151185 /nfs/dbraw/zinc/15/11/85/720151185.db2.gz HWCQOWSZGLJGGP-IERDGZPVSA-N 1 1 407.942 3.096 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1ccc(-c3ccc(OC)cc3)nn1)C2 ZINC001164817193 720163969 /nfs/dbraw/zinc/16/39/69/720163969.db2.gz OTCRJFQTJMZFGJ-HYBUGGRVSA-N 1 1 408.546 3.337 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1nccc(-c3ccccc3OC)n1)C2 ZINC001164816656 720174354 /nfs/dbraw/zinc/17/43/54/720174354.db2.gz LZMLEUFFLCMMAL-DVECYGJZSA-N 1 1 408.546 3.337 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1nc(-c3ccccn3)nc(C)c1C)C2 ZINC001164818680 720184144 /nfs/dbraw/zinc/18/41/44/720184144.db2.gz TZHDHGWBLMUKQO-GBXCKJPGSA-N 1 1 407.562 3.340 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1ccc3c(cccc3C(=O)OC)n1)C2 ZINC001164812434 720187572 /nfs/dbraw/zinc/18/75/72/720187572.db2.gz AQKGTLXCATVIJE-KOSHJBKYSA-N 1 1 409.530 3.206 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1ccc(-c3sc(C)nc3C)nn1)C2 ZINC001164813046 720189466 /nfs/dbraw/zinc/18/94/66/720189466.db2.gz CCNRFOAIRYVUNZ-GCJKJVERSA-N 1 1 413.591 3.402 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1ccc3c(cc(OC)cc3OC)n1)C2 ZINC001164815190 720195405 /nfs/dbraw/zinc/19/54/05/720195405.db2.gz WWCCQCFEMAOHKJ-KOSHJBKYSA-N 1 1 411.546 3.437 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1ncc(C(N)=S)c3ccsc31)C2 ZINC001164814641 720204360 /nfs/dbraw/zinc/20/43/60/720204360.db2.gz VPALYQLZGVNIOY-BTYIYWSLSA-N 1 1 416.616 3.115 20 0 HGADMO Cc1sc2ncnc(N3CCCn4c(=O)cc(C[N@H+](C)C(C)C)nc4C3)c2c1C ZINC001164813453 720212354 /nfs/dbraw/zinc/21/23/54/720212354.db2.gz PUDIZVGGWRUWGH-UHFFFAOYSA-N 1 1 412.563 3.115 20 0 HGADMO CC(C)[N@@H+](C)Cc1cc(=O)n2c(n1)CN(c1cnc3c(Cl)cccc3n1)CCC2 ZINC001164812172 720218915 /nfs/dbraw/zinc/21/89/15/720218915.db2.gz GAZMLQSEOFCBFX-UHFFFAOYSA-N 1 1 412.925 3.090 20 0 HGADMO Cc1c[nH]c2nc(Cl)cc(N3CCCn4c(=O)cc(C[N@H+](C)C(C)C)nc4C3)c12 ZINC001164814066 720233985 /nfs/dbraw/zinc/23/39/85/720233985.db2.gz UGQJQVREFRIFGD-UHFFFAOYSA-N 1 1 414.941 3.332 20 0 HGADMO CC[N@H+]1CCCC[C@H]1c1ccc(N2Cc3ccnn3C[C@H](C(=O)N3CCCC3)C2)nc1 ZINC001164820319 720268039 /nfs/dbraw/zinc/26/80/39/720268039.db2.gz VSQHYQBOYBPLHV-IRLDBZIGSA-N 1 1 422.577 3.084 20 0 HGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2Cc3ccnn3C[C@H](C(=O)N3CCCC3)C2)nc1 ZINC001164820318 720268580 /nfs/dbraw/zinc/26/85/80/720268580.db2.gz VSQHYQBOYBPLHV-IFMALSPDSA-N 1 1 422.577 3.084 20 0 HGADMO COC(=O)c1ccc2nc(Cl)c(N3CC[C@H]4[C@@H]3CC[N@@H+]4Cc3cccnc3)nc2c1 ZINC001164724490 720340223 /nfs/dbraw/zinc/34/02/23/720340223.db2.gz KJOFHJTZKZMZLP-OALUTQOASA-N 1 1 423.904 3.318 20 0 HGADMO COC(=O)c1ccc2nc(Cl)c(N3CC[C@H]4[C@@H]3CC[N@H+]4Cc3cccnc3)nc2c1 ZINC001164724490 720340232 /nfs/dbraw/zinc/34/02/32/720340232.db2.gz KJOFHJTZKZMZLP-OALUTQOASA-N 1 1 423.904 3.318 20 0 HGADMO COC(=O)c1cc(C(F)(F)N2CC[C@@H]3[C@@H]2CC[N@@H+]3Cc2cccnc2)cnc1Cl ZINC001164726555 720365036 /nfs/dbraw/zinc/36/50/36/720365036.db2.gz PMPNYCKDZONQNY-SJORKVTESA-N 1 1 422.863 3.315 20 0 HGADMO COC(=O)c1cc(C(F)(F)N2CC[C@@H]3[C@@H]2CC[N@H+]3Cc2cccnc2)cnc1Cl ZINC001164726555 720365046 /nfs/dbraw/zinc/36/50/46/720365046.db2.gz PMPNYCKDZONQNY-SJORKVTESA-N 1 1 422.863 3.315 20 0 HGADMO COC(=O)c1cc(Cl)ncc1C(F)(F)N1CC[C@H]2[C@@H]1CC[N@@H+]2Cc1cccnc1 ZINC001164731029 720368809 /nfs/dbraw/zinc/36/88/09/720368809.db2.gz YEEFQVQFKRHHHK-IRXDYDNUSA-N 1 1 422.863 3.315 20 0 HGADMO COC(=O)c1cc(Cl)ncc1C(F)(F)N1CC[C@H]2[C@@H]1CC[N@H+]2Cc1cccnc1 ZINC001164731029 720368817 /nfs/dbraw/zinc/36/88/17/720368817.db2.gz YEEFQVQFKRHHHK-IRXDYDNUSA-N 1 1 422.863 3.315 20 0 HGADMO c1ccc2nc(N3CC[C@@H]4[C@H]3CC[N@@H+]4Cc3cccnc3)c(N3CCCC3)nc2c1 ZINC001164726271 720429442 /nfs/dbraw/zinc/42/94/42/720429442.db2.gz BFVUUKOUTPOMJL-FGZHOGPDSA-N 1 1 400.530 3.478 20 0 HGADMO COC(=O)c1cnc(Cl)cc1C(F)(F)N1CC[C@@H]2[C@H]1CC[N@@H+]2Cc1cccnc1 ZINC001164727166 720435237 /nfs/dbraw/zinc/43/52/37/720435237.db2.gz DEQNAZJXBBGDAJ-IAGOWNOFSA-N 1 1 422.863 3.315 20 0 HGADMO COC(=O)c1cnc(Cl)cc1C(F)(F)N1CC[C@@H]2[C@H]1CC[N@H+]2Cc1cccnc1 ZINC001164727166 720435242 /nfs/dbraw/zinc/43/52/42/720435242.db2.gz DEQNAZJXBBGDAJ-IAGOWNOFSA-N 1 1 422.863 3.315 20 0 HGADMO COC(=O)c1cnc(N2CC[C@@H]3[C@@H](C[C@H](Cn4cccn4)[N@H+]3C(C)C)C2)c(Cl)c1 ZINC001164834740 720507062 /nfs/dbraw/zinc/50/70/62/720507062.db2.gz HKRRJDSDCFYEBB-YQVWRLOYSA-N 1 1 417.941 3.096 20 0 HGADMO COC(=O)c1cnc(Cl)cc1N1CC[C@@H]2[C@H](C[C@H](Cn3cccn3)[N@H+]2C(C)C)C1 ZINC001164841228 720508507 /nfs/dbraw/zinc/50/85/07/720508507.db2.gz XYKDAGJROIFUHO-JFIYKMOQSA-N 1 1 417.941 3.096 20 0 HGADMO CC(C)[N@@H+]1[C@@H]2CCN(C(F)(F)c3nccc(Cl)n3)C[C@@H]2C[C@H]1Cn1cccn1 ZINC001164840022 720515393 /nfs/dbraw/zinc/51/53/93/720515393.db2.gz VUMIWFLJVKDCFP-HRCADAONSA-N 1 1 410.900 3.249 20 0 HGADMO COC(=O)c1c(C)cc(C)nc1N1CC[C@@H]2[C@H](C[C@H](Cn3cccn3)[N@H+]2C(C)C)C1 ZINC001164833754 720540328 /nfs/dbraw/zinc/54/03/28/720540328.db2.gz BMNKJENTPZWOOL-VAMGGRTRSA-N 1 1 411.550 3.059 20 0 HGADMO COc1cc2c(cc1F)ncnc2N1CC[C@@H]2[C@H](C[C@@H](Cn3cccn3)[N@H+]2C(C)C)C1 ZINC001164840205 720571042 /nfs/dbraw/zinc/57/10/42/720571042.db2.gz SDPWJIQEJODWKN-LLGFUMIMSA-N 1 1 424.524 3.352 20 0 HGADMO COC(=O)/C=C\c1cc(C)cnc1N1CC[C@@H]2[C@H](C[C@@H](Cn3cccn3)[N@H+]2C(C)C)C1 ZINC001164842212 720581497 /nfs/dbraw/zinc/58/14/97/720581497.db2.gz UMDXKJOVRYTKOS-SZJKLMJPSA-N 1 1 423.561 3.151 20 0 HGADMO CC(C)[N@@H+]1[C@@H]2CCN(C(F)(F)c3cnc(Cl)c(N)c3)C[C@H]2C[C@H]1Cn1cccn1 ZINC001164837808 720593669 /nfs/dbraw/zinc/59/36/69/720593669.db2.gz JQGJYMVGULTTNH-UWWQBHOKSA-N 1 1 424.927 3.436 20 0 HGADMO C[N@@H+](Cc1ccccc1)[C@H]1COC2(C1)CCN(c1nc(Cl)nc3nc[nH]c31)CC2 ZINC001164839197 720659755 /nfs/dbraw/zinc/65/97/55/720659755.db2.gz JGZUDJVNLSRBQS-MRXNPFEDSA-N 1 1 412.925 3.266 20 0 HGADMO C[N@H+](Cc1ccccc1)[C@H]1COC2(C1)CCN(c1nc(Cl)nc3[nH]cnc31)CC2 ZINC001164839197 720659764 /nfs/dbraw/zinc/65/97/64/720659764.db2.gz JGZUDJVNLSRBQS-MRXNPFEDSA-N 1 1 412.925 3.266 20 0 HGADMO C[N@@H+](Cc1ccccc1)[C@H]1COC2(C1)CCN(c1nc(Cl)nc3[nH]cnc31)CC2 ZINC001164839197 720659777 /nfs/dbraw/zinc/65/97/77/720659777.db2.gz JGZUDJVNLSRBQS-MRXNPFEDSA-N 1 1 412.925 3.266 20 0 HGADMO COC(=O)c1ccnc(N2CCC3(C[C@@H]([N@@H+](C)Cc4ccccc4)CO3)CC2)c1C ZINC001164837061 720676973 /nfs/dbraw/zinc/67/69/73/720676973.db2.gz AZWDYUGHJBALAM-HXUWFJFHSA-N 1 1 409.530 3.437 20 0 HGADMO CCOC(=O)c1ncnc(N2CCC3(C[C@H]([N@@H+](C)Cc4ccccc4)CO3)CC2)c1C ZINC001164841949 720695664 /nfs/dbraw/zinc/69/56/64/720695664.db2.gz KMJWNFNOOLQHRO-FQEVSTJZSA-N 1 1 424.545 3.222 20 0 HGADMO Clc1cccc2nc(Cl)nc(N3CC[N@H+]4C[C@H](Oc5cncnc5)C[C@H]4C3)c12 ZINC001164737953 720696051 /nfs/dbraw/zinc/69/60/51/720696051.db2.gz HWMBHCURWKQZQC-QWHCGFSZSA-N 1 1 417.300 3.069 20 0 HGADMO CCCCOc1cnc(N2CC[N@H+]3C[C@@H](Oc4cncnc4)C[C@@H]3C2)c(Cl)c1 ZINC001164739013 720744801 /nfs/dbraw/zinc/74/48/01/720744801.db2.gz HMFLRRJXFFTFGV-WBVHZDCISA-N 1 1 403.914 3.046 20 0 HGADMO CC[C@H]1N(c2ncnc3c2CC[N@H+](Cc2ccccc2)C3)CCC[C@]12CCC(=O)N2 ZINC001164843902 720749904 /nfs/dbraw/zinc/74/99/04/720749904.db2.gz MNKHHZYGZRJSND-QPPBQGQZSA-N 1 1 405.546 3.063 20 0 HGADMO CC[C@H]1N(c2ncnc3c2CC[N@@H+](Cc2ccccc2)C3)CCC[C@]12CCC(=O)N2 ZINC001164843902 720749916 /nfs/dbraw/zinc/74/99/16/720749916.db2.gz MNKHHZYGZRJSND-QPPBQGQZSA-N 1 1 405.546 3.063 20 0 HGADMO c1ccc2c(c1)cccc2-c1ccc(N2CC[N@@H+]3C[C@H](Oc4cncnc4)C[C@H]3C2)nn1 ZINC001164742940 720783148 /nfs/dbraw/zinc/78/31/48/720783148.db2.gz PQYOINHLSFGUGW-VQTJNVASSA-N 1 1 424.508 3.429 20 0 HGADMO Clc1cccc2nc(Cl)c(N3CC[N@H+]4C[C@H](Oc5cncnc5)C[C@@H]4C3)nc12 ZINC001164742754 720800553 /nfs/dbraw/zinc/80/05/53/720800553.db2.gz DMYSRNGNJPMXAM-CHWSQXEVSA-N 1 1 417.300 3.069 20 0 HGADMO Clc1cnc(N2CC[C@@H]3[C@H](C[C@H](Cn4cncn4)[N@H+]3CC3CC3)C2)c(Cl)c1 ZINC001164748306 720810994 /nfs/dbraw/zinc/81/09/94/720810994.db2.gz QQGGKTVPXXGHHL-QGPMSJSTSA-N 1 1 407.349 3.359 20 0 HGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2C[C@@H]3CN(Cc4ccncc4)C(=O)[C@H]3C2)nc1 ZINC001164853205 720814086 /nfs/dbraw/zinc/81/40/86/720814086.db2.gz QOOGRTLWHGJLDY-BHIFYINESA-N 1 1 405.546 3.118 20 0 HGADMO Clc1nnc(N2CC[C@@H]3[C@@H](C[C@H](Cn4cncn4)[N@H+]3CC3CC3)C2)c2ccccc12 ZINC001164740758 720815165 /nfs/dbraw/zinc/81/51/65/720815165.db2.gz AIXVYZSOQRPTJW-SQGPQFPESA-N 1 1 423.952 3.254 20 0 HGADMO c1ncn(C[C@H]2C[C@@H]3CN(c4ccnc(-c5ccccc5)n4)CC[C@H]3[N@H+]2CC2CC2)n1 ZINC001164741258 720816390 /nfs/dbraw/zinc/81/63/90/720816390.db2.gz MSIQJITYWLUIRT-YPAWHYETSA-N 1 1 415.545 3.115 20 0 HGADMO Clc1cc2[nH]ccc2c(N2CC[C@@H]3[C@@H](C[C@H](Cn4cncn4)[N@H+]3CC3CC3)C2)n1 ZINC001164737410 720817500 /nfs/dbraw/zinc/81/75/00/720817500.db2.gz AYGZGFSVJBAAMF-FRQCXROJSA-N 1 1 411.941 3.187 20 0 HGADMO Clc1cc2[nH]ccc2c(N2CC[C@@H]3[C@@H](C[C@@H](Cn4cncn4)[N@H+]3CC3CC3)C2)n1 ZINC001164737413 720817946 /nfs/dbraw/zinc/81/79/46/720817946.db2.gz AYGZGFSVJBAAMF-TXPKVOOTSA-N 1 1 411.941 3.187 20 0 HGADMO Clc1cccc2nc(N3CC[C@@H]4[C@@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)cnc12 ZINC001164738838 720822723 /nfs/dbraw/zinc/82/27/23/720822723.db2.gz HCOWYEPWMTXXMS-ABSDTBQOSA-N 1 1 423.952 3.254 20 0 HGADMO Clc1ccc2nc(N3CC[C@@H]4[C@@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)ncc2c1 ZINC001164741170 720831896 /nfs/dbraw/zinc/83/18/96/720831896.db2.gz DNVHENNWRAJVKT-FBBABVLZSA-N 1 1 423.952 3.254 20 0 HGADMO Clc1cccc2nc(N3CC[C@@H]4[C@@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)ncc12 ZINC001164743585 720832911 /nfs/dbraw/zinc/83/29/11/720832911.db2.gz JJZMOQFAIJGHLF-CSODHUTKSA-N 1 1 423.952 3.254 20 0 HGADMO COc1ccc2ccc(N3CC[C@@H]4[C@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)nc2c1 ZINC001164742971 720835464 /nfs/dbraw/zinc/83/54/64/720835464.db2.gz HPVADJSDDKSYCS-TXTKFYIRSA-N 1 1 418.545 3.214 20 0 HGADMO COCC[N@H+]1CCO[C@@H]2CN(C(F)(F)c3ccnc(Cl)c3Cl)CC[C@H]2C1 ZINC001164857875 720837293 /nfs/dbraw/zinc/83/72/93/720837293.db2.gz YVJWFXHGRDUPGC-GXTWGEPZSA-N 1 1 410.292 3.107 20 0 HGADMO CSc1cc(Cl)cnc1N1CC[C@@H]2[C@H](C[C@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164748364 720843502 /nfs/dbraw/zinc/84/35/02/720843502.db2.gz UKUVJPDYXMRNDE-KBAYOESNSA-N 1 1 418.998 3.428 20 0 HGADMO COCC[N@H+]1CCO[C@H]2CN(c3ncnc4cc(C(C)(C)C)sc43)CC[C@@H]2C1 ZINC001164857578 720844550 /nfs/dbraw/zinc/84/45/50/720844550.db2.gz YGCNKLKGDUMKLZ-WBVHZDCISA-N 1 1 404.580 3.162 20 0 HGADMO Fc1ccc2cc(N3CC[C@@H]4[C@@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)ncc2c1 ZINC001164749582 720850454 /nfs/dbraw/zinc/85/04/54/720850454.db2.gz WELZPMATJQDJFZ-KSEOMHKRSA-N 1 1 406.509 3.345 20 0 HGADMO c1cc(-c2ccc(N3CC[C@@H]4[C@@H](C[C@@H](Cn5cncn5)[N@@H+]4CC4CC4)C3)nn2)cs1 ZINC001164749681 720855244 /nfs/dbraw/zinc/85/52/44/720855244.db2.gz OAWZZMMJLBJXLD-IRFCIJBXSA-N 1 1 421.574 3.176 20 0 HGADMO COCC[N@H+]1CCO[C@H]2CN(C(F)(F)c3ccc(SC)c(Cl)n3)CC[C@@H]2C1 ZINC001164852499 720860822 /nfs/dbraw/zinc/86/08/22/720860822.db2.gz DNXXYAQNSPYZJG-KGLIPLIRSA-N 1 1 421.941 3.175 20 0 HGADMO COCC[N@H+]1CCO[C@H]2CN(C(F)(F)c3ccc(SC)c(Cl)n3)CC[C@H]2C1 ZINC001164852498 720861236 /nfs/dbraw/zinc/86/12/36/720861236.db2.gz DNXXYAQNSPYZJG-KBPBESRZSA-N 1 1 421.941 3.175 20 0 HGADMO COCC[N@H+]1CCO[C@H]2CN(c3ncnc4cc(Cl)c(Cl)cc43)CC[C@@H]2C1 ZINC001164854371 720866923 /nfs/dbraw/zinc/86/69/23/720866923.db2.gz JOYJTNRHQSMSKW-ACJLOTCBSA-N 1 1 411.333 3.110 20 0 HGADMO Clc1ncncc1N1CC[C@]2(C1)C[N@@H+](CC1CC1)C[C@@H]2COCc1cccnc1 ZINC001164754344 720876642 /nfs/dbraw/zinc/87/66/42/720876642.db2.gz RHXOTWCXDZWCQV-DENIHFKCSA-N 1 1 413.953 3.280 20 0 HGADMO COCC[N@H+]1CCO[C@H]2CN(c3cc(Cl)nc(-c4ccc(F)cc4)n3)CC[C@@H]2C1 ZINC001164860537 720880810 /nfs/dbraw/zinc/88/08/10/720880810.db2.gz OURLDEMNHZIMBW-AEFFLSMTSA-N 1 1 420.916 3.110 20 0 HGADMO COCC[N@H+]1CCO[C@@H]2CN(c3nnc(Cl)c4ccc(Cl)cc43)CC[C@H]2C1 ZINC001164863778 720883897 /nfs/dbraw/zinc/88/38/97/720883897.db2.gz UDZKADSRGOVHDJ-SUMWQHHRSA-N 1 1 411.333 3.110 20 0 HGADMO COCC[N@H+]1CCO[C@H]2CN(c3nnc(Cl)c4ccc(Cl)cc43)CC[C@H]2C1 ZINC001164863774 720884208 /nfs/dbraw/zinc/88/42/08/720884208.db2.gz UDZKADSRGOVHDJ-GUYCJALGSA-N 1 1 411.333 3.110 20 0 HGADMO COCC[N@H+]1CCO[C@@H]2CN(C(F)(F)C3(c4ccnc(Cl)c4)CC3)CC[C@@H]2C1 ZINC001164860518 720891009 /nfs/dbraw/zinc/89/10/09/720891009.db2.gz OTQGKABHDAHSMP-NVXWUHKLSA-N 1 1 415.912 3.029 20 0 HGADMO C[N@@H+](Cc1ccc(N2CC[C@@]3(C2)C[C@H](NC(=O)c2ccccc2)CCO3)nc1)C1CC1 ZINC001164861523 720901738 /nfs/dbraw/zinc/90/17/38/720901738.db2.gz TVXLAKRQJXHTBZ-BWKNWUBXSA-N 1 1 420.557 3.234 20 0 HGADMO Cc1cc(NC(=O)c2cccnc2N2CCn3c(C[N@H+](C)C(C)C)cnc3[C@@H]2C)no1 ZINC001164858899 720998109 /nfs/dbraw/zinc/99/81/09/720998109.db2.gz JDAKBWFTIVMYPX-INIZCTEOSA-N 1 1 423.521 3.248 20 0 HGADMO COC(=O)[C@@H](C)c1c(Cl)ncnc1N1CCn2c(C[N@@H+](C)C(C)C)cnc2[C@@H]1C ZINC001164858854 721021654 /nfs/dbraw/zinc/02/16/54/721021654.db2.gz IABAUWMZOJVHRO-KBPBESRZSA-N 1 1 420.945 3.024 20 0 HGADMO Clc1c[nH]c2nc(Cl)nc(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@H]4C3)c12 ZINC001164871534 721045436 /nfs/dbraw/zinc/04/54/36/721045436.db2.gz ZNHJQRMKZQDGPN-UONOGXRCSA-N 1 1 419.316 3.139 20 0 HGADMO Cc1cc(C(F)(F)N2CC[N@H+]3C[C@H](OCc4cccnc4)C[C@@H]3C2)cc(Cl)n1 ZINC001164867681 721048993 /nfs/dbraw/zinc/04/89/93/721048993.db2.gz JQYCFIBYZLDMJZ-QZTJIDSGSA-N 1 1 408.880 3.463 20 0 HGADMO Fc1cccc2nc(Cl)nc(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@H]4C3)c12 ZINC001164866861 721072896 /nfs/dbraw/zinc/07/28/96/721072896.db2.gz GJLYGNGPUBMWPE-JKSUJKDBSA-N 1 1 413.884 3.297 20 0 HGADMO Fc1cccc2c1nc(Cl)nc2N1CC[N@H+]2C[C@@H](OCc3cccnc3)C[C@@H]2C1 ZINC001164865750 721079234 /nfs/dbraw/zinc/07/92/34/721079234.db2.gz PGTZQVGAKSXWRZ-CVEARBPZSA-N 1 1 413.884 3.297 20 0 HGADMO Cc1cccc2c(Cl)nnc(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@@H]4C3)c12 ZINC001164865998 721083478 /nfs/dbraw/zinc/08/34/78/721083478.db2.gz QXEGMOWBYNGUMF-MSOLQXFVSA-N 1 1 409.921 3.466 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4cc(-c5ccnc(Cl)c5)ccn4)C[C@@H]3C2)cn1 ZINC001164770458 721095630 /nfs/dbraw/zinc/09/56/30/721095630.db2.gz QMALDHGQJDWABB-PMACEKPBSA-N 1 1 408.937 3.489 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4cc(-c5ccnc(Cl)c5)ccn4)C[C@@H]3C2)cn1 ZINC001164770461 721096351 /nfs/dbraw/zinc/09/63/51/721096351.db2.gz QMALDHGQJDWABB-UXHICEINSA-N 1 1 408.937 3.489 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4nc(Cl)nc5cccc(F)c54)C[C@H]3C2)cn1 ZINC001164773928 721108123 /nfs/dbraw/zinc/10/81/23/721108123.db2.gz ZHLBBWOWMBDRJD-HUUCEWRRSA-N 1 1 400.889 3.114 20 0 HGADMO Cc1cccc(-c2ccc(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@H]4C3)nn2)c1 ZINC001164878964 721146448 /nfs/dbraw/zinc/14/64/48/721146448.db2.gz RDGAAKFPKNMLNH-FCHUYYIVSA-N 1 1 401.514 3.327 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4nc(Cl)cc(Cc5ccccc5)n4)C[C@H]3C2)cn1 ZINC001164770851 721173882 /nfs/dbraw/zinc/17/38/82/721173882.db2.gz OXCXNGWPAXWWBJ-WOJBJXKFSA-N 1 1 422.964 3.413 20 0 HGADMO COc1cc2nc(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@H]4C3)ccc2c(OC)c1 ZINC001164872693 721180562 /nfs/dbraw/zinc/18/05/62/721180562.db2.gz IEIORFVVCCCCLH-AZUAARDMSA-N 1 1 420.513 3.127 20 0 HGADMO Fc1ccc(-c2cncc(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@@H]4C3)n2)cc1 ZINC001164870987 721182188 /nfs/dbraw/zinc/18/21/88/721182188.db2.gz CUDORWMUDRJPMW-NHCUHLMSSA-N 1 1 405.477 3.157 20 0 HGADMO Fc1cnc(N2CC[N@H+]3C[C@H](OCc4cccnc4)C[C@@H]3C2)nc1-c1ccsc1 ZINC001164870287 721185180 /nfs/dbraw/zinc/18/51/80/721185180.db2.gz CJBNUGFBCGWHPA-QZTJIDSGSA-N 1 1 411.506 3.219 20 0 HGADMO CCc1nc2sc3c(c2c(N2C[C@@H]4CC[N@@H+](Cc5cnn(C)c5)C[C@@H]4C2)n1)CCC3 ZINC001164771826 721193778 /nfs/dbraw/zinc/19/37/78/721193778.db2.gz RBLDZVNIWIFQHO-DLBZAZTESA-N 1 1 422.602 3.434 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(C(F)(F)c4cc(C5CC5)nnc4Cl)C[C@H]3C2)cn1 ZINC001164762005 721205118 /nfs/dbraw/zinc/20/51/18/721205118.db2.gz BQWVQWOHWRAKAZ-JKSUJKDBSA-N 1 1 422.911 3.244 20 0 HGADMO Cc1ccc(C)c(-c2ccc(N3C[C@@H]4C[N@@H+](Cc5cnn(C)c5)CC[C@@H]4C3)nn2)c1 ZINC001164772868 721211787 /nfs/dbraw/zinc/21/17/87/721211787.db2.gz VQDPRUIITUKMMP-RTWAWAEBSA-N 1 1 402.546 3.452 20 0 HGADMO CCc1ccc(-c2ccc(N3C[C@H]4CC[N@@H+](Cc5cnn(C)c5)C[C@@H]4C3)nn2)cc1 ZINC001164769547 721215097 /nfs/dbraw/zinc/21/50/97/721215097.db2.gz MSZMVIRSZKXETF-FGZHOGPDSA-N 1 1 402.546 3.398 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4nnc(Cl)c5ccc(F)cc54)C[C@H]3C2)cn1 ZINC001164763277 721225799 /nfs/dbraw/zinc/22/57/99/721225799.db2.gz FDNVRLLJPMMGQE-LSDHHAIUSA-N 1 1 400.889 3.114 20 0 HGADMO C[NH+]1CCC(Oc2ccnc(N3CC[C@@H]4O[C@@H](COc5cccnc5)CC[C@@H]43)c2)CC1 ZINC001164872741 721252211 /nfs/dbraw/zinc/25/22/11/721252211.db2.gz FPVNHILDEMFTHC-VJBWXMMDSA-N 1 1 424.545 3.155 20 0 HGADMO CC(C)(c1ccnc(Cl)c1)[N@H+]1C[C@@H]2OCC[C@@H]2[C@H](C(=O)NCc2cccnc2)C1 ZINC001164877440 721305555 /nfs/dbraw/zinc/30/55/55/721305555.db2.gz ITUKUPMWOJJDOR-QRVBRYPASA-N 1 1 414.937 3.018 20 0 HGADMO CC(C)(c1ccnc(Cl)c1)[N@H+]1C[C@@H]2OCC[C@H]2[C@@H](C(=O)NCc2cccnc2)C1 ZINC001164877435 721305747 /nfs/dbraw/zinc/30/57/47/721305747.db2.gz ITUKUPMWOJJDOR-FHWLQOOXSA-N 1 1 414.937 3.018 20 0 HGADMO CCc1ncnc(Cl)c1N1CCC[C@@]2(C1)COCC[N@H+](Cc1c(C)noc1C)C2 ZINC001164775781 721336578 /nfs/dbraw/zinc/33/65/78/721336578.db2.gz ADYHPWSZDGXPCR-OAQYLSRUSA-N 1 1 419.957 3.416 20 0 HGADMO CCc1ncnc(Cl)c1N1CCC[C@@]2(C1)COCC[N@@H+](Cc1c(C)noc1C)C2 ZINC001164775781 721336581 /nfs/dbraw/zinc/33/65/81/721336581.db2.gz ADYHPWSZDGXPCR-OAQYLSRUSA-N 1 1 419.957 3.416 20 0 HGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@@]2(CCCN(c3nc(C)cnc3Cl)C2)C1 ZINC001164778758 721352724 /nfs/dbraw/zinc/35/27/24/721352724.db2.gz OJANSOKQACDZJL-FQEVSTJZSA-N 1 1 405.930 3.162 20 0 HGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@@]2(CCCN(c3nc(C)cnc3Cl)C2)C1 ZINC001164778758 721352727 /nfs/dbraw/zinc/35/27/27/721352727.db2.gz OJANSOKQACDZJL-FQEVSTJZSA-N 1 1 405.930 3.162 20 0 HGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@]2(CCCN(c3cc(C4CCC4)ncn3)C2)C1 ZINC001164787081 721372393 /nfs/dbraw/zinc/37/23/93/721372393.db2.gz YNDNIEMGGXAPHH-HSZRJFAPSA-N 1 1 411.550 3.468 20 0 HGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@]2(CCCN(c3cc(C4CCC4)ncn3)C2)C1 ZINC001164787081 721372397 /nfs/dbraw/zinc/37/23/97/721372397.db2.gz YNDNIEMGGXAPHH-HSZRJFAPSA-N 1 1 411.550 3.468 20 0 HGADMO Cc1sc2ncnc(N3CC[C@@]4(C3)CCC[C@@H](CN3CC[NH+](C)CC3)O4)c2c1C ZINC001164887736 721389039 /nfs/dbraw/zinc/38/90/39/721389039.db2.gz ICIFTOZNAAXXGS-PGRDOPGGSA-N 1 1 415.607 3.074 20 0 HGADMO COc1ccc2nc(Cl)nc(N3C[C@H]4C[NH+](Cc5nccs5)C[C@@H]4C3)c2c1 ZINC001164779906 721389104 /nfs/dbraw/zinc/38/91/04/721389104.db2.gz DQLCYIVOUBGGJB-CHWSQXEVSA-N 1 1 401.923 3.317 20 0 HGADMO c1csc(C[NH+]2C[C@@H]3CN(c4nccnc4C4SCCCS4)C[C@H]3C2)n1 ZINC001164787651 721402509 /nfs/dbraw/zinc/40/25/09/721402509.db2.gz QLSMUWLUKCGYJA-ZIAGYGMSSA-N 1 1 405.618 3.370 20 0 HGADMO COc1ccc2nc(N3CC[C@]4(C3)CCC[C@@H](CN3CC[NH+](C)CC3)O4)cc(C)c2c1 ZINC001164893014 721411795 /nfs/dbraw/zinc/41/17/95/721411795.db2.gz ZVXZWKVQNNHBNI-OFVILXPXSA-N 1 1 424.589 3.317 20 0 HGADMO CC(C)(C)NC(=O)c1ccc(Cl)nc1N1C[C@@H]2C[N@@H+](Cc3nccs3)C[C@@H]2C1 ZINC001164791058 721414878 /nfs/dbraw/zinc/41/48/78/721414878.db2.gz ZDEWLSSOJGCRQB-OKILXGFUSA-N 1 1 419.982 3.288 20 0 HGADMO CC(C)(C)NC(=O)c1ccc(Cl)nc1N1C[C@@H]2C[N@H+](Cc3nccs3)C[C@@H]2C1 ZINC001164791058 721414882 /nfs/dbraw/zinc/41/48/82/721414882.db2.gz ZDEWLSSOJGCRQB-OKILXGFUSA-N 1 1 419.982 3.288 20 0 HGADMO C[NH+]1CCN(C[C@@H]2CCC[C@@]3(CCN(c4cc5ccc(Cl)nc5cn4)C3)O2)CC1 ZINC001164886196 721415578 /nfs/dbraw/zinc/41/55/78/721415578.db2.gz ICYZEMWGZOKHPM-AVRDEDQJSA-N 1 1 415.969 3.049 20 0 HGADMO COc1ccc2ccc(N3CC[C@@]4(C3)CCC[C@H](CN3CC[NH+](C)CC3)O4)nc2c1 ZINC001164885166 721420715 /nfs/dbraw/zinc/42/07/15/721420715.db2.gz GCDMAMWPDPPZGX-ZJSXRUAMSA-N 1 1 410.562 3.009 20 0 HGADMO COc1cccc2c1ccnc2N1CC[C@@]2(C1)CCC[C@@H](CN1CC[NH+](C)CC1)O2 ZINC001164896210 721439635 /nfs/dbraw/zinc/43/96/35/721439635.db2.gz RBYHSBRQSHEKSW-YADARESESA-N 1 1 410.562 3.009 20 0 HGADMO Cc1cc2ncnc(N3CC[C@]4(C3)CCC[C@@H](CN3CC[NH+](C)CC3)O4)c2cc1C ZINC001164890734 721445835 /nfs/dbraw/zinc/44/58/35/721445835.db2.gz DRFITGMZHOVLET-RDPSFJRHSA-N 1 1 409.578 3.012 20 0 HGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1nc(C)nc3[nH]ccc31)CC2 ZINC001164783267 721454023 /nfs/dbraw/zinc/45/40/23/721454023.db2.gz AYPBULDLJVNJLA-IBGZPJMESA-N 1 1 413.566 3.000 20 0 HGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1nncc3ccccc31)CC2 ZINC001164789442 721455303 /nfs/dbraw/zinc/45/53/03/721455303.db2.gz WGNUSYBNCITGSJ-NRFANRHFSA-N 1 1 410.562 3.364 20 0 HGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1ccnc(C(C)C)n1)CC2 ZINC001164786727 721460704 /nfs/dbraw/zinc/46/07/04/721460704.db2.gz PGVZFNZSPMXGSZ-HXUWFJFHSA-N 1 1 402.583 3.334 20 0 HGADMO CCCc1cc(N2CCC3(C[C@H](COCC4CC4)[N@@H+](CCOC)C3)CC2)nc(C)n1 ZINC001164784133 721462922 /nfs/dbraw/zinc/46/29/22/721462922.db2.gz GZOBZNMCCMLCQO-JOCHJYFZSA-N 1 1 416.610 3.471 20 0 HGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1cc(C3CC3)ncn1)CC2 ZINC001164788303 721467994 /nfs/dbraw/zinc/46/79/94/721467994.db2.gz IXLNTEHDIVLRQN-FQEVSTJZSA-N 1 1 400.567 3.088 20 0 HGADMO C[N@@H+](Cc1ccncc1)C1CC2(C1)CCN(c1ccc(C(=O)NC3CC3)cn1)CC2 ZINC001164792617 721496862 /nfs/dbraw/zinc/49/68/62/721496862.db2.gz SGLCWHUUIRLMNV-UHFFFAOYSA-N 1 1 405.546 3.250 20 0 HGADMO COC(=O)c1cc(N2CC[N@H+]3C[C@@H](Oc4cccc(F)c4)C[C@H]3C2)ncc1Cl ZINC001164899600 721514477 /nfs/dbraw/zinc/51/44/77/721514477.db2.gz LGINNCUIZATLDO-HOCLYGCPSA-N 1 1 405.857 3.003 20 0 HGADMO Fc1cccc(O[C@H]2C[C@H]3CN(c4nc(Cl)nc5c4CSC5)CC[N@H+]3C2)c1 ZINC001164901628 721524298 /nfs/dbraw/zinc/52/42/98/721524298.db2.gz XTMLLXBEJAVHFX-ZFWWWQNUSA-N 1 1 406.914 3.358 20 0 HGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2nc(Cl)nc3[nH]cc(F)c32)[C@H]2CCCO[C@@H]12 ZINC001164795898 721526071 /nfs/dbraw/zinc/52/60/71/721526071.db2.gz UOIFHFUYBMSJJN-ZMSDIMECSA-N 1 1 416.888 3.014 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2nc(Cl)nc3[nH]cc(F)c32)[C@H]2CCCO[C@@H]12 ZINC001164795898 721526072 /nfs/dbraw/zinc/52/60/72/721526072.db2.gz UOIFHFUYBMSJJN-ZMSDIMECSA-N 1 1 416.888 3.014 20 0 HGADMO CSc1nc(Cl)cc(N2C[C@H]([N@H+](C)Cc3cccnc3)[C@H]3OCCC[C@@H]32)n1 ZINC001164794426 721526847 /nfs/dbraw/zinc/52/68/47/721526847.db2.gz DBHOMIIKXVIRFJ-MPGHIAIKSA-N 1 1 405.955 3.115 20 0 HGADMO CSc1nc(Cl)cc(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@H]3OCCC[C@@H]32)n1 ZINC001164794426 721526850 /nfs/dbraw/zinc/52/68/50/721526850.db2.gz DBHOMIIKXVIRFJ-MPGHIAIKSA-N 1 1 405.955 3.115 20 0 HGADMO Fc1cccc(O[C@H]2C[C@@H]3CN(c4nccc(-c5cccnc5F)n4)CC[N@H+]3C2)c1 ZINC001164911092 721545213 /nfs/dbraw/zinc/54/52/13/721545213.db2.gz VOIZYFCDMLNORM-AEFFLSMTSA-N 1 1 409.440 3.159 20 0 HGADMO COC(OC)c1cc(C)cnc1N1CC[N@H+]2C[C@H](Oc3cccc(F)c3)C[C@@H]2C1 ZINC001164909725 721547429 /nfs/dbraw/zinc/54/74/29/721547429.db2.gz RRSGMUHIOBEANX-IEBWSBKVSA-N 1 1 401.482 3.162 20 0 HGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN([C@H](F)Oc2ccc(Cl)nc2)[C@H]2CCCO[C@H]12 ZINC001164805366 721553974 /nfs/dbraw/zinc/55/39/74/721553974.db2.gz MZIQSOZAMVBKKU-HNJRGHQBSA-N 1 1 406.889 3.126 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN([C@H](F)Oc2ccc(Cl)nc2)[C@H]2CCCO[C@H]12 ZINC001164805366 721553976 /nfs/dbraw/zinc/55/39/76/721553976.db2.gz MZIQSOZAMVBKKU-HNJRGHQBSA-N 1 1 406.889 3.126 20 0 HGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(C(F)(F)c2cnc(Cl)cc2N)[C@@H]2CCCO[C@H]12 ZINC001164808631 721557815 /nfs/dbraw/zinc/55/78/15/721557815.db2.gz VGYANMZFGZPKFS-LMMKCTJWSA-N 1 1 423.895 3.125 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(C(F)(F)c2cnc(Cl)cc2N)[C@@H]2CCCO[C@H]12 ZINC001164808631 721557819 /nfs/dbraw/zinc/55/78/19/721557819.db2.gz VGYANMZFGZPKFS-LMMKCTJWSA-N 1 1 423.895 3.125 20 0 HGADMO COc1cc(OC)c2ncnc(N3CC[N@H+]4C[C@@H](Oc5cccc(F)c5)C[C@H]4C3)c2c1 ZINC001164905449 721566534 /nfs/dbraw/zinc/56/65/34/721566534.db2.gz HNCOROBYWJLBAJ-LPHOPBHVSA-N 1 1 424.476 3.128 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2nc(C3CC3)nc3[nH]ccc32)[C@H]2CCCO[C@@H]12 ZINC001164805659 721588786 /nfs/dbraw/zinc/58/87/86/721588786.db2.gz LKDPEGSNEXMNGU-XUVXKRRUSA-N 1 1 404.518 3.099 20 0 HGADMO COC(=O)c1cc(N2CCC(F)(F)[C@]3(CC[N@@H+](Cc4ccccn4)C3)C2)ncc1F ZINC001164906654 721697294 /nfs/dbraw/zinc/69/72/94/721697294.db2.gz NZYWWCWKFFUHNS-FQEVSTJZSA-N 1 1 420.435 3.140 20 0 HGADMO Cc1cc(C(F)(F)N2CCCC23CC[NH+](CC(=O)N(C)C)CC3)cc(Cl)n1 ZINC001165008218 721729623 /nfs/dbraw/zinc/72/96/23/721729623.db2.gz LCJMNMFBAGDDSV-UHFFFAOYSA-N 1 1 400.901 3.111 20 0 HGADMO CCOC(=O)c1cccnc1N1CCc2c(C[N@H+](C)Cc3ccco3)cncc2C1 ZINC001164908863 721745643 /nfs/dbraw/zinc/74/56/43/721745643.db2.gz MUKLYASKNBSUFM-UHFFFAOYSA-N 1 1 406.486 3.441 20 0 HGADMO CCOC(=O)c1cccnc1N1CCc2c(C[N@@H+](C)Cc3ccco3)cncc2C1 ZINC001164908863 721745648 /nfs/dbraw/zinc/74/56/48/721745648.db2.gz MUKLYASKNBSUFM-UHFFFAOYSA-N 1 1 406.486 3.441 20 0 HGADMO COc1cnc(N2C[C@@H]3CCC[C@H]([N@@H+](C)Cc4ccccn4)[C@@H]3C2)nc1NC(C)C ZINC001165024454 721798098 /nfs/dbraw/zinc/79/80/98/721798098.db2.gz LBOFVLSYHXEEIF-SXLOBPIMSA-N 1 1 410.566 3.437 20 0 HGADMO CSc1nc(Cl)nc(N2C[C@@H]3CCC[C@H]([N@@H+](C)Cc4ccccn4)[C@@H]3C2)n1 ZINC001165026638 721807078 /nfs/dbraw/zinc/80/70/78/721807078.db2.gz RQKQYULUAKGGBA-IMJJTQAJSA-N 1 1 404.971 3.379 20 0 HGADMO C[C@@H]1CC(=O)Nc2ncnc(N3C[C@@H]4CCC[C@@H]([N@@H+](C)Cc5ccccn5)[C@@H]4C3)c21 ZINC001165026522 721813489 /nfs/dbraw/zinc/81/34/89/721813489.db2.gz QYQFXNDNSOYREK-UKBAYJJMSA-N 1 1 406.534 3.054 20 0 HGADMO CON(C)C(=O)c1cc(C)cnc1N1C[C@@H]2CCC[C@@H]([N@@H+](C)Cc3ccccn3)[C@H]2C1 ZINC001165023593 721819893 /nfs/dbraw/zinc/81/98/93/721819893.db2.gz ICNDTQNOARCCCW-YUXAGFNASA-N 1 1 423.561 3.155 20 0 HGADMO COc1cnc2c(c1)ncnc2N1C[C@@H]2CCC[C@H]([N@@H+](C)Cc3ccccn3)[C@@H]2C1 ZINC001165025923 721820787 /nfs/dbraw/zinc/82/07/87/721820787.db2.gz OESPJYOWAFULLV-SCWSEQNSSA-N 1 1 404.518 3.165 20 0 HGADMO C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@@H]2CN([C@H](F)Oc3ccc(Cl)nn3)C[C@H]21 ZINC001165030217 721831956 /nfs/dbraw/zinc/83/19/56/721831956.db2.gz ZASCNMSITKAOJP-OYRIPWCXSA-N 1 1 405.905 3.389 20 0 HGADMO CN(C)CC[N@H+]1CC[C@H]2[C@@H]1CCN2c1nc(-c2ccccc2)nc(-c2ccccc2)n1 ZINC001164924077 721861470 /nfs/dbraw/zinc/86/14/70/721861470.db2.gz BSHYMQJXEVDRHB-VXKWHMMOSA-N 1 1 414.557 3.420 20 0 HGADMO C[NH+](C)CCN1CC[C@H]2[C@@H]1CCN2c1nc(-c2ccccc2)nc(-c2ccccc2)n1 ZINC001164924077 721861471 /nfs/dbraw/zinc/86/14/71/721861471.db2.gz BSHYMQJXEVDRHB-VXKWHMMOSA-N 1 1 414.557 3.420 20 0 HGADMO Cc1c(C)n(Cc2ccccc2)c2ncnc(N3CC[C@H]4[C@@H]3CC[N@@H+]4CCN(C)C)c12 ZINC001164931502 721879083 /nfs/dbraw/zinc/87/90/83/721879083.db2.gz FZQSEFTZNABTRU-VXKWHMMOSA-N 1 1 418.589 3.311 20 0 HGADMO Cc1c(C)n(Cc2ccccc2)c2ncnc(N3CC[C@H]4[C@@H]3CCN4CC[NH+](C)C)c12 ZINC001164931502 721879084 /nfs/dbraw/zinc/87/90/84/721879084.db2.gz FZQSEFTZNABTRU-VXKWHMMOSA-N 1 1 418.589 3.311 20 0 HGADMO C[C@@H]1CCc2c(sc3nc(C[NH+]4CCCCC4)nc(N4CCNC(=O)[C@@H]4C)c23)C1 ZINC001165036140 721883689 /nfs/dbraw/zinc/88/36/89/721883689.db2.gz JVNORPWLUHPAPC-CABCVRRESA-N 1 1 413.591 3.127 20 0 HGADMO CN(C)CC[N@@H+]1CC[C@@H]2[C@@H]1CCN2c1ccc(-c2ccc(N3CCCCC3)cc2)nn1 ZINC001164935137 721885745 /nfs/dbraw/zinc/88/57/45/721885745.db2.gz WNCABUMVKLEYPC-BJKOFHAPSA-N 1 1 420.605 3.349 20 0 HGADMO CN(C)CC[N@H+]1CC[C@@H]2[C@@H]1CCN2c1ccc(-c2ccc(N3CCCCC3)cc2)nn1 ZINC001164935137 721885746 /nfs/dbraw/zinc/88/57/46/721885746.db2.gz WNCABUMVKLEYPC-BJKOFHAPSA-N 1 1 420.605 3.349 20 0 HGADMO Cc1ccccc1Oc1nc(Cl)ncc1N1CC[C@@H]2[C@H]1CC[N@H+]2CCN(C)C ZINC001164934092 721888189 /nfs/dbraw/zinc/88/81/89/721888189.db2.gz PMFMTMDNKIYGFN-IAGOWNOFSA-N 1 1 401.942 3.445 20 0 HGADMO Cc1ccccc1Oc1nc(Cl)ncc1N1CC[C@@H]2[C@H]1CC[N@@H+]2CCN(C)C ZINC001164934092 721888192 /nfs/dbraw/zinc/88/81/92/721888192.db2.gz PMFMTMDNKIYGFN-IAGOWNOFSA-N 1 1 401.942 3.445 20 0 HGADMO Cc1ccc(Oc2nc(Cl)ncc2N2CC[C@H]3[C@@H]2CC[N@H+]3CCN(C)C)cc1 ZINC001164933628 721888196 /nfs/dbraw/zinc/88/81/96/721888196.db2.gz NMCWHDFLNQKVGG-ROUUACIJSA-N 1 1 401.942 3.445 20 0 HGADMO Cc1ccc(Oc2nc(Cl)ncc2N2CC[C@H]3[C@@H]2CC[N@@H+]3CCN(C)C)cc1 ZINC001164933628 721888198 /nfs/dbraw/zinc/88/81/98/721888198.db2.gz NMCWHDFLNQKVGG-ROUUACIJSA-N 1 1 401.942 3.445 20 0 HGADMO COc1ccccc1Oc1nc(Cl)ncc1N1CC[C@H]2[C@H]1CC[N@@H+]2CCN(C)C ZINC001164934416 721889145 /nfs/dbraw/zinc/88/91/45/721889145.db2.gz RLNUGAATSIFHJM-JKSUJKDBSA-N 1 1 417.941 3.146 20 0 HGADMO COc1ccccc1Oc1nc(Cl)ncc1N1CC[C@H]2[C@H]1CC[N@H+]2CCN(C)C ZINC001164934416 721889148 /nfs/dbraw/zinc/88/91/48/721889148.db2.gz RLNUGAATSIFHJM-JKSUJKDBSA-N 1 1 417.941 3.146 20 0 HGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2CCCn3cnc(Cn4cccn4)c3C2)nc1 ZINC001164937946 721915935 /nfs/dbraw/zinc/91/59/35/721915935.db2.gz ICHXUGZNVNQHLQ-OAQYLSRUSA-N 1 1 405.550 3.480 20 0 HGADMO Cc1ccc(C[N@H+]2CCOC3(CCN(c4ccc(Cl)c(C(N)=O)n4)CC3)C2)cc1 ZINC001164938784 721921702 /nfs/dbraw/zinc/92/17/02/721921702.db2.gz RGHJQAFCPFISTM-UHFFFAOYSA-N 1 1 414.937 3.014 20 0 HGADMO Cc1ccc(C[N@H+]2CCOC3(CCN(c4cc(Cl)ncc4C(N)=O)CC3)C2)cc1 ZINC001164938316 721921886 /nfs/dbraw/zinc/92/18/86/721921886.db2.gz LKADPQKYVGDTGO-UHFFFAOYSA-N 1 1 414.937 3.014 20 0 HGADMO O=C1NCC[N@@H+](Cc2ccccc2)C12CCN(c1nccc3ccc(F)cc31)CC2 ZINC001164947697 721974484 /nfs/dbraw/zinc/97/44/84/721974484.db2.gz QRLRORUJCATKTE-UHFFFAOYSA-N 1 1 404.489 3.345 20 0 HGADMO O=C1NCC[N@H+](Cc2ccccc2)C12CCN(c1nccc3ccc(F)cc31)CC2 ZINC001164947697 721974486 /nfs/dbraw/zinc/97/44/86/721974486.db2.gz QRLRORUJCATKTE-UHFFFAOYSA-N 1 1 404.489 3.345 20 0 HGADMO COC(=O)c1ccc2ncnc(N3CCC4(CC[N@@H+](Cc5cccnc5)C4)CC3)c2c1 ZINC001164954856 722013876 /nfs/dbraw/zinc/01/38/76/722013876.db2.gz PHILQUUZDTWREU-UHFFFAOYSA-N 1 1 417.513 3.304 20 0 HGADMO COC(=O)c1cccc2nc(N3CCC4(CC[N@@H+](Cc5cccnc5)C4)CC3)ncc21 ZINC001164953662 722015764 /nfs/dbraw/zinc/01/57/64/722015764.db2.gz WTVBZZASIXTBTR-UHFFFAOYSA-N 1 1 417.513 3.304 20 0 HGADMO COC(=O)c1ccc(Cl)c(N2CCC3(CC[N@@H+](Cc4cccnc4)C3)CC2)n1 ZINC001164952072 722018925 /nfs/dbraw/zinc/01/89/25/722018925.db2.gz GTRIEOSSUUDODD-UHFFFAOYSA-N 1 1 400.910 3.409 20 0 HGADMO CN(C)C(=O)c1cnc(N2CCC3(CC[N@@H+](Cc4cccnc4)C3)CC2)c(Cl)c1 ZINC001164955913 722022157 /nfs/dbraw/zinc/02/21/57/722022157.db2.gz SGOKMANLBVYNJL-UHFFFAOYSA-N 1 1 413.953 3.324 20 0 HGADMO O=C(c1ccco1)N1CC[C@H]2CN(c3nc(Cl)ccc3C[NH+]3CCCC3)C[C@@H]21 ZINC001164960815 722047389 /nfs/dbraw/zinc/04/73/89/722047389.db2.gz XHMJWMQRQUOTTB-RDJZCZTQSA-N 1 1 400.910 3.275 20 0 HGADMO c1ccc(-c2cc(N3CCC4(CC3)COCC[N@H+](Cc3ccncc3)C4)ncn2)nc1 ZINC001164960690 722060263 /nfs/dbraw/zinc/06/02/63/722060263.db2.gz HSERYADIYOAGDH-UHFFFAOYSA-N 1 1 416.529 3.053 20 0 HGADMO COC(=O)c1ccc(-c2ccc(N3C[C@@H]4C[N@H+](CC5CC5)C[C@H](C3)O4)nc2C)cc1 ZINC001164966978 722074896 /nfs/dbraw/zinc/07/48/96/722074896.db2.gz HZSKUTBVNKYQEA-OYRHEFFESA-N 1 1 407.514 3.143 20 0 HGADMO Fc1ccc(Oc2nc(Cl)ncc2N2C[C@@H]3C[N@H+](CC4CC4)C[C@H](C2)O3)cc1 ZINC001164967508 722075891 /nfs/dbraw/zinc/07/58/91/722075891.db2.gz SNINSPLTONEJTD-CALCHBBNSA-N 1 1 404.873 3.361 20 0 HGADMO COc1ccc2nc(C(F)(F)N3C[C@@H]4C[N@@H+](CC5CC5)C[C@H](C3)O4)nc(Cl)c2c1 ZINC001164967437 722076029 /nfs/dbraw/zinc/07/60/29/722076029.db2.gz QEFQURFHARTBNE-GASCZTMLSA-N 1 1 424.879 3.136 20 0 HGADMO COc1ccc2nc(C(F)(F)N3C[C@@H]4C[N@H+](CC5CC5)C[C@H](C3)O4)nc(Cl)c2c1 ZINC001164967437 722076031 /nfs/dbraw/zinc/07/60/31/722076031.db2.gz QEFQURFHARTBNE-GASCZTMLSA-N 1 1 424.879 3.136 20 0 HGADMO FC(F)(c1ccc(Cl)nc1)N1CC[C@H]2C[N@@H+](Cc3cccnc3)CCO[C@@H]2C1 ZINC001164981348 722098713 /nfs/dbraw/zinc/09/87/13/722098713.db2.gz LDPSFBSEVXSMBQ-FUHWJXTLSA-N 1 1 408.880 3.402 20 0 HGADMO Clc1nnc(N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)c2ccccc12 ZINC001164984271 722103732 /nfs/dbraw/zinc/10/37/32/722103732.db2.gz RUDFFNDYBAKUKF-PXNSSMCTSA-N 1 1 409.921 3.406 20 0 HGADMO c1ccc(-c2ccc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)nn2)cc1 ZINC001164984307 722105011 /nfs/dbraw/zinc/10/50/11/722105011.db2.gz SHOUNHBZCJQVLP-GGAORHGYSA-N 1 1 401.514 3.266 20 0 HGADMO c1ccc(-c2ccc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)nn2)cc1 ZINC001164984306 722105335 /nfs/dbraw/zinc/10/53/35/722105335.db2.gz SHOUNHBZCJQVLP-FYYLOGMGSA-N 1 1 401.514 3.266 20 0 HGADMO Clc1nc2c(c(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)n1)CCCC2 ZINC001164977271 722106224 /nfs/dbraw/zinc/10/62/24/722106224.db2.gz FNLXKACDCJSQBV-PXNSSMCTSA-N 1 1 413.953 3.131 20 0 HGADMO Clc1ccc2nc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)cnc2c1 ZINC001164975656 722110661 /nfs/dbraw/zinc/11/06/61/722110661.db2.gz KEQIMXURVIJJDY-DYESRHJHSA-N 1 1 409.921 3.406 20 0 HGADMO Clc1ccc2ncc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)nc2c1 ZINC001164981084 722112822 /nfs/dbraw/zinc/11/28/22/722112822.db2.gz SKLVFPHLHRQPSB-UTKZUKDTSA-N 1 1 409.921 3.406 20 0 HGADMO CCCN(CCC)c1cc(N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)ncn1 ZINC001164975194 722131765 /nfs/dbraw/zinc/13/17/65/722131765.db2.gz FNBQVZQZRGRNNN-FCHUYYIVSA-N 1 1 424.593 3.225 20 0 HGADMO COc1cc(N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)nc2ccccc21 ZINC001164984643 722132060 /nfs/dbraw/zinc/13/20/60/722132060.db2.gz YEWRKXCHLXULCP-AUSIDOKSSA-N 1 1 404.514 3.366 20 0 HGADMO COc1cc(N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)nc2ccccc21 ZINC001164984646 722132604 /nfs/dbraw/zinc/13/26/04/722132604.db2.gz YEWRKXCHLXULCP-XXBNENTESA-N 1 1 404.514 3.366 20 0 HGADMO Clc1ccnc2ccc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)nc12 ZINC001164978081 722135939 /nfs/dbraw/zinc/13/59/39/722135939.db2.gz JQUUOAADWVJPOI-FXAWDEMLSA-N 1 1 409.921 3.406 20 0 HGADMO CCc1nc(Cl)c(N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)c(Cl)n1 ZINC001164972640 722146738 /nfs/dbraw/zinc/14/67/38/722146738.db2.gz AFYNKMXTJQDTRO-CVEARBPZSA-N 1 1 422.360 3.468 20 0 HGADMO CSc1ccc2ncnc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)c2c1 ZINC001164972566 722154219 /nfs/dbraw/zinc/15/42/19/722154219.db2.gz IKCCJTLQNCHQCS-XMSQKQJNSA-N 1 1 421.570 3.474 20 0 HGADMO c1cncc(C[N@H+]2CCO[C@@H]3CN(c4cncc(OCC5CCCC5)n4)CC[C@@H]3C2)c1 ZINC001164971076 722154569 /nfs/dbraw/zinc/15/45/69/722154569.db2.gz ALJRQKOBIMEPRI-FGZHOGPDSA-N 1 1 423.561 3.168 20 0 HGADMO CSc1cc(N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)nc(SC)n1 ZINC001164974788 722156621 /nfs/dbraw/zinc/15/66/21/722156621.db2.gz QLGJLMONQXNIRI-IRXDYDNUSA-N 1 1 417.604 3.043 20 0 HGADMO COc1cc(C)c2ncnc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)c2c1 ZINC001164977126 722159077 /nfs/dbraw/zinc/15/90/77/722159077.db2.gz XGNKTHHMCOIOAQ-SIKLNZKXSA-N 1 1 419.529 3.069 20 0 HGADMO COC(=O)c1c[nH]c2ncnc(N3CCC[C@]4(CC[N@H+]4Cc4cccc(F)c4)C3)c12 ZINC001164997300 722202351 /nfs/dbraw/zinc/20/23/51/722202351.db2.gz YXBOQDUVAXHQPU-QFIPXVFZSA-N 1 1 409.465 3.129 20 0 HGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2CCO[C@@H]3C[C@@H](C(=O)NC(C)C)C[C@@H]32)nc1 ZINC001164997852 722216729 /nfs/dbraw/zinc/21/67/29/722216729.db2.gz SMXIPZSKMWHYGF-JSXRDJHFSA-N 1 1 400.567 3.137 20 0 HGADMO C[NH+]1CCN(c2ncnc3c2CCN(c2nccc4cccc(Cl)c42)CC3)CC1 ZINC001164996638 722233968 /nfs/dbraw/zinc/23/39/68/722233968.db2.gz HPGOLKHSNDZILJ-UHFFFAOYSA-N 1 1 408.937 3.035 20 0 HGADMO OCC1([NH2+]Cc2nc(Cc3cccc(Br)c3)no2)Cc2ccccc2C1 ZINC000512332035 1126095609 /nfs/dbraw/zinc/09/56/09/1126095609.db2.gz MSZCSNZZGLCLCQ-UHFFFAOYSA-N 1 1 414.303 3.042 20 0 HGADMO OC[C@@]1([NH2+]Cc2ncn(-c3ccccc3)n2)CCc2cc(Br)ccc2C1 ZINC001307927646 1126161997 /nfs/dbraw/zinc/16/19/97/1126161997.db2.gz FBPBBBUZJOOUCB-HXUWFJFHSA-N 1 1 413.319 3.039 20 0 HGADMO CN(C)Cc1ccc(C[NH2+][C@](C)(CO)Cc2ccccc2F)c2c1OC(F)(F)O2 ZINC001560548143 1126212072 /nfs/dbraw/zinc/21/20/72/1126212072.db2.gz CNNCSSIFORCVAG-FQEVSTJZSA-N 1 1 410.436 3.292 20 0 HGADMO CCOC(=O)c1nnc(Cl)cc1N1CCC[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]21 ZINC001164625807 719073854 /nfs/dbraw/zinc/07/38/54/719073854.db2.gz NHLSFVOGJMWHTC-FUHWJXTLSA-N 1 1 400.910 3.408 20 0 HGADMO O=C1NCc2c1c(N1CCC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]31)nc(Cl)c2F ZINC001164628948 719083191 /nfs/dbraw/zinc/08/31/91/719083191.db2.gz VDGQHSCHZLZOMW-ZBFHGGJFSA-N 1 1 400.885 3.218 20 0 HGADMO CCCNC(=O)c1cc(Cl)nc(N2CCC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)n1 ZINC001164621882 719114605 /nfs/dbraw/zinc/11/46/05/719114605.db2.gz BJZRICKTUAKMRS-IEBWSBKVSA-N 1 1 413.953 3.371 20 0 HGADMO C[NH+]1CCC(Oc2ccnc(N3CCC(n4c5ccccc5[nH]c4=O)CC3)c2)CC1 ZINC001164623156 719128937 /nfs/dbraw/zinc/12/89/37/719128937.db2.gz RGTLHPPEKYUXBX-UHFFFAOYSA-N 1 1 407.518 3.451 20 0 HGADMO CC(C)n1nc(C[NH+](C)C)c2c1CN(c1nc(Cl)nc3c1CSCC3)CC2 ZINC001164647841 719308161 /nfs/dbraw/zinc/30/81/61/719308161.db2.gz NUJOLODBMNNFTN-UHFFFAOYSA-N 1 1 406.987 3.321 20 0 HGADMO CC(C)n1nc(C[NH+](C)C)c2c1CN(c1cc(NC(=O)OC(C)(C)C)ncn1)CC2 ZINC001164649113 719308558 /nfs/dbraw/zinc/30/85/58/719308558.db2.gz UILLPVMGFZUZPN-UHFFFAOYSA-N 1 1 415.542 3.225 20 0 HGADMO COC(=O)c1ccc2c(ccnc2N2CCc3c(C[NH+](C)C)nn(C(C)C)c3C2)c1 ZINC001164649704 719309865 /nfs/dbraw/zinc/30/98/65/719309865.db2.gz QXYBSENJVDPBPQ-UHFFFAOYSA-N 1 1 407.518 3.423 20 0 HGADMO CCOC(=O)c1ccc2ncnc(N3CCc4c(C[NH+](C)C)nn(C(C)C)c4C3)c2c1 ZINC001164648231 719311469 /nfs/dbraw/zinc/31/14/69/719311469.db2.gz HDTLROGLWBMHHI-UHFFFAOYSA-N 1 1 422.533 3.208 20 0 HGADMO CN(C[C@H](O)CO)c1nc(C[NH+]2CCCCC2)nc2scc(-c3ccccc3)c21 ZINC001164668390 719366134 /nfs/dbraw/zinc/36/61/34/719366134.db2.gz NDXRIUISVYWNSQ-KRWDZBQOSA-N 1 1 412.559 3.134 20 0 HGADMO CNC(=O)C[N@H+]1CCCC12CCN(c1nc(Cl)nc3ccc(Cl)cc31)CC2 ZINC001164686616 719698860 /nfs/dbraw/zinc/69/88/60/719698860.db2.gz PAGQXJTZAGAZHS-UHFFFAOYSA-N 1 1 408.333 3.117 20 0 HGADMO CNC(=O)C[N@H+]1CCCC12CCN(C(F)(F)c1ccc3cnc(Cl)nc3c1)CC2 ZINC001164686766 719725921 /nfs/dbraw/zinc/72/59/21/719725921.db2.gz ROWLPFJAIUDHCM-UHFFFAOYSA-N 1 1 423.895 3.009 20 0 HGADMO COC[C@H]1CN(c2ccc3c(n2)CC[N@H+](Cc2ccccc2)C3)Cc2cn(C)nc21 ZINC001164696244 719831457 /nfs/dbraw/zinc/83/14/57/719831457.db2.gz QWOKLAQVRFOWJZ-OAQYLSRUSA-N 1 1 403.530 3.124 20 0 HGADMO COC(=O)[C@]1(C)C[C@H]([NH+]2CCOCC2)CCN1c1cc(Cl)nc2ccccc21 ZINC001164702644 719838053 /nfs/dbraw/zinc/83/80/53/719838053.db2.gz OLGDVLIBZISAGB-VFNWGFHPSA-N 1 1 403.910 3.121 20 0 HGADMO COC(=O)[C@]1(C)C[C@@H]([NH+]2CCOCC2)CCN1c1nc(Cl)cc2ccc(F)cc21 ZINC001164699338 719847034 /nfs/dbraw/zinc/84/70/34/719847034.db2.gz HMPGNGNQYSQDMH-KKSFZXQISA-N 1 1 421.900 3.260 20 0 HGADMO COC(=O)[C@]1(C)C[C@@H]([NH+]2CCOCC2)CCN1c1cc(Cl)nc2ccsc21 ZINC001164703275 719849434 /nfs/dbraw/zinc/84/94/34/719849434.db2.gz PRENUNMBSLFZKY-DJJJIMSYSA-N 1 1 409.939 3.182 20 0 HGADMO COC(=O)[C@]1(C)C[C@H]([NH+]2CCOCC2)CCN1c1nccc2c(Cl)cccc21 ZINC001164702934 719852933 /nfs/dbraw/zinc/85/29/33/719852933.db2.gz OHVBTQNHVIEJTD-VFNWGFHPSA-N 1 1 403.910 3.121 20 0 HGADMO COC(=O)c1cc(C)nc(N2CCC3(CC2)C[N@@H+](Cc2cccs2)CCO3)c1 ZINC001164702259 719886722 /nfs/dbraw/zinc/88/67/22/719886722.db2.gz PTDHXPALMNDMGH-UHFFFAOYSA-N 1 1 401.532 3.110 20 0 HGADMO COC(=O)c1cc(N2CCC3(CC2)C[N@@H+](Cc2cccs2)CCO3)ncc1Cl ZINC001164694870 719887707 /nfs/dbraw/zinc/88/77/07/719887707.db2.gz FZUDDUCSGMJQJS-UHFFFAOYSA-N 1 1 421.950 3.455 20 0 HGADMO COC(=O)c1cc(Cl)cc(N2CCC3(CC2)C[N@@H+](Cc2cccs2)CCO3)n1 ZINC001164695325 719888770 /nfs/dbraw/zinc/88/87/70/719888770.db2.gz NTOBPBWBGSOHHW-UHFFFAOYSA-N 1 1 421.950 3.455 20 0 HGADMO COC(=O)c1ccc(N2CCC3(CC2)C[N@@H+](Cc2cccs2)CCO3)nc1C ZINC001164695353 719891276 /nfs/dbraw/zinc/89/12/76/719891276.db2.gz PGLNOBNBDHKGHV-UHFFFAOYSA-N 1 1 401.532 3.110 20 0 HGADMO CC(C)n1cnc2cnc(N3CCC4(CC3)C[N@@H+](Cc3cccs3)CCO4)nc21 ZINC001164707524 719898570 /nfs/dbraw/zinc/89/85/70/719898570.db2.gz SPMSWAPJVAYIEJ-UHFFFAOYSA-N 1 1 412.563 3.340 20 0 HGADMO CCOC(=O)c1cnc(Cl)cc1N1CC[C@]2(C1)C[N@@H+](CC1CC1)C[C@H]2COC ZINC001164809741 720068699 /nfs/dbraw/zinc/06/86/99/720068699.db2.gz JTEUMGUEMNZPKX-HRAATJIYSA-N 1 1 407.942 3.096 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1nc(Cl)nc3c1CSCC3)C2 ZINC001164811659 720082738 /nfs/dbraw/zinc/08/27/38/720082738.db2.gz OTHCTKPLMUWYMJ-QRWLVFNGSA-N 1 1 408.999 3.104 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1cc(NC(=O)OC(C)(C)C)ncn1)C2 ZINC001164811273 720086022 /nfs/dbraw/zinc/08/60/22/720086022.db2.gz NSHVRDXIHJHETB-JTSKRJEESA-N 1 1 417.554 3.008 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(C(F)(F)Oc1cccnc1Cl)C2 ZINC001164807390 720089769 /nfs/dbraw/zinc/08/97/69/720089769.db2.gz FHPIEFBFZQBZJG-YJBOKZPZSA-N 1 1 401.885 3.344 20 0 HGADMO COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1nc(Cl)nc(Cl)n1)CC2 ZINC001164717417 720108049 /nfs/dbraw/zinc/10/80/49/720108049.db2.gz ORSXJAQFWGHATK-OAHLLOKOSA-N 1 1 423.348 3.081 20 0 HGADMO COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1ncnc3cnc(F)cc31)CC2 ZINC001164719063 720108137 /nfs/dbraw/zinc/10/81/37/720108137.db2.gz VBVBZIAIGHFWHW-SFHVURJKSA-N 1 1 422.508 3.066 20 0 HGADMO COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1ccc(C(=O)OC)c(C)n1)CC2 ZINC001164716181 720113349 /nfs/dbraw/zinc/11/33/49/720113349.db2.gz JIZVIDWQQVFRLS-FQEVSTJZSA-N 1 1 424.545 3.079 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1ccc(C(=O)OC(C)(C)C)cn1)C2 ZINC001164810005 720114863 /nfs/dbraw/zinc/11/48/63/720114863.db2.gz JELHBDCQDSUIQE-CVDCTZTESA-N 1 1 401.551 3.222 20 0 HGADMO COC[C@H]1C[N@H+](CC2CC2)C[C@]12CCN(c1nccc3cc(OC)c(OC)cc31)C2 ZINC001164807064 720123348 /nfs/dbraw/zinc/12/33/48/720123348.db2.gz BHCUYVAMZVLHNF-DVECYGJZSA-N 1 1 411.546 3.437 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1nccc3cc(OC)c(OC)cc31)C2 ZINC001164807064 720123353 /nfs/dbraw/zinc/12/33/53/720123353.db2.gz BHCUYVAMZVLHNF-DVECYGJZSA-N 1 1 411.546 3.437 20 0 HGADMO COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1cc(OCC3CC3)ncn1)CC2 ZINC001164716953 720124447 /nfs/dbraw/zinc/12/44/47/720124447.db2.gz MDRNTMCESKHPAO-OAQYLSRUSA-N 1 1 423.561 3.168 20 0 HGADMO COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1cc(C(=O)OC)c(C)cn1)CC2 ZINC001164718564 720125720 /nfs/dbraw/zinc/12/57/20/720125720.db2.gz SJIZLHQCYLBWMU-FQEVSTJZSA-N 1 1 424.545 3.079 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1cc(OCc3ccccc3)cnn1)C2 ZINC001164807292 720131693 /nfs/dbraw/zinc/13/16/93/720131693.db2.gz BTIYFJKTAQQYJJ-URXFXBBRSA-N 1 1 408.546 3.240 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1ccc3cc(OC)c(OC)cc3n1)C2 ZINC001164807007 720133117 /nfs/dbraw/zinc/13/31/17/720133117.db2.gz ADDVZXWIMCMOEU-NTKDMRAZSA-N 1 1 411.546 3.437 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(C(F)(F)c1nc(C)c(C)c(Cl)n1)C2 ZINC001164807983 720137607 /nfs/dbraw/zinc/13/76/07/720137607.db2.gz DHUROJZGNLXOGU-VQIMIIECSA-N 1 1 414.928 3.476 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(C(F)(F)COc1cccc(Cl)n1)C2 ZINC001164815859 720137765 /nfs/dbraw/zinc/13/77/65/720137765.db2.gz WLNGXAPZHSPWFK-QFBILLFUSA-N 1 1 415.912 3.387 20 0 HGADMO COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1nccnc1OC1CCC1)CC2 ZINC001164711712 720151287 /nfs/dbraw/zinc/15/12/87/720151287.db2.gz IGZUUXKVMOUEDS-FQEVSTJZSA-N 1 1 423.561 3.310 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1cc(-c3nc(C4CC4)no3)ccn1)C2 ZINC001164817544 720189838 /nfs/dbraw/zinc/18/98/38/720189838.db2.gz PUXZSBWBHZITLM-AUSIDOKSSA-N 1 1 409.534 3.194 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1ncnc3c1ncn3-c1ccccc1)C2 ZINC001164819735 720190254 /nfs/dbraw/zinc/19/02/54/720190254.db2.gz XYIWFTNVHZWBST-DVECYGJZSA-N 1 1 418.545 3.000 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(C(F)(F)Oc1ccnc(Cl)c1)C2 ZINC001164812755 720196502 /nfs/dbraw/zinc/19/65/02/720196502.db2.gz MBMBCMQRBAEAFR-QAPCUYQASA-N 1 1 401.885 3.344 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1ncnc3[nH]c4cc(F)ccc4c31)C2 ZINC001164811736 720203864 /nfs/dbraw/zinc/20/38/64/720203864.db2.gz JYIYEHFASGZHJC-QMHKHESXSA-N 1 1 409.509 3.435 20 0 HGADMO CC(C)[N@@H+](C)Cc1cc(=O)n2c(n1)CN(c1cc(Cl)nc3ncccc13)CCC2 ZINC001164812184 720219981 /nfs/dbraw/zinc/21/99/81/720219981.db2.gz GGVYGXRQFUAGIY-UHFFFAOYSA-N 1 1 412.925 3.090 20 0 HGADMO COc1ccc2c(C)cc(N3CCCn4c(=O)cc(C[N@@H+](C)C(C)C)nc4C3)nc2c1 ZINC001164814519 720229724 /nfs/dbraw/zinc/22/97/24/720229724.db2.gz WVQOFTSLSPMNRE-UHFFFAOYSA-N 1 1 421.545 3.359 20 0 HGADMO CC[C@@H](C)c1nc2[nH]ccc2c(N2CCCn3c(=O)cc(C[N@@H+](C)C(C)C)nc3C2)n1 ZINC001164817699 720247398 /nfs/dbraw/zinc/24/73/98/720247398.db2.gz TXECCSZZIUOYMT-MRXNPFEDSA-N 1 1 423.565 3.279 20 0 HGADMO CC(C)[N@@H+](C)Cc1cc(=O)n2c(n1)CN(C(C)(C)c1ccnc(Cl)c1)CCC2 ZINC001164816759 720247911 /nfs/dbraw/zinc/24/79/11/720247911.db2.gz MGRGQHPBLQDPPG-UHFFFAOYSA-N 1 1 403.958 3.273 20 0 HGADMO CC[C@H](C)c1nc2[nH]ccc2c(N2CCCn3c(=O)cc(C[N@@H+](C)C(C)C)nc3C2)n1 ZINC001164817698 720248474 /nfs/dbraw/zinc/24/84/74/720248474.db2.gz TXECCSZZIUOYMT-INIZCTEOSA-N 1 1 423.565 3.279 20 0 HGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2Cc3ccnn3C[C@@H](C(=O)N3CCCC3)C2)nc1 ZINC001164820321 720268009 /nfs/dbraw/zinc/26/80/09/720268009.db2.gz VSQHYQBOYBPLHV-RBBKRZOGSA-N 1 1 422.577 3.084 20 0 HGADMO CCOC(=O)c1cnc(Cl)c(C)c1N1CC[C@H]2[C@@H]1CC[N@H+]2Cc1cccnc1 ZINC001164725096 720395578 /nfs/dbraw/zinc/39/55/78/720395578.db2.gz LUOQWKBVQOCSIB-ROUUACIJSA-N 1 1 400.910 3.468 20 0 HGADMO COC(=O)c1cc2c(N3CC[C@@H]4[C@H]3CC[N@H+]4Cc3cccnc3)[nH]c(Cl)cc-2n1 ZINC001164731723 720412589 /nfs/dbraw/zinc/41/25/89/720412589.db2.gz MDLFKLCVALUDAD-QZTJIDSGSA-N 1 1 411.893 3.251 20 0 HGADMO CN(C)c1ccc(-c2ccnc(N3CC[C@H]4[C@@H]3CC[N@H+]4Cc3cccnc3)n2)cc1 ZINC001164732820 720420065 /nfs/dbraw/zinc/42/00/65/720420065.db2.gz OINXKEGMBDRKQV-GOTSBHOMSA-N 1 1 400.530 3.458 20 0 HGADMO COC(=O)c1ccc(Cl)nc1N1CC[C@@H]2[C@H](C[C@H](Cn3cccn3)[N@H+]2C(C)C)C1 ZINC001164841114 720508039 /nfs/dbraw/zinc/50/80/39/720508039.db2.gz XOEWGPSJTKEDDM-JFIYKMOQSA-N 1 1 417.941 3.096 20 0 HGADMO CCOC(=O)/C=C/c1cccnc1N1CC[C@@H]2[C@H](C[C@@H](Cn3cccn3)[N@H+]2C(C)C)C1 ZINC001164832349 720512468 /nfs/dbraw/zinc/51/24/68/720512468.db2.gz ACAZYTDGOPHQRA-BWPXKEADSA-N 1 1 423.561 3.232 20 0 HGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@H]2CN(c3nc(Cl)nc4c3CCC4)CC[C@@H]21 ZINC001164840781 720516327 /nfs/dbraw/zinc/51/63/27/720516327.db2.gz XNIQFOCJFAQDEV-BXWFABGCSA-N 1 1 400.958 3.193 20 0 HGADMO CSc1ncc(Cl)c(N2CC[C@@H]3[C@H](C[C@@H](Cn4cccn4)[N@H+]3C(C)C)C2)n1 ZINC001164833815 720518128 /nfs/dbraw/zinc/51/81/28/720518128.db2.gz DRKJNHOLUUGWDR-HLLBOEOZSA-N 1 1 406.987 3.426 20 0 HGADMO COc1ccc2ncnc(N3CC[C@@H]4[C@@H](C[C@@H](Cn5cccn5)[N@H+]4C(C)C)C3)c2c1 ZINC001164837233 720521375 /nfs/dbraw/zinc/52/13/75/720521375.db2.gz OPIDRXWTELBMSF-NPPFBWRTSA-N 1 1 406.534 3.213 20 0 HGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@@H]2CN(c3nc(Cl)nc4c3ccn4C)CC[C@@H]21 ZINC001164841132 720527301 /nfs/dbraw/zinc/52/73/01/720527301.db2.gz XORXQDDDOSMBTE-RYRKJORJSA-N 1 1 413.957 3.196 20 0 HGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@H]2CN(c3nc(Cl)nc4c3SCC4)CC[C@@H]21 ZINC001164833642 720530625 /nfs/dbraw/zinc/53/06/25/720530625.db2.gz BBLYDWIMDKREBF-ZOBUZTSGSA-N 1 1 418.998 3.353 20 0 HGADMO COC(=O)c1nc(N2CC[C@@H]3[C@@H](C[C@@H](Cn4cccn4)[N@H+]3C(C)C)C2)ccc1Cl ZINC001164835894 720540137 /nfs/dbraw/zinc/54/01/37/720540137.db2.gz IXVBSBPNTZLVQD-XYJFISCASA-N 1 1 417.941 3.096 20 0 HGADMO COC(=O)c1c(C)cc(C)nc1N1CC[C@@H]2[C@@H](C[C@H](Cn3cccn3)[N@H+]2C(C)C)C1 ZINC001164833756 720540573 /nfs/dbraw/zinc/54/05/73/720540573.db2.gz BMNKJENTPZWOOL-XUVXKRRUSA-N 1 1 411.550 3.059 20 0 HGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@@H]2CN([C@H](F)Oc3ccc(Cl)nc3)CC[C@@H]21 ZINC001164839550 720544618 /nfs/dbraw/zinc/54/46/18/720544618.db2.gz QMROUIYSHDULJJ-JMVFIXPQSA-N 1 1 407.921 3.437 20 0 HGADMO CC(C)[N@@H+]1[C@@H]2CCN(c3ncnc4cc(Cl)cnc43)C[C@H]2C[C@H]1Cn1cccn1 ZINC001164836603 720558761 /nfs/dbraw/zinc/55/87/61/720558761.db2.gz KFFDUNBSINZJBT-HHXXYDBFSA-N 1 1 411.941 3.253 20 0 HGADMO CC(C)[N@@H+]1[C@@H]2CCN(C(F)(F)c3cncc(Cl)n3)C[C@H]2C[C@H]1Cn1cccn1 ZINC001164842232 720579681 /nfs/dbraw/zinc/57/96/81/720579681.db2.gz UUZXTVAPUVNWGE-OWCLPIDISA-N 1 1 410.900 3.249 20 0 HGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@H]2CN(C(F)(F)c3nccnc3Cl)CC[C@@H]21 ZINC001164835288 720587676 /nfs/dbraw/zinc/58/76/76/720587676.db2.gz AYVIBSNYLCAUSY-JYJNAYRXSA-N 1 1 410.900 3.249 20 0 HGADMO CC(C)[N@@H+]1[C@@H]2CCN(c3ccnc(N4CCCCC4)n3)C[C@H]2C[C@H]1Cn1cccn1 ZINC001164844155 720597862 /nfs/dbraw/zinc/59/78/62/720597862.db2.gz ZHHFYLNMTOMTQA-QHAWAJNXSA-N 1 1 409.582 3.041 20 0 HGADMO COc1cccc2ncnc(N3CC[C@@H]4[C@@H](C[C@H](Cn5cccn5)[N@H+]4C(C)C)C3)c21 ZINC001164837169 720609330 /nfs/dbraw/zinc/60/93/30/720609330.db2.gz HJEHKXSDWPPBRU-NLWGTHIKSA-N 1 1 406.534 3.213 20 0 HGADMO Cc1noc(-c2ccnc(N3CC[C@@H]4[C@@H](C[C@H](Cn5cccn5)[N@@H+]4C(C)C)C3)c2)n1 ZINC001164842903 720614400 /nfs/dbraw/zinc/61/44/00/720614400.db2.gz WGDBCWBMIFAXAN-XUVXKRRUSA-N 1 1 407.522 3.014 20 0 HGADMO CC(C)OC(=O)c1cccnc1N1CC[C@@H]2[C@H](C[C@@H](Cn3cccn3)[N@H+]2C(C)C)C1 ZINC001164835186 720635122 /nfs/dbraw/zinc/63/51/22/720635122.db2.gz AMEVVDWEWHTWDK-SVFBPWRDSA-N 1 1 411.550 3.221 20 0 HGADMO COC(=O)c1cc(C)nc(N2CCC3(C[C@H]([N@@H+](C)Cc4ccccc4)CO3)CC2)c1 ZINC001164843207 720662701 /nfs/dbraw/zinc/66/27/01/720662701.db2.gz VGCPAJDVIJHWOO-NRFANRHFSA-N 1 1 409.530 3.437 20 0 HGADMO C[N@@H+](Cc1ccccc1)[C@@H]1COC2(C1)CCN(c1ncc(Cl)cc1C(N)=O)CC2 ZINC001164840422 720666712 /nfs/dbraw/zinc/66/67/12/720666712.db2.gz MHEXMFCJFADZIJ-SFHVURJKSA-N 1 1 414.937 3.094 20 0 HGADMO Clc1cnc2cc(Cl)c(N3CC[N@H+]4C[C@@H](Oc5cncnc5)C[C@@H]4C3)cc2n1 ZINC001164740619 720679443 /nfs/dbraw/zinc/67/94/43/720679443.db2.gz RCTOBJARSGODIU-OLZOCXBDSA-N 1 1 417.300 3.069 20 0 HGADMO COC(=O)c1cnc(N2CCC3(C[C@H]([N@@H+](C)Cc4ccccc4)CO3)CC2)c(F)c1 ZINC001164841266 720683244 /nfs/dbraw/zinc/68/32/44/720683244.db2.gz IRBZBHUEZKWHQJ-IBGZPJMESA-N 1 1 413.493 3.267 20 0 HGADMO CN(C)C(=O)c1ccc(N2CCC3(C[C@@H]([N@@H+](C)Cc4ccccc4)CO3)CC2)nc1 ZINC001164841084 720683529 /nfs/dbraw/zinc/68/35/29/720683529.db2.gz HNQVIFDAFBCJJG-OAQYLSRUSA-N 1 1 408.546 3.043 20 0 HGADMO COC(=O)c1cnc(N2CCC3(C[C@@H]([N@@H+](C)Cc4ccccc4)CO3)CC2)c(F)c1 ZINC001164841269 720683538 /nfs/dbraw/zinc/68/35/38/720683538.db2.gz IRBZBHUEZKWHQJ-LJQANCHMSA-N 1 1 413.493 3.267 20 0 HGADMO COC(=O)c1ccc(N2CCC3(C[C@H]([N@@H+](C)Cc4ccccc4)CO3)CC2)nc1C ZINC001164841216 720685335 /nfs/dbraw/zinc/68/53/35/720685335.db2.gz IIMMNYLNIJXXOY-FQEVSTJZSA-N 1 1 409.530 3.437 20 0 HGADMO FC(F)(c1ccc(Cl)c(Cl)n1)N1CC[N@@H+]2C[C@H](Oc3cncnc3)C[C@@H]2C1 ZINC001164738989 720693042 /nfs/dbraw/zinc/69/30/42/720693042.db2.gz LVMFKITUDQNXFK-VXGBXAGGSA-N 1 1 416.259 3.065 20 0 HGADMO FC(F)(c1ccc(Cl)c(Cl)n1)N1CC[N@H+]2C[C@H](Oc3cncnc3)C[C@@H]2C1 ZINC001164738989 720693044 /nfs/dbraw/zinc/69/30/44/720693044.db2.gz LVMFKITUDQNXFK-VXGBXAGGSA-N 1 1 416.259 3.065 20 0 HGADMO CCNC(=O)c1cccnc1N1CCC2(C[C@@H]([N@@H+](C)Cc3ccccc3)CO2)CC1 ZINC001164839724 720699596 /nfs/dbraw/zinc/69/95/96/720699596.db2.gz BNMQVDNLAAAOHC-HXUWFJFHSA-N 1 1 408.546 3.091 20 0 HGADMO C[N@@H+](Cc1ccccc1)[C@@H]1COC2(C1)CCN(c1ncc3ncnc(Cl)c3n1)CC2 ZINC001164843390 720701051 /nfs/dbraw/zinc/70/10/51/720701051.db2.gz PFJXZZJOKDUNAP-KRWDZBQOSA-N 1 1 424.936 3.333 20 0 HGADMO COc1ccc2c(cc(Cl)nc2N2CC[N@H+]3C[C@@H](Oc4cncnc4)C[C@H]3C2)c1 ZINC001164744846 720730013 /nfs/dbraw/zinc/73/00/13/720730013.db2.gz SVWAWJILTFLRJF-RDJZCZTQSA-N 1 1 411.893 3.029 20 0 HGADMO FC(F)(c1cnc(Cl)c(C2CC2)c1)N1CC[N@@H+]2C[C@H](Oc3cncnc3)C[C@H]2C1 ZINC001164751150 720806407 /nfs/dbraw/zinc/80/64/07/720806407.db2.gz WZNBKRUNMLKMQB-JKSUJKDBSA-N 1 1 421.879 3.289 20 0 HGADMO FC(F)(c1cnc(Cl)c(C2CC2)c1)N1CC[N@H+]2C[C@H](Oc3cncnc3)C[C@H]2C1 ZINC001164751150 720806408 /nfs/dbraw/zinc/80/64/08/720806408.db2.gz WZNBKRUNMLKMQB-JKSUJKDBSA-N 1 1 421.879 3.289 20 0 HGADMO FC(F)(c1ccnc(Cl)c1)N1CC[C@@H]2[C@@H](C[C@@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164748958 720810621 /nfs/dbraw/zinc/81/06/21/720810621.db2.gz SBWRLIJANJRMJQ-RYQLBKOJSA-N 1 1 422.911 3.251 20 0 HGADMO Cc1sc2ncnc(N3CC[C@@H]4[C@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)c2c1C ZINC001164751997 720814895 /nfs/dbraw/zinc/81/48/95/720814895.db2.gz YJAMETKSJGTDHW-GUDVDZBRSA-N 1 1 423.590 3.279 20 0 HGADMO Clc1ccc2ncnc(N3CC[C@@H]4[C@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)c2c1 ZINC001164743856 720816833 /nfs/dbraw/zinc/81/68/33/720816833.db2.gz SWDYZDOPVLPRBB-HGHGUNKESA-N 1 1 423.952 3.254 20 0 HGADMO COc1cccc2ccc(N3CC[C@@H]4[C@@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)nc21 ZINC001164745099 720819010 /nfs/dbraw/zinc/81/90/10/720819010.db2.gz WFDIWMILOGYTAT-PWRODBHTSA-N 1 1 418.545 3.214 20 0 HGADMO Clc1cc(N2CC[C@@H]3[C@H](C[C@H](Cn4cncn4)[N@H+]3CC3CC3)C2)c2c(n1)CCC2 ZINC001164740271 720820328 /nfs/dbraw/zinc/82/03/28/720820328.db2.gz JYMHCCIHLJUOHF-MBOZVWFJSA-N 1 1 412.969 3.195 20 0 HGADMO Clc1ccc(Cl)c(N2CC[C@@H]3[C@H](C[C@H](Cn4cncn4)[N@H+]3CC3CC3)C2)n1 ZINC001164745122 720822914 /nfs/dbraw/zinc/82/29/14/720822914.db2.gz WKSIARVKJTYAQI-BFYDXBDKSA-N 1 1 407.349 3.359 20 0 HGADMO Clc1ccc2ncc(N3CC[C@@H]4[C@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)nc2c1 ZINC001164741404 720825210 /nfs/dbraw/zinc/82/52/10/720825210.db2.gz NTBVMPBLDHSJFO-PLMTUMEDSA-N 1 1 423.952 3.254 20 0 HGADMO Clc1cnc2nc(N3CC[C@@H]4[C@@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)ccc2c1 ZINC001164740312 720825455 /nfs/dbraw/zinc/82/54/55/720825455.db2.gz KDHLVHYENXDDPA-YSIASYRMSA-N 1 1 423.952 3.254 20 0 HGADMO Clc1ccnc2cc(N3CC[C@@H]4[C@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)ncc12 ZINC001164742111 720826330 /nfs/dbraw/zinc/82/63/30/720826330.db2.gz PWMYTJAHZKZCJG-CBGDNZLLSA-N 1 1 423.952 3.254 20 0 HGADMO Fc1ccc2ccnc(N3CC[C@@H]4[C@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)c2c1 ZINC001164737367 720830706 /nfs/dbraw/zinc/83/07/06/720830706.db2.gz AKGXXJMTXDBSJY-KAGYGMCKSA-N 1 1 406.509 3.345 20 0 HGADMO Clc1ccc2c(cnnc2N2CC[C@@H]3[C@@H](C[C@@H](Cn4cncn4)[N@H+]3CC3CC3)C2)c1 ZINC001164741860 720831267 /nfs/dbraw/zinc/83/12/67/720831267.db2.gz OQFGWBITVVCIGH-HFSMHLIXSA-N 1 1 423.952 3.254 20 0 HGADMO Cc1cc(Cl)c(C)c(N2CC[C@@H]3[C@H](C[C@H](Cn4cncn4)[N@H+]3CC3CC3)C2)n1 ZINC001164739375 720833589 /nfs/dbraw/zinc/83/35/89/720833589.db2.gz ACXVYWJEGRGXKU-QWFCFKBJSA-N 1 1 400.958 3.323 20 0 HGADMO COc1cc(N2CC[C@@H]3[C@H](C[C@H](Cn4cncn4)[N@H+]3CC3CC3)C2)nc2ccccc21 ZINC001164744689 720839616 /nfs/dbraw/zinc/83/96/16/720839616.db2.gz LDBRUSWCTTYLFM-WOIUINJBSA-N 1 1 418.545 3.214 20 0 HGADMO COCC[N@H+]1CCO[C@@H]2CN(c3cc4nc(Cl)cnc4cc3Cl)CC[C@H]2C1 ZINC001164856371 720850944 /nfs/dbraw/zinc/85/09/44/720850944.db2.gz VYFVPGJFQAWTID-SCLBCKFNSA-N 1 1 411.333 3.110 20 0 HGADMO Cc1ccc(-c2ccc(N3CC[C@@H]4[C@@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)nn2)o1 ZINC001164749695 720852002 /nfs/dbraw/zinc/85/20/02/720852002.db2.gz OBPMVHRDWPYYQP-IRFCIJBXSA-N 1 1 419.533 3.016 20 0 HGADMO COCC[N@H+]1CCO[C@H]2CN(c3nc4ccccc4c(-c4ccccc4)n3)CC[C@H]2C1 ZINC001164856014 720852681 /nfs/dbraw/zinc/85/26/81/720852681.db2.gz NHJSQBKNPHEUGN-REWPJTCUSA-N 1 1 418.541 3.470 20 0 HGADMO CC(C)c1c(Cl)ncnc1N1CC[C@@H]2[C@H](C[C@@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164751053 720856634 /nfs/dbraw/zinc/85/66/34/720856634.db2.gz PXZWLWUXLMSNCA-FGTMMUONSA-N 1 1 415.973 3.224 20 0 HGADMO COCC[N@H+]1CCO[C@H]2CN(c3cc(F)ccc3-c3ccc(Cl)nn3)CC[C@H]2C1 ZINC001164854932 720881311 /nfs/dbraw/zinc/88/13/11/720881311.db2.gz GGKFDYZIRIBHQZ-YWZLYKJASA-N 1 1 420.916 3.110 20 0 HGADMO CCc1nccnc1N1CC[C@]2(C1)C[N@@H+](CC1CC1)C[C@H]2COCc1cccnc1 ZINC001164752565 720886735 /nfs/dbraw/zinc/88/67/35/720886735.db2.gz FDUQZEHPKDRMQZ-XUZZJYLKSA-N 1 1 407.562 3.189 20 0 HGADMO CCc1nccnc1N1CC[C@@]2(C1)C[N@@H+](CC1CC1)C[C@H]2COCc1cccnc1 ZINC001164752560 720887085 /nfs/dbraw/zinc/88/70/85/720887085.db2.gz FDUQZEHPKDRMQZ-URXFXBBRSA-N 1 1 407.562 3.189 20 0 HGADMO COCC[N@H+]1CCO[C@@H]2CN(c3cc(Cl)nc4c(F)ccc(F)c34)CC[C@H]2C1 ZINC001164853852 720890800 /nfs/dbraw/zinc/89/08/00/720890800.db2.gz DAIVNBDEGDNFPY-SUMWQHHRSA-N 1 1 411.880 3.340 20 0 HGADMO C[N@@H+](Cc1ccc(N2CC[C@@]3(C2)C[C@@H](NC(=O)c2ccccc2)CCO3)nc1)C1CC1 ZINC001164861532 720902413 /nfs/dbraw/zinc/90/24/13/720902413.db2.gz TVXLAKRQJXHTBZ-OFVILXPXSA-N 1 1 420.557 3.234 20 0 HGADMO CCc1cc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COCc2cccnc2)ncn1 ZINC001164750624 720915038 /nfs/dbraw/zinc/91/50/38/720915038.db2.gz JXXIHVKRMXBGEJ-URXFXBBRSA-N 1 1 407.562 3.189 20 0 HGADMO CCOC(=O)c1cnc(C2CC2)nc1N1CCn2c(C[N@@H+](C)C(C)C)cnc2[C@@H]1C ZINC001164863434 720960088 /nfs/dbraw/zinc/96/00/88/720960088.db2.gz ZYOVWPNXRPSIQD-HNNXBMFYSA-N 1 1 412.538 3.149 20 0 HGADMO COc1nc(Cl)ncc1C(F)(F)N1CCn2c(C[N@@H+](C)C(C)C)cnc2[C@@H]1C ZINC001164863574 720992416 /nfs/dbraw/zinc/99/24/16/720992416.db2.gz WQNDPLNAPZVVFO-LBPRGKRZSA-N 1 1 414.888 3.301 20 0 HGADMO FC(F)(c1cc(Cl)ncc1Cl)N1CCc2[nH+]cc(Cn3cccn3)n2CC1 ZINC001164861069 721031567 /nfs/dbraw/zinc/03/15/67/721031567.db2.gz AFRSTBXCNLWKBU-UHFFFAOYSA-N 1 1 413.259 3.437 20 0 HGADMO CCC[N@H+]1CCCC[C@@H]1c1ccc(N2CC[C@H]3[C@@H]2CCN3C(=O)c2cnn(C)c2)nc1 ZINC001164761550 721038994 /nfs/dbraw/zinc/03/89/94/721038994.db2.gz GJZKBBLMMLMUNZ-FSSWDIPSSA-N 1 1 422.577 3.246 20 0 HGADMO FC(F)(Oc1cccnc1Cl)N1CC[N@H+]2C[C@@H](OCc3cccnc3)C[C@H]2C1 ZINC001164867955 721064502 /nfs/dbraw/zinc/06/45/02/721064502.db2.gz LJIGDVYBRKNOMS-HOTGVXAUSA-N 1 1 410.852 3.034 20 0 HGADMO Cc1cccc2c1nc(Cl)nc2N1CC[N@H+]2C[C@H](OCc3cccnc3)C[C@@H]2C1 ZINC001164866575 721072328 /nfs/dbraw/zinc/07/23/28/721072328.db2.gz FRKOQZOTJDTGIV-QZTJIDSGSA-N 1 1 409.921 3.466 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(C(F)(F)c4cc(Cl)nc(Cl)n4)C[C@H]3C2)cn1 ZINC001164773729 721078258 /nfs/dbraw/zinc/07/82/58/721078258.db2.gz YDXFAAFOAZAINO-QWHCGFSZSA-N 1 1 417.291 3.020 20 0 HGADMO CSc1nc2sccc2c(N2C[C@@H]3CC[N@@H+](Cc4cnn(C)c4)C[C@@H]3C2)n1 ZINC001164765638 721083602 /nfs/dbraw/zinc/08/36/02/721083602.db2.gz JFEIPAWHINZPLE-LSDHHAIUSA-N 1 1 400.577 3.105 20 0 HGADMO Cc1nc2cc(Cl)ccc2c(N2CC[N@H+]3C[C@@H](OCc4cccnc4)C[C@@H]3C2)n1 ZINC001164867191 721092227 /nfs/dbraw/zinc/09/22/27/721092227.db2.gz WUGVUBJXWBGGFI-MOPGFXCFSA-N 1 1 409.921 3.466 20 0 HGADMO CSc1nc2ccccc2c(N2CC[N@H+]3C[C@@H](OCc4cccnc4)C[C@@H]3C2)n1 ZINC001164867330 721097580 /nfs/dbraw/zinc/09/75/80/721097580.db2.gz XXWBRTXRZYZZIP-MSOLQXFVSA-N 1 1 407.543 3.226 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4nccnc4C4SCCCS4)C[C@H]3C2)cn1 ZINC001164770580 721105241 /nfs/dbraw/zinc/10/52/41/721105241.db2.gz RAJIKPMEZLJXLP-DLBZAZTESA-N 1 1 416.620 3.037 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4cc(Cl)nc(Cc5ccccc5)n4)C[C@H]3C2)cn1 ZINC001164763354 721111635 /nfs/dbraw/zinc/11/16/35/721111635.db2.gz FGOTXAKTBRUPAS-WOJBJXKFSA-N 1 1 422.964 3.413 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4cc(Cl)nc(Cc5ccccc5)n4)C[C@@H]3C2)cn1 ZINC001164763351 721112137 /nfs/dbraw/zinc/11/21/37/721112137.db2.gz FGOTXAKTBRUPAS-PMACEKPBSA-N 1 1 422.964 3.413 20 0 HGADMO CCc1cc2c(nc(Cl)nc2N2CC[N@H+]3C[C@H](OCc4cccnc4)C[C@H]3C2)[nH]1 ZINC001164879090 721130890 /nfs/dbraw/zinc/13/08/90/721130890.db2.gz RTDVVZMHQUHGQY-DLBZAZTESA-N 1 1 412.925 3.048 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4cccc(-c5cccc(Cl)n5)n4)C[C@H]3C2)cn1 ZINC001164770591 721136490 /nfs/dbraw/zinc/13/64/90/721136490.db2.gz RBYZKEKVQINFTO-ZWKOTPCHSA-N 1 1 408.937 3.489 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4nc(Cl)ccc4CN4CCCC4)C[C@@H]3C2)cn1 ZINC001164774144 721148917 /nfs/dbraw/zinc/14/89/17/721148917.db2.gz ZVHCAJQUQYXCQS-QUCCMNQESA-N 1 1 414.985 3.023 20 0 HGADMO Cc1nc(-c2ccccn2)nc(N2CC[N@H+]3C[C@@H](OCc4cccnc4)C[C@@H]3C2)c1C ZINC001164880346 721167687 /nfs/dbraw/zinc/16/76/87/721167687.db2.gz WAANWLNKPDVCSZ-RTWAWAEBSA-N 1 1 416.529 3.030 20 0 HGADMO COc1cc2nc(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@@H]4C3)ccc2c(OC)c1 ZINC001164872700 721180637 /nfs/dbraw/zinc/18/06/37/721180637.db2.gz IEIORFVVCCCCLH-QUCCMNQESA-N 1 1 420.513 3.127 20 0 HGADMO CSc1ccc2ncnc(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@H]4C3)c2c1 ZINC001164878643 721181256 /nfs/dbraw/zinc/18/12/56/721181256.db2.gz QTWPWRHSLOSFGB-ZWKOTPCHSA-N 1 1 407.543 3.226 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4cc(F)cc5ncnc(Cl)c54)C[C@@H]3C2)cn1 ZINC001164772346 721181868 /nfs/dbraw/zinc/18/18/68/721181868.db2.gz SQBGDNAVBMXQDL-CABCVRRESA-N 1 1 400.889 3.114 20 0 HGADMO Fc1ccc(-c2cncc(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@H]4C3)n2)cc1 ZINC001164870993 721181911 /nfs/dbraw/zinc/18/19/11/721181911.db2.gz CUDORWMUDRJPMW-SFTDATJTSA-N 1 1 405.477 3.157 20 0 HGADMO Cc1cnc(N2CC[N@H+]3C[C@H](OCc4cccnc4)C[C@H]3C2)nc1-c1ccccc1F ZINC001164875431 721184283 /nfs/dbraw/zinc/18/42/83/721184283.db2.gz LPLVJUBERYDGGC-VQTJNVASSA-N 1 1 419.504 3.466 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4ccc(-c5c(F)cccc5F)nn4)C[C@@H]3C2)cn1 ZINC001164771885 721215074 /nfs/dbraw/zinc/21/50/74/721215074.db2.gz RRZFJMUFEABVPG-SJORKVTESA-N 1 1 410.472 3.114 20 0 HGADMO CCc1ccc(-c2ccc(N3C[C@@H]4CC[N@@H+](Cc5cnn(C)c5)C[C@H]4C3)nn2)cc1 ZINC001164769550 721215484 /nfs/dbraw/zinc/21/54/84/721215484.db2.gz MSZMVIRSZKXETF-VXKWHMMOSA-N 1 1 402.546 3.398 20 0 HGADMO Cc1cc(N2C[C@@H]3CC[N@H+](Cc4cnn(C)c4)C[C@@H]3C2)nc(-c2ccc(Cl)nc2)n1 ZINC001164763912 721230437 /nfs/dbraw/zinc/23/04/37/721230437.db2.gz OBBANONZPVRUPC-RBUKOAKNSA-N 1 1 423.952 3.192 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4nc(C(F)F)nc5ccc(F)cc54)C[C@H]3C2)cn1 ZINC001164766747 721231766 /nfs/dbraw/zinc/23/17/66/721231766.db2.gz VIGIBSHMTZSSDW-HUUCEWRRSA-N 1 1 416.451 3.398 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4c(Cl)nc(Cl)nc4C4CC4)C[C@@H]3C2)cn1 ZINC001164768858 721242034 /nfs/dbraw/zinc/24/20/34/721242034.db2.gz YHVRCTRWGOIEQS-CABCVRRESA-N 1 1 407.349 3.353 20 0 HGADMO CN(C)C1=[NH+]OC2(C1)CCN(C(F)(F)Cc1nc3c(ncnc3Cl)s1)CC2 ZINC001164876292 721327980 /nfs/dbraw/zinc/32/79/80/721327980.db2.gz NSDIDPFYRZRNFA-UHFFFAOYSA-N 1 1 416.885 3.005 20 0 HGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@@]2(CCCN(c3cc(CC(C)C)ncn3)C2)C1 ZINC001164781374 721368219 /nfs/dbraw/zinc/36/82/19/721368219.db2.gz IUQIYOKFVLWGPX-QHCPKHFHSA-N 1 1 413.566 3.399 20 0 HGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@@]2(CCCN(c3cc(CC(C)C)ncn3)C2)C1 ZINC001164781374 721368222 /nfs/dbraw/zinc/36/82/22/721368222.db2.gz IUQIYOKFVLWGPX-QHCPKHFHSA-N 1 1 413.566 3.399 20 0 HGADMO C[NH+]1CCN(C[C@H]2CCC[C@]3(CCN(c4cc(Oc5ccccc5)ncn4)C3)O2)CC1 ZINC001164886708 721392881 /nfs/dbraw/zinc/39/28/81/721392881.db2.gz FOFLYFVHZQVWKL-ZJSXRUAMSA-N 1 1 423.561 3.034 20 0 HGADMO O=C(NCc1ccccc1)c1cccnc1N1C[C@@H]2C[NH+](Cc3nccs3)C[C@H]2C1 ZINC001164783425 721394010 /nfs/dbraw/zinc/39/40/10/721394010.db2.gz HZWCTFPOHGWABN-OALUTQOASA-N 1 1 419.554 3.036 20 0 HGADMO C[NH+]1CCN(C[C@H]2CCC[C@@]3(CCN(c4csc5ncnc(Cl)c45)C3)O2)CC1 ZINC001164892420 721402443 /nfs/dbraw/zinc/40/24/43/721402443.db2.gz YCEWSKSKECCIFH-QRWLVFNGSA-N 1 1 421.998 3.110 20 0 HGADMO CCc1cc2c(ncnc2N2CC[C@]3(C2)CCC[C@@H](CN2CC[NH+](C)CC2)O3)s1 ZINC001164883918 721409689 /nfs/dbraw/zinc/40/96/89/721409689.db2.gz CRDOKZNDEQMVCY-JTSKRJEESA-N 1 1 415.607 3.019 20 0 HGADMO CCc1cc2c(ncnc2N2CC[C@]3(C2)CCC[C@H](CN2CC[NH+](C)CC2)O3)s1 ZINC001164883923 721409816 /nfs/dbraw/zinc/40/98/16/721409816.db2.gz CRDOKZNDEQMVCY-VGSWGCGISA-N 1 1 415.607 3.019 20 0 HGADMO COc1ccc2nc(N3CC[C@]4(C3)CCC[C@H](CN3CC[NH+](C)CC3)O4)cc(C)c2c1 ZINC001164893013 721411893 /nfs/dbraw/zinc/41/18/93/721411893.db2.gz ZVXZWKVQNNHBNI-BWKNWUBXSA-N 1 1 424.589 3.317 20 0 HGADMO FC(F)(Cc1nc(Cl)cc(Cl)n1)N1C[C@@H]2C[N@@H+](Cc3nccs3)C[C@@H]2C1 ZINC001164787329 721422392 /nfs/dbraw/zinc/42/23/92/721422392.db2.gz QFKCNYIQNPPSCQ-PHIMTYICSA-N 1 1 420.316 3.439 20 0 HGADMO FC(F)(Cc1nc(Cl)cc(Cl)n1)N1C[C@@H]2C[N@H+](Cc3nccs3)C[C@@H]2C1 ZINC001164787329 721422394 /nfs/dbraw/zinc/42/23/94/721422394.db2.gz QFKCNYIQNPPSCQ-PHIMTYICSA-N 1 1 420.316 3.439 20 0 HGADMO CC(C)(C)OC(=O)Nc1ccc(N2C[C@@H]3C[NH+](Cc4nccs4)C[C@H]3C2)nc1 ZINC001164788064 721423360 /nfs/dbraw/zinc/42/33/60/721423360.db2.gz RXAKGPAOVWBECE-GJZGRUSLSA-N 1 1 401.536 3.453 20 0 HGADMO c1csc(C[NH+]2C[C@@H]3CN(c4nc(-c5ccncc5)nc5c4CCC5)C[C@H]3C2)n1 ZINC001164783655 721432670 /nfs/dbraw/zinc/43/26/70/721432670.db2.gz JDNFRQIFVALWNW-IAGOWNOFSA-N 1 1 404.543 3.052 20 0 HGADMO CCc1nc2sccc2c(N2CC[C@@]3(C2)CCC[C@H](CN2CC[NH+](C)CC2)O3)n1 ZINC001164893043 721443420 /nfs/dbraw/zinc/44/34/20/721443420.db2.gz IUOKZBUWNVXQEK-VGOFRKELSA-N 1 1 415.607 3.019 20 0 HGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1ncnc3ccccc31)CC2 ZINC001164788678 721451486 /nfs/dbraw/zinc/45/14/86/721451486.db2.gz SMIIJBMUTNVQSH-HXUWFJFHSA-N 1 1 410.562 3.364 20 0 HGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1nccc3scnc31)CC2 ZINC001164785506 721460819 /nfs/dbraw/zinc/46/08/19/721460819.db2.gz LTJBKEMTMVBDIG-SFHVURJKSA-N 1 1 416.591 3.425 20 0 HGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1nc(C)c(Cl)c(C)n1)CC2 ZINC001164785765 721461770 /nfs/dbraw/zinc/46/17/70/721461770.db2.gz NILLBJINUOWTIM-IBGZPJMESA-N 1 1 423.001 3.481 20 0 HGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1nc(C)nc(C)c1C)CC2 ZINC001164790129 721469176 /nfs/dbraw/zinc/46/91/76/721469176.db2.gz RHCOVAJLESXXKP-OAQYLSRUSA-N 1 1 402.583 3.136 20 0 HGADMO CCS(=O)(=O)c1ccnc(N2CCC3(CC([N@@H+](C)Cc4ccncc4)C3)CC2)c1 ZINC001164796194 721504492 /nfs/dbraw/zinc/50/44/92/721504492.db2.gz PQGNKAGANOFZHY-UHFFFAOYSA-N 1 1 414.575 3.151 20 0 HGADMO CCOC(=O)c1cc(Cl)nc(N2CC[N@H+]3C[C@@H](Oc4cccc(F)c4)C[C@@H]3C2)c1 ZINC001164901053 721508711 /nfs/dbraw/zinc/50/87/11/721508711.db2.gz WFPFUHCKFXFWDS-AEFFLSMTSA-N 1 1 419.884 3.393 20 0 HGADMO CSc1nc(Cl)cc(N2C[C@H]([N@H+](C)Cc3cccnc3)[C@H]3OCCC[C@H]32)n1 ZINC001164794430 721526401 /nfs/dbraw/zinc/52/64/01/721526401.db2.gz DBHOMIIKXVIRFJ-VKJFTORMSA-N 1 1 405.955 3.115 20 0 HGADMO CSc1nc(Cl)cc(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@H]3OCCC[C@H]32)n1 ZINC001164794430 721526406 /nfs/dbraw/zinc/52/64/06/721526406.db2.gz DBHOMIIKXVIRFJ-VKJFTORMSA-N 1 1 405.955 3.115 20 0 HGADMO CC(C)(C)NC(=O)c1ccc(N2CC[N@H+]3C[C@H](Oc4cccc(F)c4)C[C@@H]3C2)nc1 ZINC001164904724 721535269 /nfs/dbraw/zinc/53/52/69/721535269.db2.gz GBYGUXCSQMWERI-UYAOXDASSA-N 1 1 412.509 3.091 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2ccnc(-c3ccccc3)n2)[C@@H]2CCCO[C@@H]12 ZINC001164801540 721535891 /nfs/dbraw/zinc/53/58/91/721535891.db2.gz FPTBAGPDPNKXOY-MQSCRBSSSA-N 1 1 401.514 3.407 20 0 HGADMO Nc1cc(Cl)ncc1C(F)(F)N1CC[N@H+]2C[C@H](Oc3cccc(F)c3)C[C@@H]2C1 ZINC001164907716 721536585 /nfs/dbraw/zinc/53/65/85/721536585.db2.gz OCKVSSSIUJDIAW-UKRRQHHQSA-N 1 1 412.843 3.343 20 0 HGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(C(F)(F)Oc2cccnc2Cl)[C@@H]2CCCO[C@H]12 ZINC001164801352 721540375 /nfs/dbraw/zinc/54/03/75/721540375.db2.gz DZDUYKMNXFPENZ-NUJGCVRESA-N 1 1 424.879 3.423 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(C(F)(F)Oc2cccnc2Cl)[C@@H]2CCCO[C@H]12 ZINC001164801352 721540376 /nfs/dbraw/zinc/54/03/76/721540376.db2.gz DZDUYKMNXFPENZ-NUJGCVRESA-N 1 1 424.879 3.423 20 0 HGADMO Cc1cc(C(F)(F)N2C[C@H]([N@H+](C)Cc3cccnc3)[C@H]3OCCC[C@H]32)nc(Cl)n1 ZINC001164799163 721545425 /nfs/dbraw/zinc/54/54/25/721545425.db2.gz BAIQMMTYKKIPHV-RYRKJORJSA-N 1 1 423.895 3.247 20 0 HGADMO Cc1cc(C(F)(F)N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@H]3OCCC[C@H]32)nc(Cl)n1 ZINC001164799163 721545429 /nfs/dbraw/zinc/54/54/29/721545429.db2.gz BAIQMMTYKKIPHV-RYRKJORJSA-N 1 1 423.895 3.247 20 0 HGADMO CCOC(=O)c1cnc2cc(N3CC[N@H+]4C[C@@H](Oc5cccc(F)c5)C[C@H]4C3)[nH]cc1-2 ZINC001164908719 721550685 /nfs/dbraw/zinc/55/06/85/721550685.db2.gz QGZZADVWTBGHRX-WMZOPIPTSA-N 1 1 424.476 3.221 20 0 HGADMO CSc1nc(Cl)ncc1N1C[C@H]([N@@H+](C)Cc2cccnc2)[C@@H]2OCCC[C@H]21 ZINC001164807351 721554471 /nfs/dbraw/zinc/55/44/71/721554471.db2.gz STJMXGPOSOEYGH-HYVNUMGLSA-N 1 1 405.955 3.115 20 0 HGADMO CSc1nc(Cl)ncc1N1C[C@H]([N@H+](C)Cc2cccnc2)[C@@H]2OCCC[C@H]21 ZINC001164807351 721554466 /nfs/dbraw/zinc/55/44/66/721554466.db2.gz STJMXGPOSOEYGH-HYVNUMGLSA-N 1 1 405.955 3.115 20 0 HGADMO Cc1nc(-c2ccncc2)cc(N2CC[N@H+]3C[C@@H](Oc4cccc(F)c4)C[C@H]3C2)n1 ZINC001164909710 721558557 /nfs/dbraw/zinc/55/85/57/721558557.db2.gz UPMBTXSAPYDAQD-FPOVZHCZSA-N 1 1 405.477 3.328 20 0 HGADMO C[C@@H]1CCCN(c2cc(N3CC[N@H+]4C[C@H](Oc5cccc(F)c5)C[C@H]4C3)ncn2)C1 ZINC001164910841 721560310 /nfs/dbraw/zinc/56/03/10/721560310.db2.gz XLHRHYQOFLERPI-SLYNCCJLSA-N 1 1 411.525 3.194 20 0 HGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(C(F)(F)c2cc(N)cc(Cl)n2)[C@H]2CCCO[C@H]12 ZINC001164800320 721561651 /nfs/dbraw/zinc/56/16/51/721561651.db2.gz DUTDRUMLUHUJHL-FCEWJHQRSA-N 1 1 423.895 3.125 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(C(F)(F)c2cc(N)cc(Cl)n2)[C@H]2CCCO[C@H]12 ZINC001164800320 721561656 /nfs/dbraw/zinc/56/16/56/721561656.db2.gz DUTDRUMLUHUJHL-FCEWJHQRSA-N 1 1 423.895 3.125 20 0 HGADMO COc1cc(OC)c2ncnc(N3CC[N@H+]4C[C@H](Oc5cccc(F)c5)C[C@@H]4C3)c2c1 ZINC001164905456 721566123 /nfs/dbraw/zinc/56/61/23/721566123.db2.gz HNCOROBYWJLBAJ-VQIMIIECSA-N 1 1 424.476 3.128 20 0 HGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2cc(-c3cccs3)ncn2)[C@H]2CCCO[C@H]12 ZINC001164799243 721581619 /nfs/dbraw/zinc/58/16/19/721581619.db2.gz ABGJMNGRQVOBHA-JQVVWYNYSA-N 1 1 407.543 3.468 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2cc(-c3cccs3)ncn2)[C@H]2CCCO[C@H]12 ZINC001164799243 721581623 /nfs/dbraw/zinc/58/16/23/721581623.db2.gz ABGJMNGRQVOBHA-JQVVWYNYSA-N 1 1 407.543 3.468 20 0 HGADMO Cc1nc(-c2ccncc2)cc(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@H]3OCCC[C@H]32)n1 ZINC001164810212 721583275 /nfs/dbraw/zinc/58/32/75/721583275.db2.gz VDTUXYSMILZREX-GPXNEJASSA-N 1 1 416.529 3.110 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2nc(C3CC3)nc3[nH]ccc32)[C@@H]2CCCO[C@@H]12 ZINC001164805655 721588598 /nfs/dbraw/zinc/58/85/98/721588598.db2.gz LKDPEGSNEXMNGU-VAMGGRTRSA-N 1 1 404.518 3.099 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2nc(C3CCC3)nc3[nH]ccc32)[C@@H]2CCCO[C@H]12 ZINC001164802535 721591870 /nfs/dbraw/zinc/59/18/70/721591870.db2.gz GGVYOQJWIPSKAY-NJYVYQBISA-N 1 1 418.545 3.489 20 0 HGADMO Fc1cc2c(cn1)ncnc2N1CCC(F)(F)[C@]2(CC[N@@H+](Cc3ccccn3)C2)C1 ZINC001164907037 721695836 /nfs/dbraw/zinc/69/58/36/721695836.db2.gz QLMXQFNGWOLPLU-FQEVSTJZSA-N 1 1 414.435 3.297 20 0 HGADMO COc1ncc(Cl)c(N2CCC(F)(F)[C@@]3(CC[N@@H+](Cc4ccccn4)C3)C2)n1 ZINC001164909798 721733634 /nfs/dbraw/zinc/73/36/34/721733634.db2.gz DSIFAYPXBCWWLI-GOSISDBHSA-N 1 1 409.868 3.271 20 0 HGADMO CCOC(=O)c1cc(C)nc(N2CCc3c(C[N@H+](C)Cc4ccco4)cncc3C2)n1 ZINC001164910058 721749570 /nfs/dbraw/zinc/74/95/70/721749570.db2.gz ZWYBBPZEEDQAQW-UHFFFAOYSA-N 1 1 421.501 3.144 20 0 HGADMO CCOC(=O)c1cc(C)nc(N2CCc3c(C[N@@H+](C)Cc4ccco4)cncc3C2)n1 ZINC001164910058 721749579 /nfs/dbraw/zinc/74/95/79/721749579.db2.gz ZWYBBPZEEDQAQW-UHFFFAOYSA-N 1 1 421.501 3.144 20 0 HGADMO Cc1cc(Cl)nc(N2C[C@@H]3CCC[C@H]([N@@H+](C)Cc4ccccn4)[C@H]3C2)c1C(N)=O ZINC001165024701 721801760 /nfs/dbraw/zinc/80/17/60/721801760.db2.gz MRIGYDCUUOKQAZ-SZMVWBNQSA-N 1 1 413.953 3.274 20 0 HGADMO CCOC(=O)c1cnc(C)nc1N1C[C@@H]2CCC[C@H]([N@@H+](C)Cc3ccccn3)[C@@H]2C1 ZINC001165025091 721807443 /nfs/dbraw/zinc/80/74/43/721807443.db2.gz NNIAAZKOOBOTMR-WMQCIHAUSA-N 1 1 409.534 3.094 20 0 HGADMO C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@@H]2CN(c3[nH]c4cc(=O)[nH]c-4cc3Cl)C[C@H]21 ZINC001165022717 721813906 /nfs/dbraw/zinc/81/39/06/721813906.db2.gz GWBKJKNKYLBXIH-AKCHCHLHSA-N 1 1 411.937 3.362 20 0 HGADMO C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@@H]2CN(c3ncc4ncnc(Cl)c4n3)C[C@@H]21 ZINC001165025511 721818345 /nfs/dbraw/zinc/81/83/45/721818345.db2.gz NCKBCHPIQQJJFL-UWWQBHOKSA-N 1 1 409.925 3.205 20 0 HGADMO C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@H]2CN(c3cc(C(=O)N4CCCC4)ccn3)C[C@@H]21 ZINC001165026126 721819020 /nfs/dbraw/zinc/81/90/20/721819020.db2.gz PHSGHJNCGZXCHK-ACIOBRDBSA-N 1 1 419.573 3.450 20 0 HGADMO COC(=O)c1cc2c[nH]c(N3C[C@@H]4CCC[C@H]([N@@H+](C)Cc5ccccn5)[C@H]4C3)cc-2n1 ZINC001165025521 721820424 /nfs/dbraw/zinc/82/04/24/721820424.db2.gz NEBBWKQOTVVWCK-BPXKWBHBSA-N 1 1 419.529 3.481 20 0 HGADMO C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@@H]2CN(c3nc(C(N)=O)cc4ccccc43)C[C@@H]21 ZINC001165030550 721826267 /nfs/dbraw/zinc/82/62/67/721826267.db2.gz ZSKMLURMGQOBJV-RZFNWQHOSA-N 1 1 415.541 3.466 20 0 HGADMO COc1nc(N2C[C@@H]3CCC[C@@H]([N@@H+](C)Cc4ccccn4)[C@@H]3C2)nc2c1ccn2C ZINC001165027005 721830653 /nfs/dbraw/zinc/83/06/53/721830653.db2.gz QSMONAAGPFMQMG-PWIZWCRZSA-N 1 1 406.534 3.109 20 0 HGADMO COc1cnnc(Cl)c1N1CCC2(CC1)C[N@@H+](Cc1ccc(C)cc1)CCO2 ZINC001164939330 721926190 /nfs/dbraw/zinc/92/61/90/721926190.db2.gz IVOUBPGCLBCIMX-UHFFFAOYSA-N 1 1 402.926 3.318 20 0 HGADMO CCNC(=O)c1cccnc1N1CCC2(CC1)C[N@@H+](Cc1ccc(C)cc1)CCO2 ZINC001164939677 721928438 /nfs/dbraw/zinc/92/84/38/721928438.db2.gz ODBKDMLULYPRNL-UHFFFAOYSA-N 1 1 408.546 3.011 20 0 HGADMO CCOC(=O)c1c(Cl)cc(C)nc1N1CC[NH+](CCOc2ccccc2)CC1 ZINC001165042492 721952520 /nfs/dbraw/zinc/95/25/20/721952520.db2.gz NGCGCPMXPCSVFD-UHFFFAOYSA-N 1 1 403.910 3.421 20 0 HGADMO COc1cccc2ccc(N3CCC4(CC3)C(=O)NCC[N@H+]4Cc3ccccc3)nc21 ZINC001164946775 721971387 /nfs/dbraw/zinc/97/13/87/721971387.db2.gz WAJMTTQOXTVBJT-UHFFFAOYSA-N 1 1 416.525 3.214 20 0 HGADMO COc1cccc2ccc(N3CCC4(CC3)C(=O)NCC[N@@H+]4Cc3ccccc3)nc21 ZINC001164946775 721971390 /nfs/dbraw/zinc/97/13/90/721971390.db2.gz WAJMTTQOXTVBJT-UHFFFAOYSA-N 1 1 416.525 3.214 20 0 HGADMO CC(C)COc1cccc(N2CCC3(CC2)C(=O)NCC[N@H+]3Cc2ccccc2)n1 ZINC001164946703 721977009 /nfs/dbraw/zinc/97/70/09/721977009.db2.gz KGXSACPGPMOTIE-UHFFFAOYSA-N 1 1 408.546 3.087 20 0 HGADMO CC(C)COc1cccc(N2CCC3(CC2)C(=O)NCC[N@@H+]3Cc2ccccc2)n1 ZINC001164946703 721977011 /nfs/dbraw/zinc/97/70/11/721977011.db2.gz KGXSACPGPMOTIE-UHFFFAOYSA-N 1 1 408.546 3.087 20 0 HGADMO COC(=O)c1cc(Cl)cc(N2CCC3(CC[N@@H+](Cc4cccnc4)C3)CC2)n1 ZINC001164953656 722014803 /nfs/dbraw/zinc/01/48/03/722014803.db2.gz WPDDCDHJWKCQRR-UHFFFAOYSA-N 1 1 400.910 3.409 20 0 HGADMO COC(=O)c1c[nH]c2nc(N3CCC4(CC[N@@H+](Cc5cccnc5)C4)CC3)ccc12 ZINC001164953584 722016084 /nfs/dbraw/zinc/01/60/84/722016084.db2.gz VGIHRJOLVUSCOS-UHFFFAOYSA-N 1 1 405.502 3.237 20 0 HGADMO Clc1nc2cccnc2c(N2CCC3(CC2)COCC[N@@H+](Cc2ccncc2)C3)n1 ZINC001164959551 722053995 /nfs/dbraw/zinc/05/39/95/722053995.db2.gz MVHWVNAXJPARCZ-UHFFFAOYSA-N 1 1 424.936 3.192 20 0 HGADMO CC1(C)OC(=O)c2c1ccnc2N1CCC2(CC1)COCC[N@@H+](Cc1ccncc1)C2 ZINC001164963182 722055147 /nfs/dbraw/zinc/05/51/47/722055147.db2.gz HYLOVXIVZRBOEO-UHFFFAOYSA-N 1 1 422.529 3.001 20 0 HGADMO COc1cnc(N2CCC3(CC2)COCC[N@@H+](Cc2ccncc2)C3)c(Cl)c1 ZINC001164960699 722057561 /nfs/dbraw/zinc/05/75/61/722057561.db2.gz IBGXTCJREITRSR-UHFFFAOYSA-N 1 1 402.926 3.258 20 0 HGADMO CCCSc1cncc(N2CCC3(CC2)COCC[N@@H+](Cc2ccncc2)C3)n1 ZINC001164961754 722060460 /nfs/dbraw/zinc/06/04/60/722060460.db2.gz OYDSULFKLYKATC-UHFFFAOYSA-N 1 1 413.591 3.493 20 0 HGADMO O=C(c1ccccc1)n1ccc2ccc(N3C[C@@H]4C[N@H+](CC5CC5)C[C@H](C3)O4)nc21 ZINC001164967850 722074752 /nfs/dbraw/zinc/07/47/52/722074752.db2.gz ZTELKOGYWYQMAT-OYRHEFFESA-N 1 1 402.498 3.024 20 0 HGADMO CC(=O)N1[C@H](Cn2cccn2)C[C@H]2C[N@H+](C(C)(C)c3ccnc(Cl)c3)CC[C@@H]21 ZINC001164970769 722081356 /nfs/dbraw/zinc/08/13/56/722081356.db2.gz RLUQSBMMLFKMLP-WDSOQIARSA-N 1 1 401.942 3.178 20 0 HGADMO Cc1sc2ncnc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)c2c1C ZINC001164984130 722103661 /nfs/dbraw/zinc/10/36/61/722103661.db2.gz RSZQQNAZBIAHGO-OALUTQOASA-N 1 1 409.559 3.430 20 0 HGADMO Clc1ccnc2c1ccnc2N1CC[C@@H]2C[N@@H+](Cc3cccnc3)CCO[C@@H]2C1 ZINC001164975481 722104898 /nfs/dbraw/zinc/10/48/98/722104898.db2.gz BZHNETSATLJWKM-YLJYHZDGSA-N 1 1 409.921 3.406 20 0 HGADMO c1ccc(Oc2cc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)ncn2)cc1 ZINC001164979352 722105787 /nfs/dbraw/zinc/10/57/87/722105787.db2.gz ICNDKDLLEBSEER-RBBKRZOGSA-N 1 1 417.513 3.391 20 0 HGADMO FC(F)(Oc1ccc(Cl)nc1)N1CC[C@H]2C[N@@H+](Cc3cccnc3)CCO[C@@H]2C1 ZINC001164978304 722108607 /nfs/dbraw/zinc/10/86/07/722108607.db2.gz OKKUUVULGLIBMY-FUHWJXTLSA-N 1 1 424.879 3.282 20 0 HGADMO Clc1ncnc2scc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)c21 ZINC001164974086 722110636 /nfs/dbraw/zinc/11/06/36/722110636.db2.gz ILJLCQFZKBKCNA-DOTOQJQBSA-N 1 1 415.950 3.467 20 0 HGADMO Clc1cnc2nc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)ccc2c1 ZINC001164975631 722113116 /nfs/dbraw/zinc/11/31/16/722113116.db2.gz KDMRWLVWCUJOCF-AZUAARDMSA-N 1 1 409.921 3.406 20 0 HGADMO CC(C)(C)OC(=O)c1ccc(N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)nc1 ZINC001164980509 722117294 /nfs/dbraw/zinc/11/72/94/722117294.db2.gz RNENCRWYTDYVPZ-NHCUHLMSSA-N 1 1 424.545 3.159 20 0 HGADMO Clc1ccnc2cnc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)cc12 ZINC001164978376 722127585 /nfs/dbraw/zinc/12/75/85/722127585.db2.gz OMNLZPWNSWMVHC-UWJYYQICSA-N 1 1 409.921 3.406 20 0 HGADMO Clc1ccnc2ccc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)nc12 ZINC001164978083 722135451 /nfs/dbraw/zinc/13/54/51/722135451.db2.gz JQUUOAADWVJPOI-PXNSSMCTSA-N 1 1 409.921 3.406 20 0 HGADMO CC(C)(C)c1nc2[nH]ccc2c(N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)n1 ZINC001164975201 722135554 /nfs/dbraw/zinc/13/55/54/722135554.db2.gz FQVPZPGWTKNJKV-UYAOXDASSA-N 1 1 420.561 3.378 20 0 HGADMO Fc1ccccc1-c1ccc(N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)nn1 ZINC001164977041 722147807 /nfs/dbraw/zinc/14/78/07/722147807.db2.gz IAVBYYPFEVVSOE-WMZHIEFXSA-N 1 1 419.504 3.405 20 0 HGADMO Fc1cccc(-c2ccc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)nn2)c1 ZINC001164985006 722148038 /nfs/dbraw/zinc/14/80/38/722148038.db2.gz YTHHGKZPGLHLBO-REWPJTCUSA-N 1 1 419.504 3.405 20 0 HGADMO CCc1nc(N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)c(Cl)nc1C ZINC001164977117 722156740 /nfs/dbraw/zinc/15/67/40/722156740.db2.gz XDOOGRVXRNEYKK-MJGOQNOKSA-N 1 1 401.942 3.123 20 0 HGADMO COc1cc(C)c2ncnc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)c2c1 ZINC001164977125 722159220 /nfs/dbraw/zinc/15/92/20/722159220.db2.gz XGNKTHHMCOIOAQ-KNQAVFIVSA-N 1 1 419.529 3.069 20 0 HGADMO NC(=O)c1nc(Cl)nc(Cl)c1N1CCC[C@@]2(CC[N@@H+]2Cc2cccc(F)c2)C1 ZINC001164996218 722201900 /nfs/dbraw/zinc/20/19/00/722201900.db2.gz RQVHFCRJRJKLLB-LJQANCHMSA-N 1 1 424.307 3.266 20 0 HGADMO NC(=O)c1nc(Cl)nc(Cl)c1N1CCC[C@@]2(CC[N@H+]2Cc2cccc(F)c2)C1 ZINC001164996218 722201901 /nfs/dbraw/zinc/20/19/01/722201901.db2.gz RQVHFCRJRJKLLB-LJQANCHMSA-N 1 1 424.307 3.266 20 0 HGADMO COC(=O)c1nc2cnccc2c(N2CCC[C@]3(CC[N@H+]3Cc3cccc(F)c3)C2)n1 ZINC001164996695 722202608 /nfs/dbraw/zinc/20/26/08/722202608.db2.gz VNMWPYLZJHNOMO-QHCPKHFHSA-N 1 1 421.476 3.195 20 0 HGADMO CC(C)c1cc(N2CCc3ncnc(N4CC[NH+](C)CC4)c3CC2)nc(C(C)(C)C)n1 ZINC001165002562 722238785 /nfs/dbraw/zinc/23/87/85/722238785.db2.gz VOGDPKCPDWWXPA-UHFFFAOYSA-N 1 1 423.609 3.045 20 0 HGADMO Cc1cccc2cc(Cl)nc(N3CCc4ncnc(N5CC[NH+](C)CC5)c4CC3)c12 ZINC001165002621 722239818 /nfs/dbraw/zinc/23/98/18/722239818.db2.gz WGEPYHOQKNJDAU-UHFFFAOYSA-N 1 1 422.964 3.344 20 0 HGADMO OCC1([NH2+]Cc2nnc(-c3ccccc3Br)o2)Cc2ccccc2C1 ZINC000512329529 1126095630 /nfs/dbraw/zinc/09/56/30/1126095630.db2.gz QOFKVRMYHFVDKB-UHFFFAOYSA-N 1 1 400.276 3.119 20 0 HGADMO COc1ccccc1C[C@@](C)(CO)[NH2+]Cc1nc(COc2cc(C)cc(C)c2)no1 ZINC001197303816 1126154340 /nfs/dbraw/zinc/15/43/40/1126154340.db2.gz HBLWBHICDZXLNX-QHCPKHFHSA-N 1 1 411.502 3.357 20 0 HGADMO COc1ccccc1C[C@](C)(CO)[NH2+]Cc1nc(COc2cc(C)cc(C)c2)no1 ZINC001197303814 1126154397 /nfs/dbraw/zinc/15/43/97/1126154397.db2.gz HBLWBHICDZXLNX-HSZRJFAPSA-N 1 1 411.502 3.357 20 0 HGADMO COc1ccc(C[C@](C)(CO)[NH2+]Cc2noc(-c3ccc(F)cc3F)n2)cc1OC ZINC001198229811 1126155594 /nfs/dbraw/zinc/15/55/94/1126155594.db2.gz MQGNMFPWLNMMNE-OAQYLSRUSA-N 1 1 419.428 3.115 20 0 HGADMO C[C@](CO)(Cc1ccccc1F)[NH2+]Cc1cn(-c2ccccc2Br)nn1 ZINC001461673170 1126196053 /nfs/dbraw/zinc/19/60/53/1126196053.db2.gz RKQFLEZRDXYNKU-LJQANCHMSA-N 1 1 419.298 3.252 20 0 HGADMO COc1ccc(C[C@](C)(CO)[NH2+]Cc2nc(-c3ccc(F)c(F)c3)no2)cc1OC ZINC001473840517 1126201171 /nfs/dbraw/zinc/20/11/71/1126201171.db2.gz ZNCGXTKFGGSMOU-OAQYLSRUSA-N 1 1 419.428 3.115 20 0 HGADMO Cc1ccc(-n2c(Cl)c(C[NH2+][C@@H](CO)Cc3ccc(O)cc3)nc2N(C)C)cc1 ZINC001474437972 1126204304 /nfs/dbraw/zinc/20/43/04/1126204304.db2.gz AYEMRSJLNMDQPV-QGZVFWFLSA-N 1 1 414.937 3.299 20 0 HGADMO COC1(c2nc(C3CCOCC3)no2)CC[NH+](Cc2cnc3c(C)cccn23)CC1 ZINC000578086977 557802570 /nfs/dbraw/zinc/80/25/70/557802570.db2.gz WNQGCOWTJQYMRE-UHFFFAOYSA-N 1 1 411.506 3.057 20 0 HGADMO NC(=O)c1ccc(C(F)(F)N2CCC[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)nc1Cl ZINC001164626571 719056220 /nfs/dbraw/zinc/05/62/20/719056220.db2.gz SFZDTRFCUXHOAL-DOTOQJQBSA-N 1 1 420.891 3.480 20 0 HGADMO O=C1NCc2c1c(N1CCC[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]31)nc(Cl)c2F ZINC001164628946 719082942 /nfs/dbraw/zinc/08/29/42/719082942.db2.gz VDGQHSCHZLZOMW-GOEBONIOSA-N 1 1 400.885 3.218 20 0 HGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2C[C@@H]3CCCO[C@H]3[C@@H](N3CCCC3=O)C2)nc1 ZINC001164646034 719305804 /nfs/dbraw/zinc/30/58/04/719305804.db2.gz AVLUJUXDMCANRD-SEDAZVQISA-N 1 1 412.578 3.235 20 0 HGADMO CCOC(=O)c1cc2ccnc(N3CCc4c(C[NH+](C)C)nn(C(C)C)c4C3)c2[nH]1 ZINC001164649627 719309941 /nfs/dbraw/zinc/30/99/41/719309941.db2.gz POZRVJVOONZCGU-UHFFFAOYSA-N 1 1 410.522 3.141 20 0 HGADMO C[N@H+]1CCO[C@@H]2CN(c3cc(-c4ccc(Cl)nc4)ccc3C3OCCCO3)C[C@H]21 ZINC001164666475 719421201 /nfs/dbraw/zinc/42/12/01/719421201.db2.gz CVTLCPRRTIXQSD-WOJBJXKFSA-N 1 1 415.921 3.357 20 0 HGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2C[C@H](C(=O)N3CC=CC3)C3(C2)CCOCC3)nc1 ZINC001164678182 719561394 /nfs/dbraw/zinc/56/13/94/719561394.db2.gz VVKOSLJOMUPVES-FGZHOGPDSA-N 1 1 424.589 3.260 20 0 HGADMO CNC(=O)C[N@H+]1CCCC12CCN(c1nc3c(Cl)cccc3nc1Cl)CC2 ZINC001164690246 719752014 /nfs/dbraw/zinc/75/20/14/719752014.db2.gz WQWGEKTWOJDUBX-UHFFFAOYSA-N 1 1 408.333 3.117 20 0 HGADMO COC(=O)Cc1cccc(N2CCC3(CCC[N@H+]3Cc3csc(C)n3)CC2)n1 ZINC001164692443 719807734 /nfs/dbraw/zinc/80/77/34/719807734.db2.gz HFVZOLWCOLEPIJ-UHFFFAOYSA-N 1 1 400.548 3.197 20 0 HGADMO CCOC(=O)c1cnc(N2CCC3(CCC[N@H+]3Cc3csc(C)n3)CC2)nc1C ZINC001164693816 719807905 /nfs/dbraw/zinc/80/79/05/719807905.db2.gz RLHKOOYCJPZYFX-UHFFFAOYSA-N 1 1 415.563 3.362 20 0 HGADMO COC[C@@H]1CN(c2ccc3c(n2)CC[N@H+](Cc2ccccc2)C3)Cc2cn(C)nc21 ZINC001164696242 719831320 /nfs/dbraw/zinc/83/13/20/719831320.db2.gz QWOKLAQVRFOWJZ-NRFANRHFSA-N 1 1 403.530 3.124 20 0 HGADMO COC(=O)[C@@]1(C)C[C@H]([NH+]2CCOCC2)CCN1c1nccc2cc(F)c(Cl)cc21 ZINC001164702331 719876300 /nfs/dbraw/zinc/87/63/00/719876300.db2.gz IIZAFSLONMKFIB-QVKFZJNVSA-N 1 1 421.900 3.260 20 0 HGADMO COc1cc(N2CCC3(CC2)C[N@@H+](Cc2cccs2)CCO3)nc(SC)n1 ZINC001164698275 719891951 /nfs/dbraw/zinc/89/19/51/719891951.db2.gz QPEAYKFJGCUKMZ-UHFFFAOYSA-N 1 1 406.577 3.140 20 0 HGADMO O=c1cc2[nH]c(N3CCC4(CC3)C[N@@H+](Cc3cccs3)CCO4)c(Cl)cc-2[nH]1 ZINC001164697040 719892887 /nfs/dbraw/zinc/89/28/87/719892887.db2.gz IYXXJKYOWQGKPC-UHFFFAOYSA-N 1 1 418.950 3.163 20 0 HGADMO CCOc1c(Cl)ncnc1N1CCC2(CC1)C[N@@H+](Cc1cccs1)CCO2 ZINC001164698239 719893402 /nfs/dbraw/zinc/89/34/02/719893402.db2.gz QEGLXHTUFRPGLY-UHFFFAOYSA-N 1 1 408.955 3.462 20 0 HGADMO CCOC(=O)c1c(C)nc(Cl)cc1N1CC[C@@]2(C1)C[N@@H+](CC1CC1)C[C@@H]2COC ZINC001164809756 720097984 /nfs/dbraw/zinc/09/79/84/720097984.db2.gz JXZIUWCJWLXVTA-VGSWGCGISA-N 1 1 421.969 3.405 20 0 HGADMO COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1ncnc3c1CCCC3)CC2 ZINC001164719447 720113628 /nfs/dbraw/zinc/11/36/28/720113628.db2.gz WXNAMPSMWCLTHY-HXUWFJFHSA-N 1 1 407.562 3.258 20 0 HGADMO COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1ncc(Cl)nc1C)CC2 ZINC001164715462 720121434 /nfs/dbraw/zinc/12/14/34/720121434.db2.gz FXRZOHCLMGONLT-GOSISDBHSA-N 1 1 401.942 3.341 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1nc(Cl)nc3sc(C)nc31)C2 ZINC001164813131 720124388 /nfs/dbraw/zinc/12/43/88/720124388.db2.gz PPJBPLAGXSPWEI-LIRRHRJNSA-N 1 1 407.971 3.233 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1cc(OCc3ccccc3)cnn1)C2 ZINC001164807296 720132460 /nfs/dbraw/zinc/13/24/60/720132460.db2.gz BTIYFJKTAQQYJJ-ZJSXRUAMSA-N 1 1 408.546 3.240 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(C(F)(F)c1nc(C)c(C)c(Cl)n1)C2 ZINC001164807977 720136937 /nfs/dbraw/zinc/13/69/37/720136937.db2.gz DHUROJZGNLXOGU-LPHOPBHVSA-N 1 1 414.928 3.476 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(C(F)(F)c1cc(Cl)nc(=S)[nH]1)C2 ZINC001164818134 720151857 /nfs/dbraw/zinc/15/18/57/720151857.db2.gz RVGKBGYROHHJPD-GUYCJALGSA-N 1 1 418.941 3.148 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1cc3ccc(C(=O)OC)cc3cn1)C2 ZINC001164814395 720157924 /nfs/dbraw/zinc/15/79/24/720157924.db2.gz GBUDRJJXJCXYIR-XUZZJYLKSA-N 1 1 409.530 3.206 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1ccc(-c3sc(C)nc3C)nn1)C2 ZINC001164813048 720188914 /nfs/dbraw/zinc/18/89/14/720188914.db2.gz CCNRFOAIRYVUNZ-XMSQKQJNSA-N 1 1 413.591 3.402 20 0 HGADMO CC(C)[N@@H+](C)Cc1cc(=O)n2c(n1)CN(C(F)(F)c1ccc(Cl)nc1)CCC2 ZINC001164811395 720207811 /nfs/dbraw/zinc/20/78/11/720207811.db2.gz HALSVUXCNRTKMN-UHFFFAOYSA-N 1 1 411.884 3.087 20 0 HGADMO CC(C)[N@@H+](C)Cc1cc(=O)n2c(n1)CN(c1nccc(Oc3ccccc3)n1)CCC2 ZINC001164812100 720215691 /nfs/dbraw/zinc/21/56/91/720215691.db2.gz DMGZUFGBFGWAIC-UHFFFAOYSA-N 1 1 420.517 3.076 20 0 HGADMO CC(C)[N@@H+](C)Cc1cc(=O)n2c(n1)CN(c1csc3ncnc(Cl)c13)CCC2 ZINC001164814717 720218342 /nfs/dbraw/zinc/21/83/42/720218342.db2.gz WLJNNUZKBGSKPY-UHFFFAOYSA-N 1 1 418.954 3.152 20 0 HGADMO CC(C)[N@@H+](C)Cc1cc(=O)n2c(n1)CN(c1cnc3ccc(Cl)cc3n1)CCC2 ZINC001164813521 720220548 /nfs/dbraw/zinc/22/05/48/720220548.db2.gz NMEIEGIZDZEFJX-UHFFFAOYSA-N 1 1 412.925 3.090 20 0 HGADMO COc1ccc2nc(N3CCCn4c(=O)cc(C[N@@H+](C)C(C)C)nc4C3)cc(C)c2c1 ZINC001164812765 720224098 /nfs/dbraw/zinc/22/40/98/720224098.db2.gz IVLWDIVCSFHXJS-UHFFFAOYSA-N 1 1 421.545 3.359 20 0 HGADMO CSc1nc2ccccc2c(N2CCCn3c(=O)cc(C[N@@H+](C)C(C)C)nc3C2)n1 ZINC001164811965 720225778 /nfs/dbraw/zinc/22/57/78/720225778.db2.gz BMEDYHNKBDSEQF-UHFFFAOYSA-N 1 1 424.574 3.159 20 0 HGADMO CCOC(=O)c1nc(Cl)nc(Cl)c1N1CC[C@@H]2[C@H]1CC[N@@H+]2Cc1cccnc1 ZINC001164729063 720395739 /nfs/dbraw/zinc/39/57/39/720395739.db2.gz UWPIDCINDBWIQH-ZIAGYGMSSA-N 1 1 422.316 3.208 20 0 HGADMO CCOC(=O)c1nc(Cl)nc(Cl)c1N1CC[C@@H]2[C@H]1CC[N@H+]2Cc1cccnc1 ZINC001164729063 720395746 /nfs/dbraw/zinc/39/57/46/720395746.db2.gz UWPIDCINDBWIQH-ZIAGYGMSSA-N 1 1 422.316 3.208 20 0 HGADMO CCOC(=O)c1cnc(Cl)c(C)c1N1CC[C@H]2[C@H]1CC[N@H+]2Cc1cccnc1 ZINC001164725097 720396188 /nfs/dbraw/zinc/39/61/88/720396188.db2.gz LUOQWKBVQOCSIB-ZWKOTPCHSA-N 1 1 400.910 3.468 20 0 HGADMO CCOC(=O)c1cc2ncnc(N3CC[C@H]4[C@H]3CC[N@H+]4Cc3cccnc3)c2s1 ZINC001164734248 720411716 /nfs/dbraw/zinc/41/17/16/720411716.db2.gz RHIZQKCUCXNJIA-DLBZAZTESA-N 1 1 409.515 3.116 20 0 HGADMO FC(F)(c1cnc2c(Cl)ncnc2c1)N1CC[C@H]2[C@H]1CC[N@@H+]2Cc1cccnc1 ZINC001164735357 720422924 /nfs/dbraw/zinc/42/29/24/720422924.db2.gz WOFQFJYLLHVVCV-DLBZAZTESA-N 1 1 416.863 3.471 20 0 HGADMO FC(F)(c1cnc2c(Cl)ncnc2c1)N1CC[C@H]2[C@H]1CC[N@H+]2Cc1cccnc1 ZINC001164735357 720422930 /nfs/dbraw/zinc/42/29/30/720422930.db2.gz WOFQFJYLLHVVCV-DLBZAZTESA-N 1 1 416.863 3.471 20 0 HGADMO c1ccc2nc(N3CC[C@@H]4[C@@H]3CC[N@@H+]4Cc3cccnc3)c(N3CCCC3)nc2c1 ZINC001164726276 720429869 /nfs/dbraw/zinc/42/98/69/720429869.db2.gz BFVUUKOUTPOMJL-YADHBBJMSA-N 1 1 400.530 3.478 20 0 HGADMO CC1CCN(C(=O)c2ccc(N3CC[C@H]4[C@H]3CC[N@H+]4Cc3cccnc3)nc2)CC1 ZINC001164734519 720436356 /nfs/dbraw/zinc/43/63/56/720436356.db2.gz SYKTXNDIVCFIFE-FCHUYYIVSA-N 1 1 405.546 3.202 20 0 HGADMO C[C@@H]1CCCN(C(=O)c2ccc(N3CC[C@@H]4[C@H]3CC[N@H+]4Cc3cccnc3)nc2)C1 ZINC001164731482 720436934 /nfs/dbraw/zinc/43/69/34/720436934.db2.gz KWNMNGMOPYWHMW-STZQEDGTSA-N 1 1 405.546 3.202 20 0 HGADMO COC(=O)c1cc(Cl)cnc1N1CC[C@@H]2[C@@H](C[C@@H](Cn3cccn3)[N@H+]2C(C)C)C1 ZINC001164833286 720512527 /nfs/dbraw/zinc/51/25/27/720512527.db2.gz CSFDUCMGNNPBAD-VDZJLULYSA-N 1 1 417.941 3.096 20 0 HGADMO CC(C)[N@@H+]1[C@@H]2CCN(c3nc(Cl)nc4ncccc43)C[C@H]2C[C@H]1Cn1cccn1 ZINC001164839436 720517880 /nfs/dbraw/zinc/51/78/80/720517880.db2.gz UJIUINWAKBQVLD-SOLBZPMBSA-N 1 1 411.941 3.253 20 0 HGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@H]2CN(c3ncnc4nc(Cl)ccc43)CC[C@@H]21 ZINC001164834617 720518018 /nfs/dbraw/zinc/51/80/18/720518018.db2.gz GSRLUYKAYDQKHV-BQFCYCMXSA-N 1 1 411.941 3.253 20 0 HGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@H]2CN(C(F)(F)c3cnc(Cl)nc3)CC[C@@H]21 ZINC001164834858 720518936 /nfs/dbraw/zinc/51/89/36/720518936.db2.gz HMNPGUOJXGOSTD-XIRDDKMYSA-N 1 1 410.900 3.249 20 0 HGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@H]2CN(c3nc(Cl)nc4c3ccn4C)CC[C@@H]21 ZINC001164841127 720528025 /nfs/dbraw/zinc/52/80/25/720528025.db2.gz XORXQDDDOSMBTE-BQFCYCMXSA-N 1 1 413.957 3.196 20 0 HGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@H]2CN(c3ccc(C(=O)NC(C)(C)C)cn3)CC[C@@H]21 ZINC001164837342 720546899 /nfs/dbraw/zinc/54/68/99/720546899.db2.gz LTYCYQDXIJXVDH-ACRUOGEOSA-N 1 1 424.593 3.184 20 0 HGADMO COc1cccc2cnc(N3CC[C@@H]4[C@@H](C[C@H](Cn5cccn5)[N@H+]4C(C)C)C3)nc21 ZINC001164833646 720550699 /nfs/dbraw/zinc/55/06/99/720550699.db2.gz BBPCGFDVXOCHKL-XUVXKRRUSA-N 1 1 406.534 3.213 20 0 HGADMO CSc1cnc(Cl)nc1N1CC[C@@H]2[C@H](C[C@@H](Cn3cccn3)[N@H+]2C(C)C)C1 ZINC001164833578 720551345 /nfs/dbraw/zinc/55/13/45/720551345.db2.gz AIKRECWEVJRADS-OWCLPIDISA-N 1 1 406.987 3.426 20 0 HGADMO CCOC(=O)c1cc(N2CC[C@@H]3[C@@H](C[C@@H](Cn4cccn4)[N@H+]3C(C)C)C2)ncc1C ZINC001164842985 720553106 /nfs/dbraw/zinc/55/31/06/720553106.db2.gz ZKIACYLTHCTCNU-IRFCIJBXSA-N 1 1 411.550 3.141 20 0 HGADMO CC(C)[N@@H+]1[C@@H]2CCN(c3cc(C(=O)NC(C)(C)C)ccn3)C[C@@H]2C[C@H]1Cn1cccn1 ZINC001164839576 720577060 /nfs/dbraw/zinc/57/70/60/720577060.db2.gz QPEIECHPGTVSBS-PCCBWWKXSA-N 1 1 424.593 3.184 20 0 HGADMO COC(OC)c1cc(C)cnc1N1CC[C@@H]2[C@H](C[C@@H](Cn3cccn3)[N@H+]2C(C)C)C1 ZINC001164843527 720583223 /nfs/dbraw/zinc/58/32/23/720583223.db2.gz XSPNSLIFWXATEU-SVFBPWRDSA-N 1 1 413.566 3.256 20 0 HGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@@H]2CN(C(F)(F)c3nccnc3Cl)CC[C@@H]21 ZINC001164835293 720588416 /nfs/dbraw/zinc/58/84/16/720588416.db2.gz AYVIBSNYLCAUSY-PMPSAXMXSA-N 1 1 410.900 3.249 20 0 HGADMO COc1nnc(N2CC[C@@H]3[C@H](C[C@H](Cn4cccn4)[N@H+]3C(C)C)C2)c2ccccc21 ZINC001164839223 720600482 /nfs/dbraw/zinc/60/04/82/720600482.db2.gz MLGZURKGPKKVQF-DBXWQHBBSA-N 1 1 406.534 3.213 20 0 HGADMO Cc1cc(N2CC[C@@H]3[C@@H](C[C@H](Cn4cccn4)[N@@H+]3C(C)C)C2)nc(-c2ccccn2)n1 ZINC001164840085 720601208 /nfs/dbraw/zinc/60/12/08/720601208.db2.gz OYIPLXHYBHHWRZ-TUNNFDKTSA-N 1 1 417.561 3.421 20 0 HGADMO FC(F)(c1cc(Cl)nc(Cl)c1)N1CC[N@@H+]2C[C@H](Oc3cncnc3)C[C@@H]2C1 ZINC001164746285 720621881 /nfs/dbraw/zinc/62/18/81/720621881.db2.gz WXYFQJZNAZLETI-CHWSQXEVSA-N 1 1 416.259 3.065 20 0 HGADMO FC(F)(c1cc(Cl)nc(Cl)c1)N1CC[N@H+]2C[C@H](Oc3cncnc3)C[C@@H]2C1 ZINC001164746285 720621882 /nfs/dbraw/zinc/62/18/82/720621882.db2.gz WXYFQJZNAZLETI-CHWSQXEVSA-N 1 1 416.259 3.065 20 0 HGADMO COC(=O)c1cc(C)nc(N2CCC3(C[C@@H]([N@@H+](C)Cc4ccccc4)CO3)CC2)c1 ZINC001164843208 720661277 /nfs/dbraw/zinc/66/12/77/720661277.db2.gz VGCPAJDVIJHWOO-OAQYLSRUSA-N 1 1 409.530 3.437 20 0 HGADMO COC(=O)c1ccc(C)nc1N1CCC2(C[C@@H]([N@@H+](C)Cc3ccccc3)CO2)CC1 ZINC001164840452 720666384 /nfs/dbraw/zinc/66/63/84/720666384.db2.gz MPNMSAIZYKBNJD-HXUWFJFHSA-N 1 1 409.530 3.437 20 0 HGADMO C[N@@H+](Cc1ccccc1)[C@H]1COC2(C1)CCN(c1cc(C(N)=O)c(Cl)cn1)CC2 ZINC001164843196 720666844 /nfs/dbraw/zinc/66/68/44/720666844.db2.gz UVTRNJHOIKVNSX-QGZVFWFLSA-N 1 1 414.937 3.094 20 0 HGADMO C[N@@H+](Cc1ccc(N(c2nc(N3CCCC3)nc3c2C[NH2+]CC3)C2CC2)nc1)C1CC1 ZINC001164844974 720744011 /nfs/dbraw/zinc/74/40/11/720744011.db2.gz WNPXIISIFCWWQG-UHFFFAOYSA-N 1 1 419.577 3.012 20 0 HGADMO C[N@H+](Cc1ccc(N(c2nc(N3CCCC3)nc3c2CNCC3)C2CC2)nc1)C1CC1 ZINC001164844974 720744019 /nfs/dbraw/zinc/74/40/19/720744019.db2.gz WNPXIISIFCWWQG-UHFFFAOYSA-N 1 1 419.577 3.012 20 0 HGADMO C[N@@H+](Cc1ccc(N(c2nc(N3CCCC3)nc3c2CNCC3)C2CC2)nc1)C1CC1 ZINC001164844974 720744027 /nfs/dbraw/zinc/74/40/27/720744027.db2.gz WNPXIISIFCWWQG-UHFFFAOYSA-N 1 1 419.577 3.012 20 0 HGADMO Clc1ccc2c(Cl)nnc(N3CC[N@H+]4C[C@@H](Oc5cncnc5)C[C@H]4C3)c2c1 ZINC001164748893 720791001 /nfs/dbraw/zinc/79/10/01/720791001.db2.gz RVBRDRQTFZODOV-KBPBESRZSA-N 1 1 417.300 3.069 20 0 HGADMO Clc1ccc2c(Cl)ncnc2c1N1CC[N@H+]2C[C@H](Oc3cncnc3)C[C@H]2C1 ZINC001164747350 720805195 /nfs/dbraw/zinc/80/51/95/720805195.db2.gz NIPYRCHBTONIRS-QWHCGFSZSA-N 1 1 417.300 3.069 20 0 HGADMO c1ncn(C[C@@H]2C[C@H]3CN(c4ccnc(-c5ccccc5)n4)CC[C@H]3[N@H+]2CC2CC2)n1 ZINC001164741257 720816046 /nfs/dbraw/zinc/81/60/46/720816046.db2.gz MSIQJITYWLUIRT-FDFHNCONSA-N 1 1 415.545 3.115 20 0 HGADMO Clc1ccc2ncnc(N3CC[C@@H]4[C@@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)c2c1 ZINC001164743985 720816795 /nfs/dbraw/zinc/81/67/95/720816795.db2.gz SWDYZDOPVLPRBB-YRISNDGFSA-N 1 1 423.952 3.254 20 0 HGADMO Clc1cccc2c1ncnc2N1CC[C@@H]2[C@@H](C[C@@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164743330 720817430 /nfs/dbraw/zinc/81/74/30/720817430.db2.gz SGGIBFJQUAUQPY-ABSDTBQOSA-N 1 1 423.952 3.254 20 0 HGADMO CC(C)(c1ccnc(Cl)c1)[N@H+]1C[C@H]2COC[C@@]2(C(=O)NCCc2ccccc2)C1 ZINC001164853653 720817711 /nfs/dbraw/zinc/81/77/11/720817711.db2.gz RJVPNNQDSITKAF-CVDCTZTESA-N 1 1 413.949 3.277 20 0 HGADMO Cc1nc2ccc(F)cc2c(N2CC[C@@H]3[C@H](C[C@H](Cn4cncn4)[N@H+]3CC3CC3)C2)n1 ZINC001164739613 720820144 /nfs/dbraw/zinc/82/01/44/720820144.db2.gz HZAKBKIRGKBFIF-SFGWALBWSA-N 1 1 421.524 3.048 20 0 HGADMO Clc1ccc2nc(N3CC[C@@H]4[C@@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)cnc2c1 ZINC001164740698 720823113 /nfs/dbraw/zinc/82/31/13/720823113.db2.gz KRUFUBVFLXKJAA-YRISNDGFSA-N 1 1 423.952 3.254 20 0 HGADMO Clc1nc2ccccc2nc1N1CC[C@@H]2[C@@H](C[C@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164739802 720823259 /nfs/dbraw/zinc/82/32/59/720823259.db2.gz IRAHDJVHQJAXBI-SQGPQFPESA-N 1 1 423.952 3.254 20 0 HGADMO Clc1ccc2cc(N3CC[C@@H]4[C@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)ncc2n1 ZINC001164741190 720831421 /nfs/dbraw/zinc/83/14/21/720831421.db2.gz MAJVJDJBWFDXLT-WSTZPKSXSA-N 1 1 423.952 3.254 20 0 HGADMO Clc1ccc2c(cnnc2N2CC[C@@H]3[C@H](C[C@@H](Cn4cncn4)[N@H+]3CC3CC3)C2)c1 ZINC001164741862 720831672 /nfs/dbraw/zinc/83/16/72/720831672.db2.gz OQFGWBITVVCIGH-SLYNCCJLSA-N 1 1 423.952 3.254 20 0 HGADMO Clc1ccnc2cnc(N3CC[C@@H]4[C@@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)cc12 ZINC001164745885 720835872 /nfs/dbraw/zinc/83/58/72/720835872.db2.gz OBUJDQDTPHFAOG-XGHQBKJUSA-N 1 1 423.952 3.254 20 0 HGADMO CSc1ccnc(Cl)c1N1CC[C@@H]2[C@H](C[C@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164746688 720836344 /nfs/dbraw/zinc/83/63/44/720836344.db2.gz PZDVADFMKWXSDM-BRWVUGGUSA-N 1 1 418.998 3.428 20 0 HGADMO COCC[N@H+]1CCO[C@H]2CN(C(F)(F)c3ccnc(Cl)c3Cl)CC[C@H]2C1 ZINC001164857876 720837457 /nfs/dbraw/zinc/83/74/57/720837457.db2.gz YVJWFXHGRDUPGC-JSGCOSHPSA-N 1 1 410.292 3.107 20 0 HGADMO CSc1cc(Cl)cnc1N1CC[C@@H]2[C@@H](C[C@@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164748365 720843888 /nfs/dbraw/zinc/84/38/88/720843888.db2.gz UKUVJPDYXMRNDE-RYQLBKOJSA-N 1 1 418.998 3.428 20 0 HGADMO Fc1ccc2ccc(N3CC[C@@H]4[C@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)nc2c1 ZINC001164745873 720848970 /nfs/dbraw/zinc/84/89/70/720848970.db2.gz OBNFQEKOZCUUIH-KAGYGMCKSA-N 1 1 406.509 3.345 20 0 HGADMO COCC[N@H+]1CCO[C@H]2CN(c3cc4nc(Cl)cnc4cc3Cl)CC[C@H]2C1 ZINC001164856373 720850715 /nfs/dbraw/zinc/85/07/15/720850715.db2.gz VYFVPGJFQAWTID-UGSOOPFHSA-N 1 1 411.333 3.110 20 0 HGADMO Cc1cc(N2CC[C@@H]3[C@@H](C[C@H](Cn4cncn4)[N@H+]3CC3CC3)C2)nc(-c2ccco2)n1 ZINC001164751208 720851687 /nfs/dbraw/zinc/85/16/87/720851687.db2.gz QRLMAOUVEKKAED-XUVXKRRUSA-N 1 1 419.533 3.016 20 0 HGADMO COCC[N@H+]1CCO[C@@H]2CN(c3cncc(Sc4cccc(C)c4)n3)CC[C@H]2C1 ZINC001164860268 720869059 /nfs/dbraw/zinc/86/90/59/720869059.db2.gz WEFLGGXFHJEMCV-AZUAARDMSA-N 1 1 414.575 3.110 20 0 HGADMO CCOc1cncc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COCc2cccnc2)n1 ZINC001164753930 720869136 /nfs/dbraw/zinc/86/91/36/720869136.db2.gz QKNSQKOWFOGBEN-URXFXBBRSA-N 1 1 423.561 3.025 20 0 HGADMO COCC[N@H+]1CCO[C@@H]2CN(c3nc(C)nc4sc5c(c43)CCCC5)CC[C@@H]2C1 ZINC001164852948 720873590 /nfs/dbraw/zinc/87/35/90/720873590.db2.gz AREQQEACDCQVDM-SJLPKXTDSA-N 1 1 416.591 3.052 20 0 HGADMO COCC[N@H+]1CCO[C@@H]2CN(c3cc(Cl)nc(-c4ccc(F)cc4)n3)CC[C@H]2C1 ZINC001164860539 720880732 /nfs/dbraw/zinc/88/07/32/720880732.db2.gz OURLDEMNHZIMBW-FUHWJXTLSA-N 1 1 420.916 3.110 20 0 HGADMO CCOc1cnc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COCc2cccnc2)nc1 ZINC001164751574 720881961 /nfs/dbraw/zinc/88/19/61/720881961.db2.gz CNWQRHGLRXAQGY-QPPBQGQZSA-N 1 1 423.561 3.025 20 0 HGADMO COCC[N@H+]1CCO[C@H]2CN(c3nc4c(Cl)cccc4nc3Cl)CC[C@@H]2C1 ZINC001164865233 720886651 /nfs/dbraw/zinc/88/66/51/720886651.db2.gz ZAOVIBDCCFQDMZ-CJNGLKHVSA-N 1 1 411.333 3.110 20 0 HGADMO COCC[N@H+]1CCO[C@H]2CN(C(F)(F)C3(c4ccnc(Cl)c4)CC3)CC[C@H]2C1 ZINC001164860522 720890721 /nfs/dbraw/zinc/89/07/21/720890721.db2.gz OTQGKABHDAHSMP-RDJZCZTQSA-N 1 1 415.912 3.029 20 0 HGADMO COCC[N@H+]1CCO[C@@H]2CN(C(F)(F)C3(c4ccc(Cl)nc4)CC3)CC[C@@H]2C1 ZINC001164853891 720891124 /nfs/dbraw/zinc/89/11/24/720891124.db2.gz DORVCCKVFIABPX-NVXWUHKLSA-N 1 1 415.912 3.029 20 0 HGADMO Cc1cnc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COCc2cccnc2)c(N)c1 ZINC001164756243 720900854 /nfs/dbraw/zinc/90/08/54/720900854.db2.gz OQXLCIBVDRHFDC-QPPBQGQZSA-N 1 1 407.562 3.122 20 0 HGADMO CCOc1cc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COCc2cccnc2)ncn1 ZINC001164748463 720910792 /nfs/dbraw/zinc/91/07/92/720910792.db2.gz GESKFSQEZZKDJW-QPPBQGQZSA-N 1 1 423.561 3.025 20 0 HGADMO c1cncc(COC[C@@H]2C[N@@H+](CC3CC3)C[C@]23CCN(c2cc4c(nn2)CCC4)C3)c1 ZINC001164747940 720929683 /nfs/dbraw/zinc/92/96/83/720929683.db2.gz FAADHLXQEPNGCG-DHLKQENFSA-N 1 1 419.573 3.115 20 0 HGADMO CC(C)[N@@H+](C)Cc1cnc2n1CCN(C(F)(F)c1nc(Cl)nc3[nH]cnc31)[C@@H]2C ZINC001164858913 721005814 /nfs/dbraw/zinc/00/58/14/721005814.db2.gz JENSARLFWAFANS-LLVKDONJSA-N 1 1 424.887 3.121 20 0 HGADMO COC(=O)c1cc(Cl)c(N2CCn3c(C[N@@H+](C)C(C)C)cnc3[C@@H]2C)nc1C ZINC001164864791 721016428 /nfs/dbraw/zinc/01/64/28/721016428.db2.gz ZMDTVXQIBIWHNN-AWEZNQCLSA-N 1 1 405.930 3.448 20 0 HGADMO CC(C)N(C)Cc1cnc2n1CCN(c1ccc(OCC3CC[NH2+]CC3)cn1)[C@H]2C ZINC001164858801 721020577 /nfs/dbraw/zinc/02/05/77/721020577.db2.gz GYSGXKUWYRDAGO-SFHVURJKSA-N 1 1 412.582 3.078 20 0 HGADMO Fc1c(Cl)nccc1C(F)(F)N1CC[N@H+]2C[C@@H](OCc3cccnc3)C[C@H]2C1 ZINC001164866266 721050914 /nfs/dbraw/zinc/05/09/14/721050914.db2.gz DJPKINRHZFXSOA-GJZGRUSLSA-N 1 1 412.843 3.294 20 0 HGADMO Clc1cc(-c2ccncc2)c(N2CC[N@H+]3C[C@H](OCc4cccnc4)C[C@@H]3C2)nn1 ZINC001164869565 721057684 /nfs/dbraw/zinc/05/76/84/721057684.db2.gz UHWCUCKUBBDTHD-RTBURBONSA-N 1 1 422.920 3.067 20 0 HGADMO c1ccc(Oc2cc(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@H]4C3)ncn2)cc1 ZINC001164868034 721060790 /nfs/dbraw/zinc/06/07/90/721060790.db2.gz MHLZAHIMDDBYOI-PZJWPPBQSA-N 1 1 403.486 3.144 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(C(F)(F)c4cc(Cl)nc(Cl)n4)C[C@@H]3C2)cn1 ZINC001164773725 721078839 /nfs/dbraw/zinc/07/88/39/721078839.db2.gz YDXFAAFOAZAINO-OLZOCXBDSA-N 1 1 417.291 3.020 20 0 HGADMO Fc1ccc(-c2ccnc(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@H]4C3)n2)cc1 ZINC001164864379 721081414 /nfs/dbraw/zinc/08/14/14/721081414.db2.gz FRKQEFAOIWQTQP-LEWJYISDSA-N 1 1 405.477 3.157 20 0 HGADMO Cc1nc2cc(Cl)ccc2c(N2CC[N@H+]3C[C@@H](OCc4cccnc4)C[C@H]3C2)n1 ZINC001164867192 721091760 /nfs/dbraw/zinc/09/17/60/721091760.db2.gz WUGVUBJXWBGGFI-OALUTQOASA-N 1 1 409.921 3.466 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4cc(-c5ccnc(Cl)c5)ccn4)C[C@H]3C2)cn1 ZINC001164770462 721096660 /nfs/dbraw/zinc/09/66/60/721096660.db2.gz QMALDHGQJDWABB-VQTJNVASSA-N 1 1 408.937 3.489 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(C(F)(F)c4c[nH]c5nc(Cl)ccc45)C[C@H]3C2)cn1 ZINC001164771377 721134762 /nfs/dbraw/zinc/13/47/62/721134762.db2.gz SKZCVBFYUDRPFM-LSDHHAIUSA-N 1 1 420.895 3.453 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4ncnc5c4ccn5C4CCCC4)C[C@H]3C2)cn1 ZINC001164771344 721142835 /nfs/dbraw/zinc/14/28/35/721142835.db2.gz SGJFEEGYZVNDSB-RBUKOAKNSA-N 1 1 405.550 3.238 20 0 HGADMO Fc1cccc(-c2ccc(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@H]4C3)nn2)c1 ZINC001164880686 721163340 /nfs/dbraw/zinc/16/33/40/721163340.db2.gz XCPPNVZLFFQOBP-LEWJYISDSA-N 1 1 405.477 3.157 20 0 HGADMO CC(C)c1noc(-c2ccnc(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@@H]4C3)c2)n1 ZINC001164871084 721167553 /nfs/dbraw/zinc/16/75/53/721167553.db2.gz DINJZMUNUCNYPM-WOJBJXKFSA-N 1 1 420.517 3.130 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4cncc(Oc5cccc(F)c5)n4)C[C@H]3C2)cn1 ZINC001164768293 721170600 /nfs/dbraw/zinc/17/06/00/721170600.db2.gz KTYMVLFZTLIHOQ-QZTJIDSGSA-N 1 1 408.481 3.100 20 0 HGADMO Cc1cc(-c2ccccc2F)nnc1N1CC[N@H+]2C[C@H](OCc3cccnc3)C[C@H]2C1 ZINC001164876481 721179859 /nfs/dbraw/zinc/17/98/59/721179859.db2.gz MRWODYFUMIPJRW-VQTJNVASSA-N 1 1 419.504 3.466 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(C(F)(F)c4cc(C5CC5)nnc4Cl)C[C@@H]3C2)cn1 ZINC001164762003 721205704 /nfs/dbraw/zinc/20/57/04/721205704.db2.gz BQWVQWOHWRAKAZ-HOTGVXAUSA-N 1 1 422.911 3.244 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4nccc(SCc5ccccc5)n4)C[C@H]3C2)cn1 ZINC001164767205 721228758 /nfs/dbraw/zinc/22/87/58/721228758.db2.gz WFNDHPQQKNPDJH-NHCUHLMSSA-N 1 1 420.586 3.461 20 0 HGADMO CC(C)(c1ccnc(Cl)c1)[N@H+]1C[C@@H]2COC[C@@H](C(=O)NCc3ccco3)[C@@H]2C1 ZINC001164760186 721258642 /nfs/dbraw/zinc/25/86/42/721258642.db2.gz CWRQMPUWSFSMJF-ZTFGCOKTSA-N 1 1 403.910 3.074 20 0 HGADMO Cc1ccc2c(C)cc(N3CCC4(CC3)COCC[N@H+](CC(=O)N(C)C)C4)nc2c1C ZINC001164875978 721286232 /nfs/dbraw/zinc/28/62/32/721286232.db2.gz IJLQQYYEDLUTIK-UHFFFAOYSA-N 1 1 424.589 3.167 20 0 HGADMO CCC[N@H+]1CCCC[C@@H]1c1ccc(N2C[C@H]3OCCN(c4ccc(C)nn4)[C@@H]3C2)nc1 ZINC001164777553 721313771 /nfs/dbraw/zinc/31/37/71/721313771.db2.gz SRGWVCGODSYLFG-YPAWHYETSA-N 1 1 422.577 3.211 20 0 HGADMO C[NH+]1CCC(Oc2ccnc(N3CCC4(CC3)C(=O)NC[C@@H]4c3ccccc3)c2)CC1 ZINC001164877976 721319330 /nfs/dbraw/zinc/31/93/30/721319330.db2.gz MAINITQLTXZNDR-JOCHJYFZSA-N 1 1 420.557 3.055 20 0 HGADMO C[N@@H+](Cc1ccc(N2CCC3(C[C@H](Oc4ncccc4F)CO3)CC2)nc1)C1CC1 ZINC001164777677 721327058 /nfs/dbraw/zinc/32/70/58/721327058.db2.gz PFARZDMMKZGHBA-IBGZPJMESA-N 1 1 412.509 3.417 20 0 HGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@@]2(CCCN(c3cc(N)cc(Cl)n3)C2)C1 ZINC001164780055 721345555 /nfs/dbraw/zinc/34/55/55/721345555.db2.gz ZFVSXYCNPKRPIQ-FQEVSTJZSA-N 1 1 405.930 3.041 20 0 HGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2CC[C@H]3OCC[C@@]3(C(=O)NCC3CC3)C2)nc1 ZINC001164882877 721345802 /nfs/dbraw/zinc/34/58/02/721345802.db2.gz IGZNSKPHKUSBLF-PQNGQFLHSA-N 1 1 412.578 3.140 20 0 HGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@]2(CCCN(c3c(C)nc(C)nc3Cl)C2)C1 ZINC001164776690 721346084 /nfs/dbraw/zinc/34/60/84/721346084.db2.gz CBOFZICPENQJAH-OAQYLSRUSA-N 1 1 419.957 3.471 20 0 HGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@]2(CCCN(c3c(C)nc(C)nc3Cl)C2)C1 ZINC001164776690 721346087 /nfs/dbraw/zinc/34/60/87/721346087.db2.gz CBOFZICPENQJAH-OAQYLSRUSA-N 1 1 419.957 3.471 20 0 HGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@@]2(CCCN(c3nccc4scnc43)C2)C1 ZINC001164779739 721352171 /nfs/dbraw/zinc/35/21/71/721352171.db2.gz VGKQSEROSQSACT-NRFANRHFSA-N 1 1 413.547 3.415 20 0 HGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@@]2(CCCN(c3ncc(Cl)nc3C)C2)C1 ZINC001164776470 721352395 /nfs/dbraw/zinc/35/23/95/721352395.db2.gz BYJPLCMSPVOOAP-FQEVSTJZSA-N 1 1 405.930 3.162 20 0 HGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@@]2(CCCN(c3ncc(Cl)nc3C)C2)C1 ZINC001164776470 721352398 /nfs/dbraw/zinc/35/23/98/721352398.db2.gz BYJPLCMSPVOOAP-FQEVSTJZSA-N 1 1 405.930 3.162 20 0 HGADMO C[NH+]1CCN(C[C@@H]2CCC[C@@]3(CCN(C(F)(F)c4cccc(Cl)n4)C3)O2)CC1 ZINC001164894575 721381818 /nfs/dbraw/zinc/38/18/18/721381818.db2.gz ZDFRDEBACHWHNJ-LPHOPBHVSA-N 1 1 414.928 3.045 20 0 HGADMO C[NH+]1CCN(C[C@@H]2CCC[C@]3(CCN(c4cnc5cccc(Cl)c5n4)C3)O2)CC1 ZINC001164893558 721394580 /nfs/dbraw/zinc/39/45/80/721394580.db2.gz VCZMRRDXMXWMII-HTAPYJJXSA-N 1 1 415.969 3.049 20 0 HGADMO C[NH+]1CCN(C[C@@H]2CCC[C@@]3(CCN(c4cnc5cccc(Cl)c5n4)C3)O2)CC1 ZINC001164893559 721394701 /nfs/dbraw/zinc/39/47/01/721394701.db2.gz VCZMRRDXMXWMII-JTSKRJEESA-N 1 1 415.969 3.049 20 0 HGADMO C[NH+]1CCN(C[C@@H]2CCC[C@@]3(CCN(c4nnc(Cl)c5ccsc54)C3)O2)CC1 ZINC001164889326 721395455 /nfs/dbraw/zinc/39/54/55/721395455.db2.gz LSAJFJMVHNTTBB-YWZLYKJASA-N 1 1 421.998 3.110 20 0 HGADMO COc1cccc2c1nc(Cl)nc2N1C[C@@H]2C[NH+](Cc3nccs3)C[C@H]2C1 ZINC001164783574 721409578 /nfs/dbraw/zinc/40/95/78/721409578.db2.gz IZVQFURTVOFMBR-STQMWFEESA-N 1 1 401.923 3.317 20 0 HGADMO COc1cc2c(cc1Cl)ncnc2N1C[C@@H]2C[N@@H+](Cc3nccs3)C[C@@H]2C1 ZINC001164781135 721411250 /nfs/dbraw/zinc/41/12/50/721411250.db2.gz BXBRYMODOFNDPH-BETUJISGSA-N 1 1 401.923 3.317 20 0 HGADMO COc1cc2c(cc1Cl)ncnc2N1C[C@@H]2C[N@H+](Cc3nccs3)C[C@@H]2C1 ZINC001164781135 721411252 /nfs/dbraw/zinc/41/12/52/721411252.db2.gz BXBRYMODOFNDPH-BETUJISGSA-N 1 1 401.923 3.317 20 0 HGADMO COc1ccc2ccc(N3CC[C@]4(C3)CCC[C@H](CN3CC[NH+](C)CC3)O4)nc2c1 ZINC001164885159 721419687 /nfs/dbraw/zinc/41/96/87/721419687.db2.gz GCDMAMWPDPPZGX-QPPBQGQZSA-N 1 1 410.562 3.009 20 0 HGADMO CSc1ccnc(Cl)c1N1CC[C@@]2(C1)CCC[C@H](CN1CC[NH+](C)CC1)O2 ZINC001164890594 721421120 /nfs/dbraw/zinc/42/11/20/721421120.db2.gz TZNGPQZEXVOWHW-OXQOHEQNSA-N 1 1 411.015 3.222 20 0 HGADMO O=C(OCc1ccccc1)c1ccc(N2C[C@H]3C[NH+](Cc4nccs4)C[C@@H]3C2)nc1 ZINC001164783330 721429170 /nfs/dbraw/zinc/42/91/70/721429170.db2.gz IIQFFGSYGJLIBD-WOJBJXKFSA-N 1 1 420.538 3.463 20 0 HGADMO Cc1ccc(-c2ccc(N3CC[C@@]4(C3)CCC[C@H](CN3CC[NH+](C)CC3)O4)nn2)cc1 ZINC001164896567 721432174 /nfs/dbraw/zinc/43/21/74/721432174.db2.gz RNKAYAPDLXELSK-RCZVLFRGSA-N 1 1 421.589 3.217 20 0 HGADMO Cc1nc(C2CC2)nc(Cl)c1N1CC[C@@]2(C1)CCC[C@H](CN1CC[NH+](C)CC1)O2 ZINC001164895375 721438000 /nfs/dbraw/zinc/43/80/00/721438000.db2.gz OCJCIDIORRNUHZ-XMSQKQJNSA-N 1 1 420.001 3.081 20 0 HGADMO COc1cccc2c1ccnc2N1CC[C@]2(C1)CCC[C@@H](CN1CC[NH+](C)CC1)O2 ZINC001164896206 721439818 /nfs/dbraw/zinc/43/98/18/721439818.db2.gz RBYHSBRQSHEKSW-CYFREDJKSA-N 1 1 410.562 3.009 20 0 HGADMO CC(C)c1c(Cl)ncnc1N1CC[C@]2(C1)CCC[C@H](CN1CC[NH+](C)CC1)O2 ZINC001164892233 721446299 /nfs/dbraw/zinc/44/62/99/721446299.db2.gz HTVLTDHPWLMPNE-UTKZUKDTSA-N 1 1 407.990 3.019 20 0 HGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1ncnc3ccsc31)CC2 ZINC001164784053 721450719 /nfs/dbraw/zinc/45/07/19/721450719.db2.gz DITICVMJVOEANL-SFHVURJKSA-N 1 1 416.591 3.425 20 0 HGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1cc(C(C)C)ncn1)CC2 ZINC001164786880 721457808 /nfs/dbraw/zinc/45/78/08/721457808.db2.gz QDDNIDBTAHNNMD-HXUWFJFHSA-N 1 1 402.583 3.334 20 0 HGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1cc(OC)cc(Cl)n1)CC2 ZINC001164785801 721458438 /nfs/dbraw/zinc/45/84/38/721458438.db2.gz NPOVVHRBPLODMG-SFHVURJKSA-N 1 1 423.985 3.478 20 0 HGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1cc(C)cc(OC)n1)CC2 ZINC001164788652 721458846 /nfs/dbraw/zinc/45/88/46/721458846.db2.gz VDWHIBIFWAKSGD-FQEVSTJZSA-N 1 1 403.567 3.133 20 0 HGADMO CCOC(=O)Cc1cccnc1N1CCC2(CC([N@@H+](C)Cc3ccncc3)C2)CC1 ZINC001164792581 721491025 /nfs/dbraw/zinc/49/10/25/721491025.db2.gz KYRKXGNEKQFPQL-UHFFFAOYSA-N 1 1 408.546 3.463 20 0 HGADMO C[N@@H+](Cc1ccncc1)C1CC2(C1)CCN(c1ncnc3c1ncn3C1CC1)CC2 ZINC001164796351 721500813 /nfs/dbraw/zinc/50/08/13/721500813.db2.gz QWAYUAYYSWLMEX-UHFFFAOYSA-N 1 1 403.534 3.437 20 0 HGADMO Cc1cc(Cl)nc(C(F)(F)N2CC[N@H+]3C[C@H](Oc4cccc(F)c4)C[C@@H]3C2)n1 ZINC001164900055 721512598 /nfs/dbraw/zinc/51/25/98/721512598.db2.gz NQCNVSLLAOMYIB-GDBMZVCRSA-N 1 1 412.843 3.464 20 0 HGADMO COC(=O)c1cc(Cl)cc(N2CC[N@H+]3C[C@H](Oc4cccc(F)c4)C[C@@H]3C2)n1 ZINC001164901426 721520156 /nfs/dbraw/zinc/52/01/56/721520156.db2.gz XEWUYJGOTCXPSQ-NVXWUHKLSA-N 1 1 405.857 3.003 20 0 HGADMO Cc1c[nH]c2nc(Cl)nc(N3CC[N@H+]4C[C@@H](Oc5cccc(F)c5)C[C@@H]4C3)c12 ZINC001164899055 721525459 /nfs/dbraw/zinc/52/54/59/721525459.db2.gz JUFHBKIZBBVVMG-ZBFHGGJFSA-N 1 1 401.873 3.401 20 0 HGADMO Cc1cc(Cl)nc(C(F)(F)N2C[C@H]([N@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@H]32)n1 ZINC001164803650 721529277 /nfs/dbraw/zinc/52/92/77/721529277.db2.gz IMWOBSZQRCWLFC-SOLBZPMBSA-N 1 1 423.895 3.247 20 0 HGADMO Cc1cc(Cl)nc(C(F)(F)N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@H]32)n1 ZINC001164803650 721529280 /nfs/dbraw/zinc/52/92/80/721529280.db2.gz IMWOBSZQRCWLFC-SOLBZPMBSA-N 1 1 423.895 3.247 20 0 HGADMO CCOC(=O)c1c(C)cc(N2CC[N@H+]3C[C@@H](Oc4cccc(F)c4)C[C@@H]3C2)nc1C ZINC001164909745 721540962 /nfs/dbraw/zinc/54/09/62/721540962.db2.gz RSSLAYONYNGFFI-QUCCMNQESA-N 1 1 413.493 3.356 20 0 HGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN([C@H](F)Oc2ccnc(Cl)c2)[C@H]2CCCO[C@H]12 ZINC001164802512 721541722 /nfs/dbraw/zinc/54/17/22/721541722.db2.gz GNQNAMAOEDWZDB-HNJRGHQBSA-N 1 1 406.889 3.126 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN([C@H](F)Oc2ccnc(Cl)c2)[C@H]2CCCO[C@H]12 ZINC001164802512 721541724 /nfs/dbraw/zinc/54/17/24/721541724.db2.gz GNQNAMAOEDWZDB-HNJRGHQBSA-N 1 1 406.889 3.126 20 0 HGADMO C=Cc1nc(Cl)nc(N2CC[N@H+]3C[C@H](Oc4cccc(F)c4)C[C@H]3C2)c1OC ZINC001164907202 721551146 /nfs/dbraw/zinc/55/11/46/721551146.db2.gz MQSSCENYHDSCIY-GOEBONIOSA-N 1 1 404.873 3.263 20 0 HGADMO CCOc1ccc(Cl)nc1N1C[C@H]([N@H+](C)Cc2cccnc2)[C@@H]2OCCC[C@@H]21 ZINC001164799724 721561358 /nfs/dbraw/zinc/56/13/58/721561358.db2.gz DIJDQERWRDMLLS-ABSDTBQOSA-N 1 1 402.926 3.397 20 0 HGADMO CCOc1ccc(Cl)nc1N1C[C@H]([N@@H+](C)Cc2cccnc2)[C@@H]2OCCC[C@@H]21 ZINC001164799724 721561360 /nfs/dbraw/zinc/56/13/60/721561360.db2.gz DIJDQERWRDMLLS-ABSDTBQOSA-N 1 1 402.926 3.397 20 0 HGADMO COc1cc2c(cc1F)ncnc2N1C[C@H]([N@@H+](C)Cc2cccnc2)[C@@H]2OCCC[C@@H]21 ZINC001164809861 721566811 /nfs/dbraw/zinc/56/68/11/721566811.db2.gz XPHDLIIFFGOUHV-JAXLGGSGSA-N 1 1 423.492 3.041 20 0 HGADMO CSc1cnc(Cl)c(N2C[C@H]([N@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@@H]32)n1 ZINC001164806783 721572921 /nfs/dbraw/zinc/57/29/21/721572921.db2.gz RRPLVJBKOKXPNB-YQQAZPJKSA-N 1 1 405.955 3.115 20 0 HGADMO CSc1cnc(Cl)c(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@@H]32)n1 ZINC001164806783 721572922 /nfs/dbraw/zinc/57/29/22/721572922.db2.gz RRPLVJBKOKXPNB-YQQAZPJKSA-N 1 1 405.955 3.115 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2ccc(-c3ccncc3)cn2)[C@H]2CCCO[C@H]12 ZINC001164805844 721575328 /nfs/dbraw/zinc/57/53/28/721575328.db2.gz PCXBLCZYNNWHMY-ZDXQCDESSA-N 1 1 401.514 3.407 20 0 HGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2cnc(-c3ccccc3)cn2)[C@H]2CCCO[C@@H]12 ZINC001164809895 721576832 /nfs/dbraw/zinc/57/68/32/721576832.db2.gz XYJCHHWHKDHWGK-WMTXJRDZSA-N 1 1 401.514 3.407 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2cnc(-c3ccccc3)cn2)[C@H]2CCCO[C@@H]12 ZINC001164809895 721576833 /nfs/dbraw/zinc/57/68/33/721576833.db2.gz XYJCHHWHKDHWGK-WMTXJRDZSA-N 1 1 401.514 3.407 20 0 HGADMO COC(=O)c1cc(C)nc(N2CCC(F)(F)[C@]3(CC[N@@H+](Cc4ccccn4)C3)C2)c1 ZINC001164907946 721584905 /nfs/dbraw/zinc/58/49/05/721584905.db2.gz XCNIMOSEOGRHRH-NRFANRHFSA-N 1 1 416.472 3.309 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2nccc3c4c([nH]c32)CCC4)[C@@H]2CCCO[C@H]12 ZINC001164808297 721589231 /nfs/dbraw/zinc/58/92/31/721589231.db2.gz QGQQQYQTYPONKM-XPNTWCBSSA-N 1 1 403.530 3.315 20 0 HGADMO FC1(F)CCN(c2[nH+][n-]c(Cl)c3ncnc2-3)C[C@]12CC[N@@H+](Cc1ccccn1)C2 ZINC001164908090 721712655 /nfs/dbraw/zinc/71/26/55/721712655.db2.gz VOBLOVOIFPKAQX-GOSISDBHSA-N 1 1 419.867 3.139 20 0 HGADMO CCN(CC)c1cc(N2CCC(F)(F)[C@]3(CC[N@@H+](Cc4ccccn4)C3)C2)ncn1 ZINC001164906794 721715802 /nfs/dbraw/zinc/71/58/02/721715802.db2.gz OJICIGFZRDLAAH-NRFANRHFSA-N 1 1 416.520 3.456 20 0 HGADMO Cc1cnc2c(ccnc2N2CCC(F)(F)[C@@]3(CC[N@@H+](Cc4ccccn4)C3)C2)n1 ZINC001164910789 721732118 /nfs/dbraw/zinc/73/21/18/721732118.db2.gz HUNLOAOFVDBUFG-OAQYLSRUSA-N 1 1 410.472 3.466 20 0 HGADMO COC(=O)c1ccc(N2CCc3c(C[N@H+](C)Cc4ccco4)cncc3C2)nc1OC ZINC001164910001 721746740 /nfs/dbraw/zinc/74/67/40/721746740.db2.gz XHRRFNMNYILEDQ-UHFFFAOYSA-N 1 1 422.485 3.060 20 0 HGADMO COC(=O)c1ccc(N2CCc3c(C[N@@H+](C)Cc4ccco4)cncc3C2)nc1OC ZINC001164910001 721746744 /nfs/dbraw/zinc/74/67/44/721746744.db2.gz XHRRFNMNYILEDQ-UHFFFAOYSA-N 1 1 422.485 3.060 20 0 HGADMO CCOC(=O)c1c(C)ncnc1N1CCc2c(C[N@H+](C)Cc3ccco3)cncc2C1 ZINC001164910061 721755653 /nfs/dbraw/zinc/75/56/53/721755653.db2.gz KGXQXZAMWBMTBM-UHFFFAOYSA-N 1 1 421.501 3.144 20 0 HGADMO CCOC(=O)c1c(C)ncnc1N1CCc2c(C[N@@H+](C)Cc3ccco3)cncc2C1 ZINC001164910061 721755656 /nfs/dbraw/zinc/75/56/56/721755656.db2.gz KGXQXZAMWBMTBM-UHFFFAOYSA-N 1 1 421.501 3.144 20 0 HGADMO CN(C)c1nc(Cl)cc(N2C[C@@H]3CCC[C@H]([N@@H+](C)Cc4ccccn4)[C@H]3C2)n1 ZINC001165028853 721799956 /nfs/dbraw/zinc/79/99/56/721799956.db2.gz ZXANTJRALVYHCV-SZMVWBNQSA-N 1 1 400.958 3.328 20 0 HGADMO C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@@H]2CN(c3nc(Cl)c(F)cc3C(N)=O)C[C@H]21 ZINC001165018701 721806627 /nfs/dbraw/zinc/80/66/27/721806627.db2.gz BYBKQXWCAYJMSV-MZMPZRCHSA-N 1 1 417.916 3.105 20 0 HGADMO CCOC(=O)c1cnc(C)nc1N1C[C@@H]2CCC[C@@H]([N@@H+](C)Cc3ccccn3)[C@H]2C1 ZINC001165025088 721807421 /nfs/dbraw/zinc/80/74/21/721807421.db2.gz NNIAAZKOOBOTMR-DZFGPLHGSA-N 1 1 409.534 3.094 20 0 HGADMO COCc1cc(N2C[C@@H]3CCC[C@@H]([N@@H+](C)Cc4ccccn4)[C@@H]3C2)nc(SC)n1 ZINC001165026882 721811024 /nfs/dbraw/zinc/81/10/24/721811024.db2.gz SAPWQBJMRKXYIV-PWIZWCRZSA-N 1 1 413.591 3.477 20 0 HGADMO COCCOC(=O)c1ccnc(N2C[C@@H]3CCC[C@@H]([N@@H+](C)Cc4ccccn4)[C@H]3C2)c1 ZINC001165027765 721829837 /nfs/dbraw/zinc/82/98/37/721829837.db2.gz TZULBGIICKBEJT-ILWGZMRPSA-N 1 1 424.545 3.017 20 0 HGADMO CN(C)CC[N@@H+]1CC[C@@H]2[C@H]1CCN2c1cnc(Cl)nc1Oc1ccc(F)cc1 ZINC001164935514 721880740 /nfs/dbraw/zinc/88/07/40/721880740.db2.gz XEZONICYRXHDGP-IAGOWNOFSA-N 1 1 405.905 3.276 20 0 HGADMO CN(C)CC[N@H+]1CC[C@@H]2[C@H]1CCN2c1cnc(Cl)nc1Oc1ccc(F)cc1 ZINC001164935514 721880743 /nfs/dbraw/zinc/88/07/43/721880743.db2.gz XEZONICYRXHDGP-IAGOWNOFSA-N 1 1 405.905 3.276 20 0 HGADMO CN(C)CC[N@@H+]1CC[C@@H]2[C@H]1CCN2[C@@H](F)Oc1cccc(-c2ccc(Cl)nn2)c1 ZINC001164935079 721883654 /nfs/dbraw/zinc/88/36/54/721883654.db2.gz VQOUEYJSAKYDIN-SFHLNBCPSA-N 1 1 419.932 3.139 20 0 HGADMO CN(C)CC[N@H+]1CC[C@@H]2[C@H]1CCN2[C@@H](F)Oc1cccc(-c2ccc(Cl)nn2)c1 ZINC001164935079 721883655 /nfs/dbraw/zinc/88/36/55/721883655.db2.gz VQOUEYJSAKYDIN-SFHLNBCPSA-N 1 1 419.932 3.139 20 0 HGADMO CN(C)CC[N@H+]1CC[C@H]2[C@@H]1CCN2c1cc(-c2nc(-c3cccs3)no2)ccn1 ZINC001164934192 721884739 /nfs/dbraw/zinc/88/47/39/721884739.db2.gz QEOMQLWDJQDCBK-IRXDYDNUSA-N 1 1 410.547 3.075 20 0 HGADMO C[NH+](C)CCN1CC[C@H]2[C@@H]1CCN2c1cc(-c2nc(-c3cccs3)no2)ccn1 ZINC001164934192 721884740 /nfs/dbraw/zinc/88/47/40/721884740.db2.gz QEOMQLWDJQDCBK-IRXDYDNUSA-N 1 1 410.547 3.075 20 0 HGADMO CC[NH+](CC)Cc1nc2sc(C)c(C)c2c(N2CC[C@H]3[C@@H]2CCC(=O)N3C)n1 ZINC001164932383 721893365 /nfs/dbraw/zinc/89/33/65/721893365.db2.gz HJGHZMZKCKJHDM-HOTGVXAUSA-N 1 1 401.580 3.349 20 0 HGADMO Cc1sc2nc(C[NH+]3CCCCC3)nc(N3CC[C@H]4[C@H]3CCC(=O)N4C)c2c1C ZINC001164930041 721893432 /nfs/dbraw/zinc/89/34/32/721893432.db2.gz BHINBPYVTBNCRP-DLBZAZTESA-N 1 1 413.591 3.494 20 0 HGADMO Cc1ccc(C[N@H+]2CCOC3(CCN(c4ncnc5c4[C@@H](C)CC(=O)N5)CC3)C2)cc1 ZINC001164940432 721926649 /nfs/dbraw/zinc/92/66/49/721926649.db2.gz QFNZEBNPNYXGMA-SFHVURJKSA-N 1 1 421.545 3.102 20 0 HGADMO Cc1ccc(C[N@H+]2CCOC3(CCN(c4nc(C(C)C)nc(N(C)C)n4)CC3)C2)cc1 ZINC001164940054 721927921 /nfs/dbraw/zinc/92/79/21/721927921.db2.gz PXHJIYXPUHQONW-UHFFFAOYSA-N 1 1 424.593 3.241 20 0 HGADMO Cc1ccc(C[N@H+]2CCOC3(CCN(c4cc(-c5nnco5)ccn4)CC3)C2)cc1 ZINC001164940604 721932121 /nfs/dbraw/zinc/93/21/21/721932121.db2.gz UQLUXIKJYWKPFX-UHFFFAOYSA-N 1 1 405.502 3.311 20 0 HGADMO O=C1NCC[N@@H+](Cc2ccccc2)C12CCN(c1ccc3ccc(F)cc3n1)CC2 ZINC001164948254 721979095 /nfs/dbraw/zinc/97/90/95/721979095.db2.gz KFPZNHGWLDYWEU-UHFFFAOYSA-N 1 1 404.489 3.345 20 0 HGADMO O=C1NCC[N@H+](Cc2ccccc2)C12CCN(c1ccc3ccc(F)cc3n1)CC2 ZINC001164948254 721979097 /nfs/dbraw/zinc/97/90/97/721979097.db2.gz KFPZNHGWLDYWEU-UHFFFAOYSA-N 1 1 404.489 3.345 20 0 HGADMO CCc1nc2sccc2c(N2CCC3(CC2)C(=O)NCC[N@H+]3Cc2ccccc2)n1 ZINC001164950423 721980270 /nfs/dbraw/zinc/98/02/70/721980270.db2.gz UAUQBWORCJMZQB-UHFFFAOYSA-N 1 1 421.570 3.225 20 0 HGADMO CCc1nc2sccc2c(N2CCC3(CC2)C(=O)NCC[N@@H+]3Cc2ccccc2)n1 ZINC001164950423 721980271 /nfs/dbraw/zinc/98/02/71/721980271.db2.gz UAUQBWORCJMZQB-UHFFFAOYSA-N 1 1 421.570 3.225 20 0 HGADMO C[C@@H]1CCc2c(sc3nc(C[NH+]4CCCC4)nc(N4CCNC(=O)C4(C)C)c32)C1 ZINC001165052063 721995031 /nfs/dbraw/zinc/99/50/31/721995031.db2.gz QNNFEBUDCMZNRT-CQSZACIVSA-N 1 1 413.591 3.127 20 0 HGADMO COC(=O)/C=C/c1cc(C)cnc1N1CCC2(CC[N@@H+](Cc3cccnc3)C2)CC1 ZINC001164955833 722020661 /nfs/dbraw/zinc/02/06/61/722020661.db2.gz OJVZHOWOHCRHBE-AATRIKPKSA-N 1 1 406.530 3.464 20 0 HGADMO FC(F)(c1cc(Cl)ncn1)N1CCC2(CC1)COCC[N@@H+](Cc1ccncc1)C2 ZINC001164961156 722051702 /nfs/dbraw/zinc/05/17/02/722051702.db2.gz SPZXZIXOERJVAX-UHFFFAOYSA-N 1 1 423.895 3.189 20 0 HGADMO CCc1ncnc(Cl)c1N1CCC2(CC1)COCC[N@@H+](Cc1ccncc1)C2 ZINC001164961917 722052952 /nfs/dbraw/zinc/05/29/52/722052952.db2.gz YPSRDKNGMMNGPR-UHFFFAOYSA-N 1 1 401.942 3.206 20 0 HGADMO CSc1ncc(Cl)c(N2CCC3(CC2)COCC[N@@H+](Cc2ccncc2)C3)n1 ZINC001164961174 722053266 /nfs/dbraw/zinc/05/32/66/722053266.db2.gz UGJHODNNPBTURH-UHFFFAOYSA-N 1 1 419.982 3.366 20 0 HGADMO COc1cccc2c1ncnc2N1CCC2(CC1)COCC[N@@H+](Cc1ccncc1)C2 ZINC001164960509 722053870 /nfs/dbraw/zinc/05/38/70/722053870.db2.gz QKSMGUICMBXTFP-UHFFFAOYSA-N 1 1 419.529 3.152 20 0 HGADMO Cc1cccc2c1ncnc2N1CCC2(CC1)COCC[N@@H+](Cc1ccncc1)C2 ZINC001164958791 722054167 /nfs/dbraw/zinc/05/41/67/722054167.db2.gz GJCXPLIGGJNRQU-UHFFFAOYSA-N 1 1 403.530 3.452 20 0 HGADMO c1coc(-c2cnc(N3CCC4(CC3)COCC[N@H+](Cc3ccncc3)C4)cn2)c1 ZINC001164962171 722055048 /nfs/dbraw/zinc/05/50/48/722055048.db2.gz ACTWRAGXUFUDIR-UHFFFAOYSA-N 1 1 405.502 3.251 20 0 HGADMO Cc1cccc2ncc(N3CCC4(CC3)COCC[N@@H+](Cc3ccncc3)C4)nc12 ZINC001164962986 722055190 /nfs/dbraw/zinc/05/51/90/722055190.db2.gz GNDKQJFUCHRANC-UHFFFAOYSA-N 1 1 403.530 3.452 20 0 HGADMO Clc1cc(N2CCC3(CC2)COCC[N@@H+](Cc2ccncc2)C3)c2[nH]cnc2n1 ZINC001164962220 722055203 /nfs/dbraw/zinc/05/52/03/722055203.db2.gz BOCAKIJQVGBUOQ-UHFFFAOYSA-N 1 1 412.925 3.125 20 0 HGADMO Clc1cc(N2CCC3(CC2)COCC[N@H+](Cc2ccncc2)C3)c2nc[nH]c2n1 ZINC001164962220 722055206 /nfs/dbraw/zinc/05/52/06/722055206.db2.gz BOCAKIJQVGBUOQ-UHFFFAOYSA-N 1 1 412.925 3.125 20 0 HGADMO Clc1cc(N2CCC3(CC2)COCC[N@@H+](Cc2ccncc2)C3)c2nc[nH]c2n1 ZINC001164962220 722055209 /nfs/dbraw/zinc/05/52/09/722055209.db2.gz BOCAKIJQVGBUOQ-UHFFFAOYSA-N 1 1 412.925 3.125 20 0 HGADMO COc1ccc(Cl)nc1N1CCC2(CC1)COCC[N@@H+](Cc1ccncc1)C2 ZINC001164963872 722056930 /nfs/dbraw/zinc/05/69/30/722056930.db2.gz PBRWLVQVYHAAAF-UHFFFAOYSA-N 1 1 402.926 3.258 20 0 HGADMO COc1nc(N2CCC3(CC2)COCC[N@@H+](Cc2ccncc2)C3)nc2ccccc21 ZINC001164963263 722057162 /nfs/dbraw/zinc/05/71/62/722057162.db2.gz KIMPQAMLZJBCAK-UHFFFAOYSA-N 1 1 419.529 3.152 20 0 HGADMO Clc1ccc2nc(N3CCC4(CC3)COCC[N@@H+](Cc3ccncc3)C4)[nH]c2n1 ZINC001164961492 722059002 /nfs/dbraw/zinc/05/90/02/722059002.db2.gz KUFVNHCONJPDAG-UHFFFAOYSA-N 1 1 412.925 3.125 20 0 HGADMO C[C@@H]1CCc2nnc(N3CCC4(CC3)COCC[N@@H+](Cc3ccncc3)C4)cc2C1 ZINC001164963414 722061249 /nfs/dbraw/zinc/06/12/49/722061249.db2.gz YXRNNFUXPHZSIG-LJQANCHMSA-N 1 1 407.562 3.115 20 0 HGADMO Cc1cc2ccncc2nc1N1CCC2(CC1)COCC[N@@H+](Cc1ccncc1)C2 ZINC001164962214 722061492 /nfs/dbraw/zinc/06/14/92/722061492.db2.gz QEJFFKQKQNXAFU-UHFFFAOYSA-N 1 1 403.530 3.452 20 0 HGADMO O=C(c1cscn1)N1CC[C@H]2[C@H]1CCN2c1nc(Cl)ccc1C[NH+]1CCCC1 ZINC001164964508 722064793 /nfs/dbraw/zinc/06/47/93/722064793.db2.gz HEWDDTAYNGJUMG-DLBZAZTESA-N 1 1 417.966 3.281 20 0 HGADMO FC(F)(c1cc(Cl)nc(-c2ccccn2)n1)N1C[C@@H]2C[N@@H+](CC3CC3)C[C@H](C1)O2 ZINC001164967761 722076120 /nfs/dbraw/zinc/07/61/20/722076120.db2.gz VHKRESKKGZWXGU-GASCZTMLSA-N 1 1 421.879 3.036 20 0 HGADMO FC(F)(c1cc(Cl)nc(-c2ccccn2)n1)N1C[C@@H]2C[N@H+](CC3CC3)C[C@H](C1)O2 ZINC001164967761 722076121 /nfs/dbraw/zinc/07/61/21/722076121.db2.gz VHKRESKKGZWXGU-GASCZTMLSA-N 1 1 421.879 3.036 20 0 HGADMO FC(F)(c1cccnc1Cl)N1CC[C@H]2C[N@@H+](Cc3cccnc3)CCO[C@@H]2C1 ZINC001164981250 722100272 /nfs/dbraw/zinc/10/02/72/722100272.db2.gz KSMZERJUJOJRAY-FUHWJXTLSA-N 1 1 408.880 3.402 20 0 HGADMO Clc1cccc2c1ncnc2N1CC[C@H]2C[N@@H+](Cc3cccnc3)CCO[C@H]2C1 ZINC001164981607 722106279 /nfs/dbraw/zinc/10/62/79/722106279.db2.gz LTMDNGATOPXPNO-PXNSSMCTSA-N 1 1 409.921 3.406 20 0 HGADMO COc1ccc2c(ccnc2N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)c1 ZINC001164979913 722107232 /nfs/dbraw/zinc/10/72/32/722107232.db2.gz IIQFCPSQKZJBAM-NFBKMPQASA-N 1 1 404.514 3.366 20 0 HGADMO Clc1cc2ccnc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)c2cn1 ZINC001164982177 722109515 /nfs/dbraw/zinc/10/95/15/722109515.db2.gz WCYNLUCMQOMAMA-ICSRJNTNSA-N 1 1 409.921 3.406 20 0 HGADMO Clc1ccc2nc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)cnc2c1 ZINC001164975666 722110802 /nfs/dbraw/zinc/11/08/02/722110802.db2.gz KEQIMXURVIJJDY-UWJYYQICSA-N 1 1 409.921 3.406 20 0 HGADMO Clc1nnc(N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)c2c1CCCC2 ZINC001164970858 722112686 /nfs/dbraw/zinc/11/26/86/722112686.db2.gz AAQIZFWVPWVFFF-FXAWDEMLSA-N 1 1 413.953 3.131 20 0 HGADMO Clc1ccnc2cc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)ncc12 ZINC001164971855 722113714 /nfs/dbraw/zinc/11/37/14/722113714.db2.gz CRRZQASFVTUBEB-LAUBAEHRSA-N 1 1 409.921 3.406 20 0 HGADMO CCc1cc2c(ncnc2N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)s1 ZINC001164977405 722115548 /nfs/dbraw/zinc/11/55/48/722115548.db2.gz NASISJQHKTZNKT-YLJYHZDGSA-N 1 1 409.559 3.376 20 0 HGADMO CCc1c(Cl)nnc(N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)c1CC ZINC001164980415 722119939 /nfs/dbraw/zinc/11/99/39/722119939.db2.gz RDBQBYGFHZKXFF-YLJYHZDGSA-N 1 1 415.969 3.377 20 0 HGADMO Clc1ccc2c(cnnc2N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)c1 ZINC001164981164 722121208 /nfs/dbraw/zinc/12/12/08/722121208.db2.gz TZMGALLBHGFTCJ-DYESRHJHSA-N 1 1 409.921 3.406 20 0 HGADMO CSc1nc2ccccc2c(N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)n1 ZINC001164980581 722123453 /nfs/dbraw/zinc/12/34/53/722123453.db2.gz RWFXNBCZRWHGTK-WIYYLYMNSA-N 1 1 421.570 3.474 20 0 HGADMO COc1ccc2cnc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)cc2c1 ZINC001164980967 722132390 /nfs/dbraw/zinc/13/23/90/722132390.db2.gz OGLNRLBBEMEMMR-REWPJTCUSA-N 1 1 404.514 3.366 20 0 HGADMO COc1ccc2nc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)c(C)nc2c1 ZINC001164976069 722146645 /nfs/dbraw/zinc/14/66/45/722146645.db2.gz GYARHEFXVSRBGM-CVDCTZTESA-N 1 1 419.529 3.069 20 0 HGADMO COc1ccc2nc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)c(C)nc2c1 ZINC001164976070 722146699 /nfs/dbraw/zinc/14/66/99/722146699.db2.gz GYARHEFXVSRBGM-WMZHIEFXSA-N 1 1 419.529 3.069 20 0 HGADMO Fc1cccc(-c2ccc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)nn2)c1 ZINC001164985005 722148172 /nfs/dbraw/zinc/14/81/72/722148172.db2.gz YTHHGKZPGLHLBO-OFNKIYASSA-N 1 1 419.504 3.405 20 0 HGADMO c1ccc(Oc2nccnc2N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)cc1 ZINC001164985064 722150139 /nfs/dbraw/zinc/15/01/39/722150139.db2.gz ZBHOIRAUXMTCAV-IRLDBZIGSA-N 1 1 417.513 3.391 20 0 HGADMO CCOC(=O)c1cnc(OC)nc1N1CCC[C@]2(CC[N@H+]2Cc2cccc(F)c2)C1 ZINC001164995118 722198215 /nfs/dbraw/zinc/19/82/15/722198215.db2.gz RSYWPKAHBJCSMD-QFIPXVFZSA-N 1 1 414.481 3.046 20 0 HGADMO Cc1ccc2c(c1)cc(Cl)nc2N1CCc2ncnc(N3CC[NH+](C)CC3)c2CC1 ZINC001164996626 722236116 /nfs/dbraw/zinc/23/61/16/722236116.db2.gz HHQAICDQQDLNIO-UHFFFAOYSA-N 1 1 422.964 3.344 20 0 HGADMO OCC1([NH2+]Cc2nc(-c3ccc(Br)s3)no2)Cc2ccccc2C1 ZINC000512330892 1126095611 /nfs/dbraw/zinc/09/56/11/1126095611.db2.gz VPHIGEXLUONXBR-UHFFFAOYSA-N 1 1 406.305 3.180 20 0 HGADMO CCOC(=O)[C@]12C[C@H]1CCN2c1nc(C[NH+]2CCCC2)nc2sc(C)c(C)c21 ZINC001164624112 719041431 /nfs/dbraw/zinc/04/14/31/719041431.db2.gz NZDMASFBNWILNO-VFNWGFHPSA-N 1 1 400.548 3.436 20 0 HGADMO CCOC(=O)c1nc2ccn(C)c2c(N2CCC[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)n1 ZINC001164632395 719092167 /nfs/dbraw/zinc/09/21/67/719092167.db2.gz ZITVRGGHCKFFAV-AZUAARDMSA-N 1 1 419.529 3.246 20 0 HGADMO CCCNC(=O)c1cc(Cl)nc(N2CCC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)n1 ZINC001164621883 719114209 /nfs/dbraw/zinc/11/42/09/719114209.db2.gz BJZRICKTUAKMRS-MJGOQNOKSA-N 1 1 413.953 3.371 20 0 HGADMO Cc1noc([C@@H]2C[C@H]3CCN(c4nc(Cl)ccc4C[NH+]4CCCC4)C[C@H]3O2)n1 ZINC001164648045 719299739 /nfs/dbraw/zinc/29/97/39/719299739.db2.gz FQIOFNKJKNQWOY-HYVNUMGLSA-N 1 1 403.914 3.379 20 0 HGADMO CCOC(=O)c1nc(N2CCc3c(C[NH+](C)C)nn(C(C)C)c3C2)ccc1Cl ZINC001164651047 719314239 /nfs/dbraw/zinc/31/42/39/719314239.db2.gz HCXUJYCREQCHFE-UHFFFAOYSA-N 1 1 405.930 3.313 20 0 HGADMO CN(C[C@H](O)CO)c1nc(C[NH+]2CCCCC2)nc2scc(-c3cccs3)c21 ZINC001164672620 719366346 /nfs/dbraw/zinc/36/63/46/719366346.db2.gz ZFCUZRFZJURFAY-AWEZNQCLSA-N 1 1 418.588 3.195 20 0 HGADMO C[N@H+]1CCO[C@H]2CN(c3nc(Cl)nc(-c4ccc(-c5ccccc5)cc4)n3)C[C@H]21 ZINC001164669310 719394757 /nfs/dbraw/zinc/39/47/57/719394757.db2.gz URFGRJWHWVRFHQ-MOPGFXCFSA-N 1 1 407.905 3.378 20 0 HGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2C[C@@H](C(=O)N3CC=CC3)C3(C2)CCOCC3)nc1 ZINC001164678178 719561468 /nfs/dbraw/zinc/56/14/68/719561468.db2.gz VVKOSLJOMUPVES-FCHUYYIVSA-N 1 1 424.589 3.260 20 0 HGADMO CNC(=O)C[N@H+]1CCCC12CCN(C(F)(F)c1cnc(Cl)c(Cl)c1)CC2 ZINC001164686334 719700832 /nfs/dbraw/zinc/70/08/32/719700832.db2.gz ZVKKSBABPZNARI-UHFFFAOYSA-N 1 1 407.292 3.114 20 0 HGADMO COC(=O)[C@@]1(C)C[C@@H]([NH+]2CCOCC2)CCN1c1cc(Cl)nc2ccccc21 ZINC001164702646 719837687 /nfs/dbraw/zinc/83/76/87/719837687.db2.gz OLGDVLIBZISAGB-YCRPNKLZSA-N 1 1 403.910 3.121 20 0 HGADMO COC(=O)[C@@]1(C)C[C@H]([NH+]2CCOCC2)CCN1c1nc(Cl)cc2ccc(F)cc21 ZINC001164699337 719847314 /nfs/dbraw/zinc/84/73/14/719847314.db2.gz HMPGNGNQYSQDMH-IIBYNOLFSA-N 1 1 421.900 3.260 20 0 HGADMO COC(=O)[C@@]1(C)C[C@H]([NH+]2CCOCC2)CCN1c1nccc2cccc(Cl)c21 ZINC001164700175 719856305 /nfs/dbraw/zinc/85/63/05/719856305.db2.gz HAZLPADUYGDIRG-IIBYNOLFSA-N 1 1 403.910 3.121 20 0 HGADMO COC(=O)c1cc(N2CCC3(CC2)C[N@@H+](Cc2cccs2)CCO3)ncc1C ZINC001164697678 719894121 /nfs/dbraw/zinc/89/41/21/719894121.db2.gz NLASGWQLVOCOBF-UHFFFAOYSA-N 1 1 401.532 3.110 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1cc(C(=O)OC(C)(C)C)ccn1)C2 ZINC001164811293 720082623 /nfs/dbraw/zinc/08/26/23/720082623.db2.gz NSLSEFQSRJTTHA-XXBNENTESA-N 1 1 401.551 3.222 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(C(F)(F)c1cc(Cl)nc(C)n1)C2 ZINC001164808530 720086493 /nfs/dbraw/zinc/08/64/93/720086493.db2.gz HWDMRYAKEDOSMB-QAPCUYQASA-N 1 1 400.901 3.168 20 0 HGADMO COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1ncnc3[nH]cc(C)c31)CC2 ZINC001164710023 720093434 /nfs/dbraw/zinc/09/34/34/720093434.db2.gz FQTXASCLBOPQCU-IBGZPJMESA-N 1 1 406.534 3.169 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(C(F)(F)Oc1cccc(Cl)n1)C2 ZINC001164809786 720094834 /nfs/dbraw/zinc/09/48/34/720094834.db2.gz KHDJNIOQLURODM-MAUKXSAKSA-N 1 1 401.885 3.344 20 0 HGADMO COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1nc(Cl)ncc1F)CC2 ZINC001164709950 720095687 /nfs/dbraw/zinc/09/56/87/720095687.db2.gz DCCHSMPUHRNDHS-MRXNPFEDSA-N 1 1 405.905 3.172 20 0 HGADMO CCOC(=O)c1c(C)cc(Cl)nc1N1CC[C@]2(C1)C[N@@H+](CC1CC1)C[C@@H]2COC ZINC001164813579 720098554 /nfs/dbraw/zinc/09/85/54/720098554.db2.gz TXELZFTYAJFBAW-VGOFRKELSA-N 1 1 421.969 3.405 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1nc3ccc(OC)cc3nc1Cl)C2 ZINC001164810675 720102314 /nfs/dbraw/zinc/10/23/14/720102314.db2.gz KOLFTNVDDGFFGJ-OPAMFIHVSA-N 1 1 416.953 3.477 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1nccc(OCc3ccccc3)n1)C2 ZINC001164808618 720113285 /nfs/dbraw/zinc/11/32/85/720113285.db2.gz FWDWISWXQAFTJD-URXFXBBRSA-N 1 1 408.546 3.240 20 0 HGADMO COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1ncc(Cl)nc1C)CC2 ZINC001164715463 720122022 /nfs/dbraw/zinc/12/20/22/720122022.db2.gz FXRZOHCLMGONLT-SFHVURJKSA-N 1 1 401.942 3.341 20 0 HGADMO CCOC(=O)c1cnc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COC)c(Cl)c1 ZINC001164808509 720122071 /nfs/dbraw/zinc/12/20/71/720122071.db2.gz FKFOJGMULNEVJF-LAUBAEHRSA-N 1 1 407.942 3.096 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1nccc(-c3cccc(OC)c3)n1)C2 ZINC001164807060 720145128 /nfs/dbraw/zinc/14/51/28/720145128.db2.gz AXCQWWNPRPRCHH-YKSBVNFPSA-N 1 1 408.546 3.337 20 0 HGADMO CCCN(CCC)c1cncc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COC)n1 ZINC001164813814 720146206 /nfs/dbraw/zinc/14/62/06/720146206.db2.gz QYQVPDPMMDPTJX-OFNKIYASSA-N 1 1 401.599 3.288 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(C(F)(F)c1cc(Cl)nc(=S)[nH]1)C2 ZINC001164818136 720152657 /nfs/dbraw/zinc/15/26/57/720152657.db2.gz RVGKBGYROHHJPD-SUMWQHHRSA-N 1 1 418.941 3.148 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1nc(-c3ccncc3)nc3c1CCC3)C2 ZINC001164816673 720185590 /nfs/dbraw/zinc/18/55/90/720185590.db2.gz MAXMQSMYMWRVPH-NBGIEHNGSA-N 1 1 419.573 3.212 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1ncc(C(N)=S)c3ccsc31)C2 ZINC001164814644 720203121 /nfs/dbraw/zinc/20/31/21/720203121.db2.gz VPALYQLZGVNIOY-YCRPNKLZSA-N 1 1 416.616 3.115 20 0 HGADMO CC(C)[N@@H+](C)Cc1cc(=O)n2c(n1)CN(c1cc(-c3cccs3)ncn1)CCC2 ZINC001164814548 720239162 /nfs/dbraw/zinc/23/91/62/720239162.db2.gz XVNSRGJQVNMYCV-UHFFFAOYSA-N 1 1 410.547 3.012 20 0 HGADMO COc1cccc2c1ccnc2N1CCCn2c(=O)cc(C[N@@H+](C)C(C)C)nc2C1 ZINC001164814535 720240306 /nfs/dbraw/zinc/24/03/06/720240306.db2.gz XJAILAXFYHDTQY-UHFFFAOYSA-N 1 1 407.518 3.051 20 0 HGADMO CCOC(=O)c1c(Cl)cc(C)nc1N1CC[C@H]2[C@@H]1CC[N@H+]2Cc1cccnc1 ZINC001164722999 720335565 /nfs/dbraw/zinc/33/55/65/720335565.db2.gz GQIVMBLBTQYXEY-ROUUACIJSA-N 1 1 400.910 3.468 20 0 HGADMO CCOC(=O)c1c(Cl)cc(C)nc1N1CC[C@@H]2[C@@H]1CC[N@H+]2Cc1cccnc1 ZINC001164722990 720335925 /nfs/dbraw/zinc/33/59/25/720335925.db2.gz GQIVMBLBTQYXEY-MSOLQXFVSA-N 1 1 400.910 3.468 20 0 HGADMO O=C(NC1CCCCC1)c1cccnc1N1CC[C@H]2[C@@H]1CC[N@H+]2Cc1cccnc1 ZINC001164721718 720341386 /nfs/dbraw/zinc/34/13/86/720341386.db2.gz DBXPIXKMWKATFP-VXKWHMMOSA-N 1 1 405.546 3.392 20 0 HGADMO CCOC(=O)c1ccc2ncnc(N3CC[C@@H]4[C@H]3CC[N@H+]4Cc3cccnc3)c2c1 ZINC001164725351 720385424 /nfs/dbraw/zinc/38/54/24/720385424.db2.gz MTGQAMCJLNXUQJ-NHCUHLMSSA-N 1 1 403.486 3.055 20 0 HGADMO COC(=O)c1ccc2c(c1)nc(Cl)nc2N1CC[C@H]2[C@H]1CC[N@H+]2Cc1cccnc1 ZINC001164727062 720387342 /nfs/dbraw/zinc/38/73/42/720387342.db2.gz QFEAVNREQVDLBY-RBUKOAKNSA-N 1 1 423.904 3.318 20 0 HGADMO CCOC(=O)c1cnc(Cl)c(C)c1N1CC[C@@H]2[C@H]1CC[N@H+]2Cc1cccnc1 ZINC001164725095 720395934 /nfs/dbraw/zinc/39/59/34/720395934.db2.gz LUOQWKBVQOCSIB-QZTJIDSGSA-N 1 1 400.910 3.468 20 0 HGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2C[C@@H]3COC[C@H](CC(=O)NC(C)C)[C@@H]3C2)nc1 ZINC001164827199 720424044 /nfs/dbraw/zinc/42/40/44/720424044.db2.gz RSKNOZVCWKERNL-LNRXMEIDSA-N 1 1 414.594 3.242 20 0 HGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@@H]2CN(C(F)(F)c3ccnc(Cl)n3)CC[C@@H]21 ZINC001164839385 720505345 /nfs/dbraw/zinc/50/53/45/720505345.db2.gz TUHGOMUZRBWWQR-PMPSAXMXSA-N 1 1 410.900 3.249 20 0 HGADMO CC(C)[N@@H+]1[C@@H]2CCN(C(F)(F)c3cnc(Cl)cn3)C[C@H]2C[C@H]1Cn1cccn1 ZINC001164832977 720513974 /nfs/dbraw/zinc/51/39/74/720513974.db2.gz CEWQGSAJTCUYOG-OWCLPIDISA-N 1 1 410.900 3.249 20 0 HGADMO COc1ccc2c(c1)ncnc2N1CC[C@@H]2[C@H](C[C@H](Cn3cccn3)[N@H+]2C(C)C)C1 ZINC001164834946 720545577 /nfs/dbraw/zinc/54/55/77/720545577.db2.gz GBBVRBIWDZQQKT-JBYIUTFZSA-N 1 1 406.534 3.213 20 0 HGADMO CCOC(=O)c1cc(C)cnc1N1CC[C@@H]2[C@H](C[C@H](Cn3cccn3)[N@H+]2C(C)C)C1 ZINC001164836338 720546759 /nfs/dbraw/zinc/54/67/59/720546759.db2.gz JOUUFMOOWKPKOS-SFHLNBCPSA-N 1 1 411.550 3.141 20 0 HGADMO CC(C)[N@@H+]1[C@@H]2CCN(C(F)(F)c3cnc(Cl)cc3N)C[C@H]2C[C@H]1Cn1cccn1 ZINC001164840201 720549433 /nfs/dbraw/zinc/54/94/33/720549433.db2.gz SDGQDIZVPZFYRM-RVKKMQEKSA-N 1 1 424.927 3.436 20 0 HGADMO CC(C)[N@@H+]1[C@@H]2CCN(C(F)(F)c3cnc(Cl)cc3N)C[C@@H]2C[C@H]1Cn1cccn1 ZINC001164840200 720550142 /nfs/dbraw/zinc/55/01/42/720550142.db2.gz SDGQDIZVPZFYRM-RLFYNMQTSA-N 1 1 424.927 3.436 20 0 HGADMO COc1ccc2nc(N3CC[C@@H]4[C@@H](C[C@H](Cn5cccn5)[N@H+]4C(C)C)C3)ncc2c1 ZINC001164836404 720550575 /nfs/dbraw/zinc/55/05/75/720550575.db2.gz JYYXVOAQRPWTIF-NNMXDRDESA-N 1 1 406.534 3.213 20 0 HGADMO COc1nc(N2CC[C@@H]3[C@H](C[C@H](Cn4cccn4)[N@H+]3C(C)C)C2)nc2ccccc21 ZINC001164833628 720557825 /nfs/dbraw/zinc/55/78/25/720557825.db2.gz AYPQMDKMTCWTHR-DBXWQHBBSA-N 1 1 406.534 3.213 20 0 HGADMO CC(C)[N@@H+]1[C@@H]2CCN(C(F)(F)c3cncc(Cl)n3)C[C@@H]2C[C@H]1Cn1cccn1 ZINC001164842230 720580979 /nfs/dbraw/zinc/58/09/79/720580979.db2.gz UUZXTVAPUVNWGE-HRCADAONSA-N 1 1 410.900 3.249 20 0 HGADMO Cc1cc(N2CC[C@@H]3[C@H](C[C@@H](Cn4cccn4)[N@@H+]3C(C)C)C2)nc(-c2ccccn2)n1 ZINC001164840084 720600414 /nfs/dbraw/zinc/60/04/14/720600414.db2.gz OYIPLXHYBHHWRZ-RZUBCFFCSA-N 1 1 417.561 3.421 20 0 HGADMO CC(C)[N@H+]1[C@@H](Cn2cccn2)C[C@@H]2CN(c3ccc(N4CCC(C)CC4)nn3)CC[C@H]21 ZINC001164840081 720607425 /nfs/dbraw/zinc/60/74/25/720607425.db2.gz OWSHSJWKXXCATJ-YPAWHYETSA-N 1 1 423.609 3.287 20 0 HGADMO FC(F)(c1ccc(Cl)nc1Cl)N1CC[N@@H+]2C[C@@H](Oc3cncnc3)C[C@H]2C1 ZINC001164744268 720617684 /nfs/dbraw/zinc/61/76/84/720617684.db2.gz QXJAFYQDTRUSQT-RYUDHWBXSA-N 1 1 416.259 3.065 20 0 HGADMO FC(F)(c1ccc(Cl)nc1Cl)N1CC[N@H+]2C[C@@H](Oc3cncnc3)C[C@H]2C1 ZINC001164744268 720617707 /nfs/dbraw/zinc/61/77/07/720617707.db2.gz QXJAFYQDTRUSQT-RYUDHWBXSA-N 1 1 416.259 3.065 20 0 HGADMO FC(F)(c1cnc(Cl)cc1Cl)N1CC[N@@H+]2C[C@H](Oc3cncnc3)C[C@@H]2C1 ZINC001164743804 720628848 /nfs/dbraw/zinc/62/88/48/720628848.db2.gz QTZZDPNKCNTZBM-VXGBXAGGSA-N 1 1 416.259 3.065 20 0 HGADMO FC(F)(c1cnc(Cl)cc1Cl)N1CC[N@H+]2C[C@H](Oc3cncnc3)C[C@@H]2C1 ZINC001164743804 720628849 /nfs/dbraw/zinc/62/88/49/720628849.db2.gz QTZZDPNKCNTZBM-VXGBXAGGSA-N 1 1 416.259 3.065 20 0 HGADMO COC(=O)c1cc(F)cnc1N1CCC2(C[C@H]([N@@H+](C)Cc3ccccc3)CO2)CC1 ZINC001164840550 720664556 /nfs/dbraw/zinc/66/45/56/720664556.db2.gz NKJZSJDACJBSRB-IBGZPJMESA-N 1 1 413.493 3.267 20 0 HGADMO Clc1cnc2cc(Cl)c(N3CC[N@H+]4C[C@@H](Oc5cncnc5)C[C@H]4C3)cc2n1 ZINC001164740621 720679603 /nfs/dbraw/zinc/67/96/03/720679603.db2.gz RCTOBJARSGODIU-STQMWFEESA-N 1 1 417.300 3.069 20 0 HGADMO C[C@H]1CC(=O)Nc2ncnc(N3CCC4(C[C@H]([N@@H+](C)Cc5ccccc5)CO4)CC3)c21 ZINC001164844807 720692913 /nfs/dbraw/zinc/69/29/13/720692913.db2.gz UYWHCMMPNDCFPX-HKUYNNGSSA-N 1 1 421.545 3.182 20 0 HGADMO C[N@H+](Cc1ccccc1)[C@H]1COC2(C1)CCN(c1cccc(N3CCOCC3)n1)CC2 ZINC001164837030 720704776 /nfs/dbraw/zinc/70/47/76/720704776.db2.gz CXHBEIFVWQNXQY-JOCHJYFZSA-N 1 1 422.573 3.178 20 0 HGADMO C[N@@H+](Cc1ccccc1)[C@H]1COC2(C1)CCN(c1cccc(N3CCOCC3)n1)CC2 ZINC001164837030 720704779 /nfs/dbraw/zinc/70/47/79/720704779.db2.gz CXHBEIFVWQNXQY-JOCHJYFZSA-N 1 1 422.573 3.178 20 0 HGADMO C[N@@H+](Cc1ccccc1)[C@@H]1COC2(C1)CCN(c1ncnc3c1ncn3C1CC1)CC2 ZINC001164839809 720714706 /nfs/dbraw/zinc/71/47/06/720714706.db2.gz NFCWMIAFGSUYSI-FQEVSTJZSA-N 1 1 418.545 3.421 20 0 HGADMO CCOC(=O)Cc1ccnc(N2CCC3(C[C@H]([N@@H+](C)Cc4ccccc4)CO3)CC2)c1 ZINC001164836916 720727992 /nfs/dbraw/zinc/72/79/92/720727992.db2.gz BVKUADJDPCCYRP-QFIPXVFZSA-N 1 1 423.557 3.447 20 0 HGADMO Cc1csc2c1nc(Cl)cc2N1CC[N@H+]2C[C@@H](Oc3cncnc3)C[C@H]2C1 ZINC001164737872 720735420 /nfs/dbraw/zinc/73/54/20/720735420.db2.gz DDLBAHAXKDIQAH-KBPBESRZSA-N 1 1 401.923 3.390 20 0 HGADMO CC(C)(C)c1cc(N2CC[N@H+]3C[C@H](Oc4cncnc4)C[C@H]3C2)nc(C(C)(C)C)n1 ZINC001164737238 720756149 /nfs/dbraw/zinc/75/61/49/720756149.db2.gz BGXXWHTZJITIKF-DLBZAZTESA-N 1 1 410.566 3.204 20 0 HGADMO c1ccc2c(c1)cccc2-c1ccc(N2CC[N@@H+]3C[C@H](Oc4cncnc4)C[C@@H]3C2)nn1 ZINC001164742941 720784846 /nfs/dbraw/zinc/78/48/46/720784846.db2.gz PQYOINHLSFGUGW-WOJBJXKFSA-N 1 1 424.508 3.429 20 0 HGADMO Clc1cc(C2CCCCC2)nc(N2CC[N@H+]3C[C@H](Oc4cncnc4)C[C@H]3C2)n1 ZINC001164752825 720802230 /nfs/dbraw/zinc/80/22/30/720802230.db2.gz ZZZIKJIITDDGBR-DLBZAZTESA-N 1 1 414.941 3.310 20 0 HGADMO FC(F)(c1ccc(Cl)nc1)N1CC[C@@H]2[C@@H](C[C@@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164743353 720808027 /nfs/dbraw/zinc/80/80/27/720808027.db2.gz FHWNOGKGTNNKPC-RYQLBKOJSA-N 1 1 422.911 3.251 20 0 HGADMO FC(F)(c1ccc(Cl)nc1)N1CC[C@@H]2[C@@H](C[C@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164743351 720808177 /nfs/dbraw/zinc/80/81/77/720808177.db2.gz FHWNOGKGTNNKPC-CGTJXYLNSA-N 1 1 422.911 3.251 20 0 HGADMO COc1cccc2ccc(N3CC[C@@H]4[C@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)nc21 ZINC001164745101 720819248 /nfs/dbraw/zinc/81/92/48/720819248.db2.gz WFDIWMILOGYTAT-QHAWAJNXSA-N 1 1 418.545 3.214 20 0 HGADMO Clc1cc2ccnc(N3CC[C@@H]4[C@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)c2cn1 ZINC001164738453 720822184 /nfs/dbraw/zinc/82/21/84/720822184.db2.gz FWHHSZVUHFEUTJ-WSTZPKSXSA-N 1 1 423.952 3.254 20 0 HGADMO COc1ccc2nc(N3CC[C@@H]4[C@@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)ccc2c1 ZINC001164743295 720822212 /nfs/dbraw/zinc/82/22/12/720822212.db2.gz RYCHOCSVWXXLHA-SXWKCWPCSA-N 1 1 418.545 3.214 20 0 HGADMO CCc1cc2c(ncnc2N2CC[C@@H]3[C@H](C[C@H](Cn4cncn4)[N@H+]3CC3CC3)C2)s1 ZINC001164743807 720827418 /nfs/dbraw/zinc/82/74/18/720827418.db2.gz SKLUWRKWOTVOAH-MBOZVWFJSA-N 1 1 423.590 3.225 20 0 HGADMO Clc1ccnc2cnc(N3CC[C@@H]4[C@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)cc12 ZINC001164745883 720836112 /nfs/dbraw/zinc/83/61/12/720836112.db2.gz OBUJDQDTPHFAOG-LLGFUMIMSA-N 1 1 423.952 3.254 20 0 HGADMO c1csc(-c2ccc(N3CC[C@@H]4[C@H](C[C@H](Cn5cncn5)[N@@H+]4CC4CC4)C3)nn2)c1 ZINC001164751125 720836258 /nfs/dbraw/zinc/83/62/58/720836258.db2.gz YNPRRLRFRVPDRM-QWFCFKBJSA-N 1 1 421.574 3.176 20 0 HGADMO COCC[N@H+]1CCO[C@@H]2CN(C(F)(F)c3cnc(Cl)cc3Cl)CC[C@@H]2C1 ZINC001164857130 720837397 /nfs/dbraw/zinc/83/73/97/720837397.db2.gz XQOGRPJZOMLACV-IUODEOHRSA-N 1 1 410.292 3.107 20 0 HGADMO Clc1ccnc2ccc(N3CC[C@@H]4[C@@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)nc12 ZINC001164751081 720843116 /nfs/dbraw/zinc/84/31/16/720843116.db2.gz YKJZVVGTTTVZQO-ABSDTBQOSA-N 1 1 423.952 3.254 20 0 HGADMO Cc1ccc(-c2ccc(N3CC[C@@H]4[C@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)nn2)o1 ZINC001164749724 720852187 /nfs/dbraw/zinc/85/21/87/720852187.db2.gz OBPMVHRDWPYYQP-SVFBPWRDSA-N 1 1 419.533 3.016 20 0 HGADMO COCC[N@H+]1CCO[C@H]2CN(c3cc(Cl)nc4cc(OC)ccc43)CC[C@H]2C1 ZINC001164862164 720853861 /nfs/dbraw/zinc/85/38/61/720853861.db2.gz ZEOKMXXLBJXXRB-YWZLYKJASA-N 1 1 405.926 3.070 20 0 HGADMO COCC[N@H+]1CCO[C@@H]2CN(c3cc(Cl)nc4cc(OC)ccc43)CC[C@H]2C1 ZINC001164862160 720854042 /nfs/dbraw/zinc/85/40/42/720854042.db2.gz ZEOKMXXLBJXXRB-MGPUTAFESA-N 1 1 405.926 3.070 20 0 HGADMO COCC[N@H+]1CCO[C@H]2CN(C(F)(F)c3ccc(Cl)c(Cl)n3)CC[C@H]2C1 ZINC001164854969 720854311 /nfs/dbraw/zinc/85/43/11/720854311.db2.gz LWGHDIUZHPWPGH-JSGCOSHPSA-N 1 1 410.292 3.107 20 0 HGADMO c1ncn(C[C@@H]2C[C@H]3CN(c4ccc(COC5CCC5)cn4)CC[C@@H]3[N@@H+]2CC2CC2)n1 ZINC001164748667 720855665 /nfs/dbraw/zinc/85/56/65/720855665.db2.gz LMUDNEVVBMQBAH-FUDKSRODSA-N 1 1 422.577 3.122 20 0 HGADMO Cc1cnc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COCc2cccnc2)c(C)n1 ZINC001164754342 720871854 /nfs/dbraw/zinc/87/18/54/720871854.db2.gz RHJXZHVSEXJUQY-VWNXMTODSA-N 1 1 407.562 3.244 20 0 HGADMO COc1cccc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COCc2cccnc2)n1 ZINC001164753494 720877803 /nfs/dbraw/zinc/87/78/03/720877803.db2.gz PQVZCULIIHRDSL-QPPBQGQZSA-N 1 1 408.546 3.240 20 0 HGADMO COCC[N@H+]1CCO[C@H]2CN(c3cc(Cl)nc4c(F)ccc(F)c34)CC[C@@H]2C1 ZINC001164853848 720890726 /nfs/dbraw/zinc/89/07/26/720890726.db2.gz DAIVNBDEGDNFPY-DYVFJYSZSA-N 1 1 411.880 3.340 20 0 HGADMO COCc1ccc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COCc2cccnc2)nc1 ZINC001164751332 720914987 /nfs/dbraw/zinc/91/49/87/720914987.db2.gz LJVLADKKHRJONE-NOZRDPDXSA-N 1 1 422.573 3.378 20 0 HGADMO CC(C)[N@@H+](C)Cc1cnc2n1CCN(c1cc(NC(=O)OC(C)(C)C)ncn1)[C@@H]2C ZINC001164861493 720936839 /nfs/dbraw/zinc/93/68/39/720936839.db2.gz SRASFXSNKPEMHW-OAHLLOKOSA-N 1 1 415.542 3.442 20 0 HGADMO Clc1ccc(C[NH+]2CCCC2)c(N2C[C@H](OCc3cccnc3)[C@H]3COC[C@H]32)n1 ZINC001164762865 721005862 /nfs/dbraw/zinc/00/58/62/721005862.db2.gz WNFJEEVWCUQUDI-ZCNNSNEGSA-N 1 1 414.937 3.146 20 0 HGADMO Clc1ccc(C[NH+]2CCCC2)c(N2C[C@H](OCc3cccnc3)[C@@H]3COC[C@@H]32)n1 ZINC001164762846 721006231 /nfs/dbraw/zinc/00/62/31/721006231.db2.gz WNFJEEVWCUQUDI-AABGKKOBSA-N 1 1 414.937 3.146 20 0 HGADMO CC(C)[N@@H+](C)Cc1cnc2n1CCN(C(F)(F)COc1cncc(Cl)n1)[C@H]2C ZINC001164864108 721007477 /nfs/dbraw/zinc/00/74/77/721007477.db2.gz XKFJWICBEFBAIQ-ZDUSSCGKSA-N 1 1 414.888 3.215 20 0 HGADMO CC(C)[N@@H+](C)Cc1cnc2n1CCN(c1ncnc3c1ncn3-c1ccccc1)[C@@H]2C ZINC001164856682 721015149 /nfs/dbraw/zinc/01/51/49/721015149.db2.gz BIRXHIGUHXDEAV-QGZVFWFLSA-N 1 1 416.533 3.433 20 0 HGADMO CC(C)[N@@H+](C)Cc1cnc2n1CCN(C(F)(F)Oc1cnc(Cl)cn1)[C@H]2C ZINC001164858839 721021955 /nfs/dbraw/zinc/02/19/55/721021955.db2.gz HVBKWRMSFPNIGC-LBPRGKRZSA-N 1 1 400.861 3.173 20 0 HGADMO COc1cc(C(F)(F)N2CCn3c(C[N@@H+](C)C(C)C)cnc3[C@H]2C)nc(Cl)n1 ZINC001164857264 721021969 /nfs/dbraw/zinc/02/19/69/721021969.db2.gz BYYIJFPPNXNOOJ-GFCCVEGCSA-N 1 1 414.888 3.301 20 0 HGADMO Clc1c[nH]c2nc(Cl)nc(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@@H]4C3)c12 ZINC001164871537 721045103 /nfs/dbraw/zinc/04/51/03/721045103.db2.gz ZNHJQRMKZQDGPN-ZIAGYGMSSA-N 1 1 419.316 3.139 20 0 HGADMO COc1cc(C(F)(F)N2CC[N@H+]3C[C@H](OCc4cccnc4)C[C@@H]3C2)cc(Cl)n1 ZINC001164867786 721054907 /nfs/dbraw/zinc/05/49/07/721054907.db2.gz KLJXYCWRMSQCDR-IAGOWNOFSA-N 1 1 424.879 3.163 20 0 HGADMO FC(F)(Oc1ccc(Cl)nc1)N1CC[N@H+]2C[C@H](OCc3cccnc3)C[C@@H]2C1 ZINC001164865864 721069857 /nfs/dbraw/zinc/06/98/57/721069857.db2.gz AUDRZTGCGYQQFK-NVXWUHKLSA-N 1 1 410.852 3.034 20 0 HGADMO Clc1ncnc2scc(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@@H]4C3)c21 ZINC001164868924 721075602 /nfs/dbraw/zinc/07/56/02/721075602.db2.gz RFSMMRSLNQZIFH-CABCVRRESA-N 1 1 401.923 3.219 20 0 HGADMO FC(F)(COc1ccnc(Cl)c1)N1CC[N@H+]2C[C@H](OCc3cccnc3)C[C@@H]2C1 ZINC001164863411 721083022 /nfs/dbraw/zinc/08/30/22/721083022.db2.gz CGCDYNSVKZDEGB-SJLPKXTDSA-N 1 1 424.879 3.077 20 0 HGADMO COc1ccc2c(C)cc(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@H]4C3)nc2c1 ZINC001164867705 721108441 /nfs/dbraw/zinc/10/84/41/721108441.db2.gz ZSJCAQOPPZVOOX-FPOVZHCZSA-N 1 1 404.514 3.427 20 0 HGADMO CSc1nc2ccsc2c(N2C[C@@H]3CC[N@@H+](Cc4cnn(C)c4)C[C@@H]3C2)n1 ZINC001164771729 721118431 /nfs/dbraw/zinc/11/84/31/721118431.db2.gz SSZWUZJCJPWYTM-LSDHHAIUSA-N 1 1 400.577 3.105 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(C(F)(F)c4c[nH]c5nc(Cl)ccc45)C[C@@H]3C2)cn1 ZINC001164771375 721134582 /nfs/dbraw/zinc/13/45/82/721134582.db2.gz SKZCVBFYUDRPFM-GJZGRUSLSA-N 1 1 420.895 3.453 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4nc(Cl)ncc4-c4ccccc4)C[C@@H]3C2)cn1 ZINC001164763422 721138878 /nfs/dbraw/zinc/13/88/78/721138878.db2.gz FQOSVELUERHAKQ-MOPGFXCFSA-N 1 1 408.937 3.489 20 0 HGADMO COc1ccc(-c2ccc(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@H]4C3)nn2)cc1 ZINC001164870251 721140036 /nfs/dbraw/zinc/14/00/36/721140036.db2.gz CAMNNGDAKQUJSU-UNMCSNQZSA-N 1 1 417.513 3.027 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4nc(Cl)ccc4CN4CCCC4)C[C@H]3C2)cn1 ZINC001164774147 721149891 /nfs/dbraw/zinc/14/98/91/721149891.db2.gz ZVHCAJQUQYXCQS-UYAOXDASSA-N 1 1 414.985 3.023 20 0 HGADMO Fc1cc2ncc(Cl)nc2cc1N1CC[N@H+]2C[C@@H](OCc3cccnc3)C[C@@H]2C1 ZINC001164877061 721158486 /nfs/dbraw/zinc/15/84/86/721158486.db2.gz OQTCUZQDXLRMBP-CVEARBPZSA-N 1 1 413.884 3.297 20 0 HGADMO Fc1ccc(Oc2ccnc(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@@H]4C3)n2)cc1 ZINC001164871073 721161325 /nfs/dbraw/zinc/16/13/25/721161325.db2.gz DHVWITMWQXVJGS-CTNGQTDRSA-N 1 1 421.476 3.283 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4ccc(-c5ccccc5Cl)nn4)C[C@@H]3C2)cn1 ZINC001164768533 721165851 /nfs/dbraw/zinc/16/58/51/721165851.db2.gz LHGRLKZCVHNGDI-ROUUACIJSA-N 1 1 408.937 3.489 20 0 HGADMO Cc1c(Cl)nc(C(C)C)nc1N1CC[N@H+]2C[C@@H](OCc3cccnc3)C[C@H]2C1 ZINC001164871550 721180115 /nfs/dbraw/zinc/18/01/15/721180115.db2.gz FGOJKLLZSYCADL-ROUUACIJSA-N 1 1 401.942 3.437 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(C(F)(F)c4cc5cc[nH]c5c(Cl)n4)C[C@H]3C2)cn1 ZINC001164762670 721180505 /nfs/dbraw/zinc/18/05/05/721180505.db2.gz DDCWLNDHBACGHT-HZPDHXFCSA-N 1 1 420.895 3.453 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(C(F)(F)c4cc5cc[nH]c5c(Cl)n4)C[C@@H]3C2)cn1 ZINC001164762665 721181623 /nfs/dbraw/zinc/18/16/23/721181623.db2.gz DDCWLNDHBACGHT-CVEARBPZSA-N 1 1 420.895 3.453 20 0 HGADMO Cc1cc(-c2cccc(F)c2)nnc1N1CC[N@H+]2C[C@H](OCc3cccnc3)C[C@H]2C1 ZINC001164871655 721182895 /nfs/dbraw/zinc/18/28/95/721182895.db2.gz GDYUQSYLMTYNPP-FCHUYYIVSA-N 1 1 419.504 3.466 20 0 HGADMO Cc1ccc(C)c(-c2ccc(N3C[C@@H]4CC[N@H+](Cc5cnn(C)c5)C[C@H]4C3)nn2)c1 ZINC001164772869 721212494 /nfs/dbraw/zinc/21/24/94/721212494.db2.gz VQDPRUIITUKMMP-SFTDATJTSA-N 1 1 402.546 3.452 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4nnc(Cl)c5ccc(F)cc54)C[C@@H]3C2)cn1 ZINC001164763273 721225634 /nfs/dbraw/zinc/22/56/34/721225634.db2.gz FDNVRLLJPMMGQE-GJZGRUSLSA-N 1 1 400.889 3.114 20 0 HGADMO CCN1C(=O)[C@]2(CC[C@H]3CN(c4nc(Cl)ccc4C[NH+]4CCCC4)C[C@H]32)N=C1C ZINC001164875119 721230175 /nfs/dbraw/zinc/23/01/75/721230175.db2.gz WDUVCHXGNUFIGQ-AQOAWAETSA-N 1 1 415.969 3.196 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4nc(C(F)F)nc5ccc(F)cc54)C[C@H]3C2)cn1 ZINC001164766751 721230491 /nfs/dbraw/zinc/23/04/91/721230491.db2.gz VIGIBSHMTZSSDW-LSDHHAIUSA-N 1 1 416.451 3.398 20 0 HGADMO COc1cc(C)cc(N2CCC[C@]3(C2)COCC[N@@H+](Cc2c(C)noc2C)C3)n1 ZINC001164777752 721348667 /nfs/dbraw/zinc/34/86/67/721348667.db2.gz HSQWAQGSMZFVBN-QFIPXVFZSA-N 1 1 400.523 3.122 20 0 HGADMO CCSc1cncc(N2CCC[C@]3(C2)COCC[N@H+](Cc2c(C)noc2C)C3)n1 ZINC001164780008 721369149 /nfs/dbraw/zinc/36/91/49/721369149.db2.gz BZCORFZLQWEGLH-NRFANRHFSA-N 1 1 417.579 3.312 20 0 HGADMO CCSc1cncc(N2CCC[C@]3(C2)COCC[N@@H+](Cc2c(C)noc2C)C3)n1 ZINC001164780008 721369153 /nfs/dbraw/zinc/36/91/53/721369153.db2.gz BZCORFZLQWEGLH-NRFANRHFSA-N 1 1 417.579 3.312 20 0 HGADMO COc1ccnc(Cl)c1N1CCC[C@@]2(C1)COCC[N@H+](Cc1c(C)noc1C)C2 ZINC001164781566 721371819 /nfs/dbraw/zinc/37/18/19/721371819.db2.gz JWLLKCNDEUSYJL-OAQYLSRUSA-N 1 1 420.941 3.467 20 0 HGADMO COc1ccnc(Cl)c1N1CCC[C@@]2(C1)COCC[N@@H+](Cc1c(C)noc1C)C2 ZINC001164781566 721371823 /nfs/dbraw/zinc/37/18/23/721371823.db2.gz JWLLKCNDEUSYJL-OAQYLSRUSA-N 1 1 420.941 3.467 20 0 HGADMO COc1ccc2nc(N3CC[C@@]4(C3)CCC[C@H](CN3CC[NH+](C)CC3)O4)c(C)cc2c1 ZINC001164887123 721381211 /nfs/dbraw/zinc/38/12/11/721381211.db2.gz HAKMCMFAEIVXEN-RCZVLFRGSA-N 1 1 424.589 3.317 20 0 HGADMO Cc1sc2ncnc(N3CC[C@@]4(C3)CCC[C@H](CN3CC[NH+](C)CC3)O4)c2c1C ZINC001164887738 721388892 /nfs/dbraw/zinc/38/88/92/721388892.db2.gz ICIFTOZNAAXXGS-XMSQKQJNSA-N 1 1 415.607 3.074 20 0 HGADMO CCOC(=O)c1c(C)cc(Cl)nc1N1C[C@H]2C[NH+](Cc3nccs3)C[C@@H]2C1 ZINC001164782910 721403093 /nfs/dbraw/zinc/40/30/93/721403093.db2.gz HAIZNDMPQAVIIX-ZIAGYGMSSA-N 1 1 406.939 3.245 20 0 HGADMO CCOC(=O)c1cc(Cl)nc(N2C[C@@H]3C[N@@H+](Cc4nccs4)C[C@@H]3C2)c1C ZINC001164788262 721409399 /nfs/dbraw/zinc/40/93/99/721409399.db2.gz RQTRWNXCEQAEFG-OKILXGFUSA-N 1 1 406.939 3.245 20 0 HGADMO CCOC(=O)c1cc(Cl)nc(N2C[C@@H]3C[N@H+](Cc4nccs4)C[C@@H]3C2)c1C ZINC001164788262 721409403 /nfs/dbraw/zinc/40/94/03/721409403.db2.gz RQTRWNXCEQAEFG-OKILXGFUSA-N 1 1 406.939 3.245 20 0 HGADMO O=C(Nc1ccccc1)c1ccnc(N2C[C@@H]3C[NH+](Cc4nccs4)C[C@H]3C2)c1 ZINC001164789028 721412013 /nfs/dbraw/zinc/41/20/13/721412013.db2.gz UKFDOCIRIVRXJY-ROUUACIJSA-N 1 1 405.527 3.359 20 0 HGADMO CCc1c(Cl)nnc(N2CC[C@@]3(C2)CCC[C@H](CN2CC[NH+](C)CC2)O3)c1CC ZINC001164884079 721413483 /nfs/dbraw/zinc/41/34/83/721413483.db2.gz DAGHYZMTRIIDNT-VGOFRKELSA-N 1 1 422.017 3.020 20 0 HGADMO CC(C)(C)NC(=O)c1cc(Cl)nc(N2C[C@H]3C[NH+](Cc4nccs4)C[C@@H]3C2)c1 ZINC001164781751 721415078 /nfs/dbraw/zinc/41/50/78/721415078.db2.gz DSQQJMLPKFGWJC-HUUCEWRRSA-N 1 1 419.982 3.288 20 0 HGADMO FC(F)(Cc1nc(Cl)cc(Cl)n1)N1C[C@@H]2C[NH+](Cc3nccs3)C[C@H]2C1 ZINC001164787334 721422545 /nfs/dbraw/zinc/42/25/45/721422545.db2.gz QFKCNYIQNPPSCQ-QWRGUYRKSA-N 1 1 420.316 3.439 20 0 HGADMO COC(=O)C[C@H](c1ccnc(N2C[C@@H]3C[N@@H+](Cc4nccs4)C[C@@H]3C2)c1)C1CC1 ZINC001164787352 721423750 /nfs/dbraw/zinc/42/37/50/721423750.db2.gz QGPODZSMJDHFFR-OTWHNJEPSA-N 1 1 412.559 3.163 20 0 HGADMO COC(=O)C[C@H](c1ccnc(N2C[C@@H]3C[N@H+](Cc4nccs4)C[C@@H]3C2)c1)C1CC1 ZINC001164787352 721423753 /nfs/dbraw/zinc/42/37/53/721423753.db2.gz QGPODZSMJDHFFR-OTWHNJEPSA-N 1 1 412.559 3.163 20 0 HGADMO O=C(OCc1ccccc1)c1ccc(N2C[C@@H]3C[NH+](Cc4nccs4)C[C@H]3C2)nc1 ZINC001164783324 721429053 /nfs/dbraw/zinc/42/90/53/721429053.db2.gz IIQFFGSYGJLIBD-PMACEKPBSA-N 1 1 420.538 3.463 20 0 HGADMO C[NH+]1CCN(C[C@@H]2CCC[C@]3(CCN(c4ccc5nccc(Cl)c5n4)C3)O2)CC1 ZINC001164894924 721429624 /nfs/dbraw/zinc/42/96/24/721429624.db2.gz NKVOIRPTHUHLRH-HTAPYJJXSA-N 1 1 415.969 3.049 20 0 HGADMO c1csc(C[NH+]2C[C@@H]3CN(c4nc(-c5cccnc5)nc5c4CCC5)C[C@H]3C2)n1 ZINC001164785704 721432825 /nfs/dbraw/zinc/43/28/25/721432825.db2.gz OBMQAFOTJXRRFD-IAGOWNOFSA-N 1 1 404.543 3.052 20 0 HGADMO Cc1cccc(-c2ccc(N3CC[C@]4(C3)CCC[C@H](CN3CC[NH+](C)CC3)O4)nn2)c1 ZINC001164898782 721434663 /nfs/dbraw/zinc/43/46/63/721434663.db2.gz WZIZBDBIDAOJSB-RDGATRHJSA-N 1 1 421.589 3.217 20 0 HGADMO Cn1cnc2c1[C@@H](COCc1cccnc1)N(c1ccc(C[N@@H+](C)C3CC3)cn1)CC2 ZINC001164780951 721441788 /nfs/dbraw/zinc/44/17/88/721441788.db2.gz DDDCENLQHSAECU-JOCHJYFZSA-N 1 1 418.545 3.125 20 0 HGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1cnc3ccccc3n1)CC2 ZINC001164787787 721451561 /nfs/dbraw/zinc/45/15/61/721451561.db2.gz QMHZCOQJUNNGEL-HXUWFJFHSA-N 1 1 410.562 3.364 20 0 HGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1nncc3ccccc31)CC2 ZINC001164789443 721455220 /nfs/dbraw/zinc/45/52/20/721455220.db2.gz WGNUSYBNCITGSJ-OAQYLSRUSA-N 1 1 410.562 3.364 20 0 HGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1ncc(F)c3cc[nH]c31)CC2 ZINC001164789842 721464101 /nfs/dbraw/zinc/46/41/01/721464101.db2.gz XRHZJQCYTXOQSX-GOSISDBHSA-N 1 1 416.541 3.436 20 0 HGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1cc(C3CC3)ncn1)CC2 ZINC001164788306 721467879 /nfs/dbraw/zinc/46/78/79/721467879.db2.gz IXLNTEHDIVLRQN-HXUWFJFHSA-N 1 1 400.567 3.088 20 0 HGADMO CCc1c(Cl)ncnc1N1CCC2(C[C@@H](COCC3CC3)[N@@H+](CCOC)C2)CC1 ZINC001164788311 721468398 /nfs/dbraw/zinc/46/83/98/721468398.db2.gz IXPLZWFDJZSRDE-SFHVURJKSA-N 1 1 423.001 3.426 20 0 HGADMO CCCNC(=O)c1ccc(N2CCC3(CC([N@@H+](C)Cc4ccncc4)C3)CC2)nc1 ZINC001164796668 721500538 /nfs/dbraw/zinc/50/05/38/721500538.db2.gz VAVRURYEOXJOOT-UHFFFAOYSA-N 1 1 407.562 3.497 20 0 HGADMO CCOC(=O)c1cnc(Cl)cc1N1CC[N@H+]2C[C@H](Oc3cccc(F)c3)C[C@@H]2C1 ZINC001164900767 721509542 /nfs/dbraw/zinc/50/95/42/721509542.db2.gz UPMJXLAHOJDIBS-NVXWUHKLSA-N 1 1 419.884 3.393 20 0 HGADMO Cc1cc(C(F)(F)N2C[C@H]([N@H+](C)Cc3cccnc3)[C@H]3OCCC[C@@H]32)nc(Cl)n1 ZINC001164799161 721544883 /nfs/dbraw/zinc/54/48/83/721544883.db2.gz BAIQMMTYKKIPHV-BQFCYCMXSA-N 1 1 423.895 3.247 20 0 HGADMO Cc1cc(C(F)(F)N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@H]3OCCC[C@@H]32)nc(Cl)n1 ZINC001164799161 721544890 /nfs/dbraw/zinc/54/48/90/721544890.db2.gz BAIQMMTYKKIPHV-BQFCYCMXSA-N 1 1 423.895 3.247 20 0 HGADMO Cc1cc(C(F)(F)N2C[C@H]([N@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@H]32)nc(Cl)n1 ZINC001164799165 721545014 /nfs/dbraw/zinc/54/50/14/721545014.db2.gz BAIQMMTYKKIPHV-SOLBZPMBSA-N 1 1 423.895 3.247 20 0 HGADMO Cc1cc(C(F)(F)N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@H]32)nc(Cl)n1 ZINC001164799165 721545016 /nfs/dbraw/zinc/54/50/16/721545016.db2.gz BAIQMMTYKKIPHV-SOLBZPMBSA-N 1 1 423.895 3.247 20 0 HGADMO CCOCc1cnc(Cl)nc1N1CC[N@H+]2C[C@@H](Oc3cccc(F)c3)C[C@@H]2C1 ZINC001164909832 721549475 /nfs/dbraw/zinc/54/94/75/721549475.db2.gz SBNRSBCRPUFTNZ-AEFFLSMTSA-N 1 1 406.889 3.148 20 0 HGADMO Nc1cc(C(F)(F)N2CC[N@H+]3C[C@@H](Oc4cccc(F)c4)C[C@H]3C2)cnc1Cl ZINC001164911405 721550601 /nfs/dbraw/zinc/55/06/01/721550601.db2.gz WQVJDNVXPDLMSF-HOCLYGCPSA-N 1 1 412.843 3.343 20 0 HGADMO CCOc1cc(Cl)nc(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@@H]32)c1 ZINC001164799052 721551145 /nfs/dbraw/zinc/55/11/45/721551145.db2.gz ALIUVTURERXYMV-BBTUJRGHSA-N 1 1 402.926 3.397 20 0 HGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN([C@H](F)Oc2ccc(Cl)nc2)[C@@H]2CCCO[C@H]12 ZINC001164805367 721554251 /nfs/dbraw/zinc/55/42/51/721554251.db2.gz MZIQSOZAMVBKKU-JYBIWHBTSA-N 1 1 406.889 3.126 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN([C@H](F)Oc2ccc(Cl)nc2)[C@@H]2CCCO[C@H]12 ZINC001164805367 721554256 /nfs/dbraw/zinc/55/42/56/721554256.db2.gz MZIQSOZAMVBKKU-JYBIWHBTSA-N 1 1 406.889 3.126 20 0 HGADMO Cc1cc(C(F)(F)N2CC[N@H+]3C[C@H](Oc4cccc(F)c4)C[C@H]3C2)c(Cl)nn1 ZINC001164911398 721555426 /nfs/dbraw/zinc/55/54/26/721555426.db2.gz ZBTCGYFJZZCFHE-GOEBONIOSA-N 1 1 412.843 3.464 20 0 HGADMO Cc1cc(C(F)(F)N2CC[N@H+]3C[C@@H](Oc4cccc(F)c4)C[C@@H]3C2)c(Cl)nn1 ZINC001164911407 721555446 /nfs/dbraw/zinc/55/54/46/721555446.db2.gz ZBTCGYFJZZCFHE-ZBFHGGJFSA-N 1 1 412.843 3.464 20 0 HGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2nc(Cl)nc3ncsc32)[C@@H]2CCCO[C@H]12 ZINC001164805421 721556168 /nfs/dbraw/zinc/55/61/68/721556168.db2.gz NTTNLCDDLDAXCX-KFWWJZLASA-N 1 1 416.938 3.003 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2nc(Cl)nc3ncsc32)[C@@H]2CCCO[C@H]12 ZINC001164805421 721556170 /nfs/dbraw/zinc/55/61/70/721556170.db2.gz NTTNLCDDLDAXCX-KFWWJZLASA-N 1 1 416.938 3.003 20 0 HGADMO COC(=O)c1cc(Cl)c(N2CC[N@H+]3C[C@@H](Oc4cccc(F)c4)C[C@@H]3C2)nc1C ZINC001164907563 721564665 /nfs/dbraw/zinc/56/46/65/721564665.db2.gz OLTOQGGEBWCJKN-WBVHZDCISA-N 1 1 419.884 3.311 20 0 HGADMO Cc1cc(C(F)(F)N2C[C@H]([N@H+](C)Cc3cccnc3)[C@H]3OCCC[C@@H]32)c(Cl)nn1 ZINC001164801900 721580510 /nfs/dbraw/zinc/58/05/10/721580510.db2.gz GEXKWNJWULEOHW-BZSNNMDCSA-N 1 1 423.895 3.247 20 0 HGADMO Cc1cc(C(F)(F)N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@H]3OCCC[C@@H]32)c(Cl)nn1 ZINC001164801900 721580514 /nfs/dbraw/zinc/58/05/14/721580514.db2.gz GEXKWNJWULEOHW-BZSNNMDCSA-N 1 1 423.895 3.247 20 0 HGADMO COc1ccc2nc(N3C[C@H]([N@@H+](C)Cc4cccnc4)[C@H]4OCCC[C@@H]43)c(C)nc2c1 ZINC001164811881 721583247 /nfs/dbraw/zinc/58/32/47/721583247.db2.gz YUUMHQSVQGEFAW-VABKMULXSA-N 1 1 419.529 3.210 20 0 HGADMO COC(=O)c1cc(F)cnc1N1CCC(F)(F)[C@@]2(CC[N@@H+](Cc3ccccn3)C2)C1 ZINC001164903577 721585686 /nfs/dbraw/zinc/58/56/86/721585686.db2.gz AIWXNFJGNGXVRY-HXUWFJFHSA-N 1 1 420.435 3.140 20 0 HGADMO CN(C)c1nc(Cl)cc(N2CCc3c(C[N@H+](C)Cc4ccco4)cncc3C2)n1 ZINC001164909359 721744082 /nfs/dbraw/zinc/74/40/82/721744082.db2.gz PJUSLHCICURVTC-UHFFFAOYSA-N 1 1 412.925 3.379 20 0 HGADMO CN(C)c1nc(Cl)cc(N2CCc3c(C[N@@H+](C)Cc4ccco4)cncc3C2)n1 ZINC001164909359 721744084 /nfs/dbraw/zinc/74/40/84/721744084.db2.gz PJUSLHCICURVTC-UHFFFAOYSA-N 1 1 412.925 3.379 20 0 HGADMO COC(=O)c1cc(OC)cnc1N1CCc2c(C[N@H+](C)Cc3ccco3)cncc2C1 ZINC001164908928 721750989 /nfs/dbraw/zinc/75/09/89/721750989.db2.gz OPPAUHGBZRQFKC-UHFFFAOYSA-N 1 1 422.485 3.060 20 0 HGADMO COC(=O)c1cc(OC)cnc1N1CCc2c(C[N@@H+](C)Cc3ccco3)cncc2C1 ZINC001164908928 721750992 /nfs/dbraw/zinc/75/09/92/721750992.db2.gz OPPAUHGBZRQFKC-UHFFFAOYSA-N 1 1 422.485 3.060 20 0 HGADMO COC(=O)c1cnc(N2C[C@@H]3CCC[C@@H]([N@@H+](C)Cc4ccccn4)[C@H]3C2)cc1OC ZINC001165023948 721803494 /nfs/dbraw/zinc/80/34/94/721803494.db2.gz KJSZWJQYTCNXMD-FFZOFVMBSA-N 1 1 410.518 3.009 20 0 HGADMO COC(=O)c1ccc(N2C[C@@H]3CCC[C@@H]([N@@H+](C)Cc4ccccn4)[C@@H]3C2)nc1OC ZINC001165022089 721803521 /nfs/dbraw/zinc/80/35/21/721803521.db2.gz HUYOPGBURRFSKU-PWIZWCRZSA-N 1 1 410.518 3.009 20 0 HGADMO CCOC(=O)c1cc(C)nc(N2C[C@@H]3CCC[C@H]([N@@H+](C)Cc4ccccn4)[C@H]3C2)n1 ZINC001165023404 721806952 /nfs/dbraw/zinc/80/69/52/721806952.db2.gz JSWIZNUVYXTZCE-CUWPLCDZSA-N 1 1 409.534 3.094 20 0 HGADMO Cn1cnc2c1nc(Cl)nc2N1C[C@@H]2CCC[C@@H]([N@@H+](C)Cc3ccccn3)[C@H]2C1 ZINC001165018576 721808576 /nfs/dbraw/zinc/80/85/76/721808576.db2.gz BJVLVNUMQUAHTK-BHYGNILZSA-N 1 1 411.941 3.149 20 0 HGADMO COC(=O)c1nc(Cl)cc(N2C[C@@H]3CCC[C@H]([N@@H+](C)Cc4ccccn4)[C@H]3C2)n1 ZINC001165030223 721827695 /nfs/dbraw/zinc/82/76/95/721827695.db2.gz ZBGWZNQREUUBBB-XIRDDKMYSA-N 1 1 415.925 3.049 20 0 HGADMO C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@@H]2CN([C@@H](F)Oc3ccc(Cl)nn3)C[C@@H]21 ZINC001165030219 721831860 /nfs/dbraw/zinc/83/18/60/721831860.db2.gz ZASCNMSITKAOJP-XNWPKKHHSA-N 1 1 405.905 3.389 20 0 HGADMO CN(C)CC[N@H+]1CC[C@@H]2[C@@H]1CCN2c1ccc(-c2ccc(C3OCCCO3)cc2)cn1 ZINC001164923634 721874515 /nfs/dbraw/zinc/87/45/15/721874515.db2.gz JEVAMZGMYJGOPJ-XZOQPEGZSA-N 1 1 422.573 3.399 20 0 HGADMO C[NH+](C)CCN1CC[C@@H]2[C@@H]1CCN2c1ccc(-c2ccc(C3OCCCO3)cc2)cn1 ZINC001164923634 721874517 /nfs/dbraw/zinc/87/45/17/721874517.db2.gz JEVAMZGMYJGOPJ-XZOQPEGZSA-N 1 1 422.573 3.399 20 0 HGADMO CN(C)CC[N@@H+]1CC[C@H]2[C@@H]1CCN2c1ccc(C(=O)Nc2cccc(Cl)c2)cn1 ZINC001164933342 721880129 /nfs/dbraw/zinc/88/01/29/721880129.db2.gz MICBUYXZXVUQEF-PMACEKPBSA-N 1 1 413.953 3.202 20 0 HGADMO CN(C)CC[N@H+]1CC[C@H]2[C@@H]1CCN2c1ccc(C(=O)Nc2cccc(Cl)c2)cn1 ZINC001164933342 721880130 /nfs/dbraw/zinc/88/01/30/721880130.db2.gz MICBUYXZXVUQEF-PMACEKPBSA-N 1 1 413.953 3.202 20 0 HGADMO C[C@@H]1C(=O)NCCN1c1nc(C[NH+]2CCCCC2)nc2sc3c(c21)CC[C@H](C)C3 ZINC001165036143 721883608 /nfs/dbraw/zinc/88/36/08/721883608.db2.gz JVNORPWLUHPAPC-LSDHHAIUSA-N 1 1 413.591 3.127 20 0 HGADMO CN(C)CC[N@H+]1CC[C@@H]2[C@@H]1CCN2c1ncnc2cc(OCc3ccccc3)ccc21 ZINC001164934397 721887708 /nfs/dbraw/zinc/88/77/08/721887708.db2.gz RILKHGWLICZWEB-BJKOFHAPSA-N 1 1 417.557 3.423 20 0 HGADMO C[NH+](C)CCN1CC[C@@H]2[C@@H]1CCN2c1ncnc2cc(OCc3ccccc3)ccc21 ZINC001164934397 721887709 /nfs/dbraw/zinc/88/77/09/721887709.db2.gz RILKHGWLICZWEB-BJKOFHAPSA-N 1 1 417.557 3.423 20 0 HGADMO CCOC(=O)c1ccc(N2CCC3(CC2)C[N@@H+](Cc2ccc(C)cc2)CCO3)nc1 ZINC001164938403 721920165 /nfs/dbraw/zinc/92/01/65/721920165.db2.gz NLXQMNBWMMVKST-UHFFFAOYSA-N 1 1 409.530 3.438 20 0 HGADMO Cc1ccc(C[N@H+]2CCOC3(CCN(c4nc(Cl)nc5nc[nH]c54)CC3)C2)cc1 ZINC001164940032 721920333 /nfs/dbraw/zinc/92/03/33/721920333.db2.gz YEMQNYJJUOOLBW-UHFFFAOYSA-N 1 1 412.925 3.186 20 0 HGADMO CCOC(=O)c1cccnc1N1CCC2(CC1)C[N@@H+](Cc1ccc(C)cc1)CCO2 ZINC001164938401 721921207 /nfs/dbraw/zinc/92/12/07/721921207.db2.gz NJFOTTJIZZUNII-UHFFFAOYSA-N 1 1 409.530 3.438 20 0 HGADMO COc1ccc(Oc2nc(Cl)ncc2N2CC[NH+](C[C@@H]3CCCO3)CC2)cc1 ZINC001165043109 721925163 /nfs/dbraw/zinc/92/51/63/721925163.db2.gz GRQLNSHLQZBJNB-KRWDZBQOSA-N 1 1 404.898 3.232 20 0 HGADMO COc1ncc(Cl)c(N2CCC3(CC2)C[N@@H+](Cc2ccc(C)cc2)CCO3)n1 ZINC001164940000 721932640 /nfs/dbraw/zinc/93/26/40/721932640.db2.gz PJQLFCFWDXLRCT-UHFFFAOYSA-N 1 1 402.926 3.318 20 0 HGADMO Cc1ccc(C[N@H+]2CCOC3(CCN([C@@H](F)Oc4ccc(Cl)nn4)CC3)C2)cc1 ZINC001164944705 721933552 /nfs/dbraw/zinc/93/35/52/721933552.db2.gz UCAXRVYLYSZRDT-HXUWFJFHSA-N 1 1 420.916 3.437 20 0 HGADMO COC[C@]12COC[C@H]1CN(c1nc(C[NH+]3CCCC3)nc3sc(C)c(C)c31)C2 ZINC001164953917 721994802 /nfs/dbraw/zinc/99/48/02/721994802.db2.gz SNDGJFBLNBAZOZ-IIBYNOLFSA-N 1 1 402.564 3.003 20 0 HGADMO C[N@@H+](Cc1ccc(N2CCCn3cnc(COc4cccnc4)c3C2)nc1)C1CC1 ZINC001164953798 721998353 /nfs/dbraw/zinc/99/83/53/721998353.db2.gz ZKCTXFZOIMMCOJ-UHFFFAOYSA-N 1 1 404.518 3.257 20 0 HGADMO COC(=O)c1ccc(Cl)nc1N1CCC2(CC[N@@H+](Cc3cccnc3)C2)CC1 ZINC001164954872 722011831 /nfs/dbraw/zinc/01/18/31/722011831.db2.gz PTHIICDRZAXUIG-UHFFFAOYSA-N 1 1 400.910 3.409 20 0 HGADMO COC(=O)c1ccc2cnc(N3CCC4(CC[N@@H+](Cc5cccnc5)C4)CC3)nc2c1 ZINC001164954851 722013832 /nfs/dbraw/zinc/01/38/32/722013832.db2.gz PFXZZAKIHPYLAF-UHFFFAOYSA-N 1 1 417.513 3.304 20 0 HGADMO c1cncc(C[N@H+]2CCC3(C2)CCN(c2ncnc4cc5c(cc42)OCCO5)CC3)c1 ZINC001164953330 722014169 /nfs/dbraw/zinc/01/41/69/722014169.db2.gz FHAABGDGTNLGOG-UHFFFAOYSA-N 1 1 417.513 3.289 20 0 HGADMO COC(=O)c1cc2c[nH]c(N3CCC4(CC[N@@H+](Cc5cccnc5)C4)CC3)cc-2n1 ZINC001164955872 722020802 /nfs/dbraw/zinc/02/08/02/722020802.db2.gz QFQLBDVKCLJGFD-UHFFFAOYSA-N 1 1 405.502 3.237 20 0 HGADMO CN1CCc2nc(Cl)nc(N3CCC4(CC[N@@H+](Cc5cccnc5)C4)CC3)c2C1 ZINC001164961296 722024565 /nfs/dbraw/zinc/02/45/65/722024565.db2.gz MNVVCHITAIWBEO-UHFFFAOYSA-N 1 1 412.969 3.005 20 0 HGADMO FC(F)(c1cnc(Cl)cn1)N1CCC2(CC1)COCC[N@@H+](Cc1ccncc1)C2 ZINC001164959621 722052744 /nfs/dbraw/zinc/05/27/44/722052744.db2.gz NCVCNXRKWNAEPR-UHFFFAOYSA-N 1 1 423.895 3.189 20 0 HGADMO Cc1cccc2ncnc(N3CCC4(CC3)COCC[N@@H+](Cc3ccncc3)C4)c12 ZINC001164964878 722056841 /nfs/dbraw/zinc/05/68/41/722056841.db2.gz YZIFQZGQHKTLBS-UHFFFAOYSA-N 1 1 403.530 3.452 20 0 HGADMO CC(C)(c1ccnc(Cl)c1)[N@H+]1C[C@@H]2CN(S(C)(=O)=O)c3ccccc3[C@@H]2C1 ZINC001164975050 722090950 /nfs/dbraw/zinc/09/09/50/722090950.db2.gz QCMLIWHDHQQKHZ-RHSMWYFYSA-N 1 1 405.951 3.465 20 0 HGADMO CC(C)(c1ccnc(Cl)c1)[N@H+]1C[C@@H]2CN(S(C)(=O)=O)c3ccccc3[C@H]2C1 ZINC001164975049 722090963 /nfs/dbraw/zinc/09/09/63/722090963.db2.gz QCMLIWHDHQQKHZ-PBHICJAKSA-N 1 1 405.951 3.465 20 0 HGADMO Cc1sc2ncnc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)c2c1C ZINC001164984133 722103799 /nfs/dbraw/zinc/10/37/99/722103799.db2.gz RSZQQNAZBIAHGO-RTBURBONSA-N 1 1 409.559 3.430 20 0 HGADMO c1ccc(-c2ccc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)nn2)cc1 ZINC001164984308 722105358 /nfs/dbraw/zinc/10/53/58/722105358.db2.gz SHOUNHBZCJQVLP-GMAHTHKFSA-N 1 1 401.514 3.266 20 0 HGADMO Fc1ccc(-c2cc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)ncn2)cc1 ZINC001164984626 722144845 /nfs/dbraw/zinc/14/48/45/722144845.db2.gz XXBFVXASIFJYAM-REWPJTCUSA-N 1 1 419.504 3.405 20 0 HGADMO c1ccc(Cc2nccc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)n2)cc1 ZINC001164985056 722147221 /nfs/dbraw/zinc/14/72/21/722147221.db2.gz ZATCDMUFLIUBBL-GOTSBHOMSA-N 1 1 415.541 3.190 20 0 HGADMO Cc1csc2nc(C)nc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)c12 ZINC001164984572 722147804 /nfs/dbraw/zinc/14/78/04/722147804.db2.gz XCVLXYQBZOZZEU-OALUTQOASA-N 1 1 409.559 3.430 20 0 HGADMO CCc1nc(N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)c(Cl)nc1C ZINC001164977115 722157525 /nfs/dbraw/zinc/15/75/25/722157525.db2.gz XDOOGRVXRNEYKK-HKUYNNGSSA-N 1 1 401.942 3.123 20 0 HGADMO Cn1cnc2c1nc(Cl)nc2N1CCC[C@]2(CC[N@H+]2Cc2cccc(F)c2)C1 ZINC001164995036 722197054 /nfs/dbraw/zinc/19/70/54/722197054.db2.gz RMJIXCRZFOUJNC-FQEVSTJZSA-N 1 1 400.889 3.401 20 0 HGADMO Cn1cnc2c1nc(Cl)nc2N1CCC[C@@]2(CC[N@H+]2Cc2cccc(F)c2)C1 ZINC001164995039 722197351 /nfs/dbraw/zinc/19/73/51/722197351.db2.gz RMJIXCRZFOUJNC-HXUWFJFHSA-N 1 1 400.889 3.401 20 0 HGADMO O=c1ccccn1-c1nccc(N2CCC[C@@]3(CC[N@@H+]3Cc3cccc(F)c3)C2)n1 ZINC001164996260 722209477 /nfs/dbraw/zinc/20/94/77/722209477.db2.gz SIIVTXRHRZKJHU-HSZRJFAPSA-N 1 1 405.477 3.012 20 0 HGADMO CCNC(=O)c1cc(Cl)nc(N2CCC[C@@]3(CC[N@H+]3Cc3cccc(F)c3)C2)n1 ZINC001164998486 722213684 /nfs/dbraw/zinc/21/36/84/722213684.db2.gz VZQDGOAXNXXSAR-OAQYLSRUSA-N 1 1 417.916 3.264 20 0 HGADMO C[NH+]1CCN(c2ncnc3c2CCN(c2ccc4cc(Cl)ccc4n2)CC3)CC1 ZINC001164996090 722230177 /nfs/dbraw/zinc/23/01/77/722230177.db2.gz DQBFTXNHYKCXRH-UHFFFAOYSA-N 1 1 408.937 3.035 20 0 HGADMO Cc1cc(C[N@H+]2C[C@H]3CCC[C@@]3(c3nc(CC4CC4)no3)C2)ccc1-n1cncn1 ZINC000328602188 569416546 /nfs/dbraw/zinc/41/65/46/569416546.db2.gz ASOHUDNXGXMBIZ-AUSIDOKSSA-N 1 1 404.518 3.465 20 0 HGADMO O=c1ccccn1Cc1ccc(N2CCC[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)nc1 ZINC001164632572 719101039 /nfs/dbraw/zinc/10/10/39/719101039.db2.gz ZRSWAQPOPNBMRV-XZOQPEGZSA-N 1 1 400.526 3.392 20 0 HGADMO C[NH+]1CCC(Oc2ccnc(N3CCO[C@@H]4[C@H](OCC5CCCC5)CC[C@@H]43)c2)CC1 ZINC001164662112 719344190 /nfs/dbraw/zinc/34/41/90/719344190.db2.gz NEDPXZALSQKJPU-ZDXQCDESSA-N 1 1 415.578 3.498 20 0 HGADMO CNC(=O)C[N@H+]1CCCC12CCN(C(F)(F)c1cc(Cl)ncc1Cl)CC2 ZINC001164683100 719699512 /nfs/dbraw/zinc/69/95/12/719699512.db2.gz IKZXSYBOBQVWLL-UHFFFAOYSA-N 1 1 407.292 3.114 20 0 HGADMO CNC(=O)C[N@H+]1CCCC12CCN(C(F)(F)c1cc(Cl)nc(Cl)c1)CC2 ZINC001164686324 719701274 /nfs/dbraw/zinc/70/12/74/719701274.db2.gz ZHLYJLRMHXGFAJ-UHFFFAOYSA-N 1 1 407.292 3.114 20 0 HGADMO CNC(=O)C[N@H+]1CCCC12CCN(c1nc(-c3ccccc3)nc3ccccc31)CC2 ZINC001164686321 719713450 /nfs/dbraw/zinc/71/34/50/719713450.db2.gz ZGINQGTYWIMJGW-UHFFFAOYSA-N 1 1 415.541 3.478 20 0 HGADMO CNC(=O)C[N@H+]1CCCC12CCN(c1nc(Cl)nc3cccc(Cl)c31)CC2 ZINC001164683611 719717232 /nfs/dbraw/zinc/71/72/32/719717232.db2.gz BBEHGKSAAWXNFC-UHFFFAOYSA-N 1 1 408.333 3.117 20 0 HGADMO CNC(=O)C[N@H+]1CCCC12CCN(c1ccc(-c3cccc4ccccc43)nn1)CC2 ZINC001164690061 719747149 /nfs/dbraw/zinc/74/71/49/719747149.db2.gz RSEUPGOYDQMIRC-UHFFFAOYSA-N 1 1 415.541 3.478 20 0 HGADMO COC(=O)c1cc(Cl)nc(N2CCC3(CCC[N@H+]3Cc3csc(C)n3)CC2)n1 ZINC001164693903 719803790 /nfs/dbraw/zinc/80/37/90/719803790.db2.gz VRGRPHNYXYENEB-UHFFFAOYSA-N 1 1 421.954 3.317 20 0 HGADMO COC(=O)c1cc(F)cnc1N1CCC2(CCC[N@H+]2Cc2csc(C)n2)CC1 ZINC001164693319 719803913 /nfs/dbraw/zinc/80/39/13/719803913.db2.gz RZNVWYZINOQSTG-UHFFFAOYSA-N 1 1 404.511 3.407 20 0 HGADMO Cc1nc(C[N@H+]2CCCC23CCN(c2ccc(Cn4cncn4)cn2)CC3)cs1 ZINC001164692024 719813919 /nfs/dbraw/zinc/81/39/19/719813919.db2.gz KTBIVZSAMDBXNZ-UHFFFAOYSA-N 1 1 409.563 3.121 20 0 HGADMO COC(=O)[C@]1(C)C[C@@H]([NH+]2CCOCC2)CCN1c1nccc2cc(F)c(Cl)cc21 ZINC001164702329 719876166 /nfs/dbraw/zinc/87/61/66/719876166.db2.gz IIZAFSLONMKFIB-BTYIYWSLSA-N 1 1 421.900 3.260 20 0 HGADMO c1csc(C[N@H+]2CCOC3(CCN(c4ccc(N5CCCCC5)nn4)CC3)C2)c1 ZINC001164701443 719886242 /nfs/dbraw/zinc/88/62/42/719886242.db2.gz NOSKBWZXDNUAQG-UHFFFAOYSA-N 1 1 413.591 3.400 20 0 HGADMO COc1c(Cl)nc(C)nc1N1CCC2(CC1)C[N@@H+](Cc1cccs1)CCO2 ZINC001164699032 719892300 /nfs/dbraw/zinc/89/23/00/719892300.db2.gz VZIFSEFEIPFHBS-UHFFFAOYSA-N 1 1 408.955 3.380 20 0 HGADMO Cc1noc(-c2ccc(N3CCC4(CC3)C[N@@H+](Cc3cccs3)CCO4)nc2)n1 ZINC001164707883 719899343 /nfs/dbraw/zinc/89/93/43/719899343.db2.gz YCSYBHXPQBLXLI-UHFFFAOYSA-N 1 1 411.531 3.373 20 0 HGADMO c1csc(C[N@H+]2CCOC3(CCN(c4ccc(-c5ccncc5)nn4)CC3)C2)c1 ZINC001164706271 719900160 /nfs/dbraw/zinc/90/01/60/719900160.db2.gz GPFKQRHDKYHDKG-UHFFFAOYSA-N 1 1 407.543 3.472 20 0 HGADMO CC(C)COc1nccnc1N1CCC2(CC1)C[N@@H+](Cc1cccs1)CCO2 ZINC001164707508 719902185 /nfs/dbraw/zinc/90/21/85/719902185.db2.gz RZEYPAOVYGYPBK-UHFFFAOYSA-N 1 1 402.564 3.444 20 0 HGADMO CCOC(=O)c1cc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COC)ncc1Cl ZINC001164814245 720076481 /nfs/dbraw/zinc/07/64/81/720076481.db2.gz WIUBOTWRSROELX-IERDGZPVSA-N 1 1 407.942 3.096 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(C(F)(F)Oc1cccnc1Cl)C2 ZINC001164807385 720090381 /nfs/dbraw/zinc/09/03/81/720090381.db2.gz FHPIEFBFZQBZJG-MAUKXSAKSA-N 1 1 401.885 3.344 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(C(F)(F)Oc1cccc(Cl)n1)C2 ZINC001164809787 720095720 /nfs/dbraw/zinc/09/57/20/720095720.db2.gz KHDJNIOQLURODM-QAPCUYQASA-N 1 1 401.885 3.344 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(C(F)(F)c1ccc(OC)nc1Cl)C2 ZINC001164811737 720112198 /nfs/dbraw/zinc/11/21/98/720112198.db2.gz NBJURTGXLJSHMH-HNAYVOBHSA-N 1 1 415.912 3.473 20 0 HGADMO COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1ccc(C(=O)OC)c(C)n1)CC2 ZINC001164716186 720113701 /nfs/dbraw/zinc/11/37/01/720113701.db2.gz JIZVIDWQQVFRLS-HXUWFJFHSA-N 1 1 424.545 3.079 20 0 HGADMO COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1cc(OC)cc(OC)n1)CC2 ZINC001164717321 720117606 /nfs/dbraw/zinc/11/76/06/720117606.db2.gz NEAHREHKAWXBKM-IBGZPJMESA-N 1 1 412.534 3.001 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1nc(Cl)nc3cccc(OC)c31)C2 ZINC001164814378 720125145 /nfs/dbraw/zinc/12/51/45/720125145.db2.gz SDIDVPXIZIUKQK-ZHRRBRCNSA-N 1 1 416.953 3.477 20 0 HGADMO COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1nc(Cl)c(F)cc1N)CC2 ZINC001164714776 720133194 /nfs/dbraw/zinc/13/31/94/720133194.db2.gz YVPRKRZMRVRWAO-MRXNPFEDSA-N 1 1 419.932 3.359 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1ccc3cc(OC)c(OC)cc3n1)C2 ZINC001164807005 720134256 /nfs/dbraw/zinc/13/42/56/720134256.db2.gz ADDVZXWIMCMOEU-DVECYGJZSA-N 1 1 411.546 3.437 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1ncc(C(N)=S)c3ccsc31)C2 ZINC001164814642 720203971 /nfs/dbraw/zinc/20/39/71/720203971.db2.gz VPALYQLZGVNIOY-QVKFZJNVSA-N 1 1 416.616 3.115 20 0 HGADMO CC(C)[N@@H+](C)Cc1cc(=O)n2c(n1)CN(c1ncc3cc(Cl)ccc3n1)CCC2 ZINC001164814710 720225761 /nfs/dbraw/zinc/22/57/61/720225761.db2.gz WCYJWZNWLUAYAJ-UHFFFAOYSA-N 1 1 412.925 3.090 20 0 HGADMO CCOC(=O)c1c(Cl)cc(C)nc1N1CC[C@@H]2[C@H]1CC[N@H+]2Cc1cccnc1 ZINC001164722996 720336587 /nfs/dbraw/zinc/33/65/87/720336587.db2.gz GQIVMBLBTQYXEY-QZTJIDSGSA-N 1 1 400.910 3.468 20 0 HGADMO CCN(CC)C(=O)c1cc(Cl)nc(N2CC[C@H]3[C@@H]2CC[N@H+]3Cc2cccnc2)c1 ZINC001164731315 720395388 /nfs/dbraw/zinc/39/53/88/720395388.db2.gz ZCBVOBMYAUTLJQ-OALUTQOASA-N 1 1 413.953 3.465 20 0 HGADMO CC1CCN(C(=O)c2ccc(N3CC[C@@H]4[C@H]3CC[N@H+]4Cc3cccnc3)nc2)CC1 ZINC001164734521 720436180 /nfs/dbraw/zinc/43/61/80/720436180.db2.gz SYKTXNDIVCFIFE-FGZHOGPDSA-N 1 1 405.546 3.202 20 0 HGADMO CCOC(=O)c1ccc(C)c(N2CC[C@@H]3[C@H](C[C@@H](Cn4cccn4)[N@H+]3C(C)C)C2)n1 ZINC001164832843 720506018 /nfs/dbraw/zinc/50/60/18/720506018.db2.gz BNJNNOHRYYHSSS-SVFBPWRDSA-N 1 1 411.550 3.141 20 0 HGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@H]2CN(C(F)(F)c3nccc(Cl)n3)CC[C@@H]21 ZINC001164840023 720515007 /nfs/dbraw/zinc/51/50/07/720515007.db2.gz VUMIWFLJVKDCFP-JYJNAYRXSA-N 1 1 410.900 3.249 20 0 HGADMO CCOC(=O)c1cnc(N2CC[C@@H]3[C@H](C[C@H](Cn4cccn4)[N@H+]3C(C)C)C2)c(C)c1 ZINC001164837111 720524652 /nfs/dbraw/zinc/52/46/52/720524652.db2.gz NQBIZDUDJYCQSX-NJDAHSKKSA-N 1 1 411.550 3.141 20 0 HGADMO CC(C)[N@@H+]1[C@@H]2CCN(c3ccnc(-c4cccnc4)n3)C[C@H]2C[C@H]1Cn1cccn1 ZINC001164835442 720558264 /nfs/dbraw/zinc/55/82/64/720558264.db2.gz HJHFTHLXUSOCIG-QHAWAJNXSA-N 1 1 403.534 3.113 20 0 HGADMO CC(C)[N@@H+]1[C@@H]2CCN(c3ncnc4cc(Cl)cnc43)C[C@@H]2C[C@H]1Cn1cccn1 ZINC001164836609 720558782 /nfs/dbraw/zinc/55/87/82/720558782.db2.gz KFFDUNBSINZJBT-VDZJLULYSA-N 1 1 411.941 3.253 20 0 HGADMO CC(C)[N@@H+]1[C@@H]2CCN(c3nccc(N4CCCCC4)n3)C[C@@H]2C[C@H]1Cn1cccn1 ZINC001164837399 720568896 /nfs/dbraw/zinc/56/88/96/720568896.db2.gz MGVXQIBBNXAMLL-PCCBWWKXSA-N 1 1 409.582 3.041 20 0 HGADMO C=Cc1nc(Cl)nc(N2CC[C@@H]3[C@@H](C[C@H](Cn4cccn4)[N@H+]3C(C)C)C2)c1OC ZINC001164841185 720594738 /nfs/dbraw/zinc/59/47/38/720594738.db2.gz RRFXBGUNBFFPPG-LZLYRXPVSA-N 1 1 416.957 3.356 20 0 HGADMO COc1nnc(N2CC[C@@H]3[C@@H](C[C@H](Cn4cccn4)[N@H+]3C(C)C)C2)c2ccccc21 ZINC001164839225 720601163 /nfs/dbraw/zinc/60/11/63/720601163.db2.gz MLGZURKGPKKVQF-WAOWUJCRSA-N 1 1 406.534 3.213 20 0 HGADMO Clc1ccc2nc(Cl)nc(N3CC[N@H+]4C[C@@H](Oc5cncnc5)C[C@H]4C3)c2c1 ZINC001164745072 720606883 /nfs/dbraw/zinc/60/68/83/720606883.db2.gz UHGKALSVHGOEKF-KBPBESRZSA-N 1 1 417.300 3.069 20 0 HGADMO CC(C)[N@@H+]1[C@@H]2CCN(c3cc(-c4ccncc4)ncn3)C[C@H]2C[C@H]1Cn1cccn1 ZINC001164841337 720613614 /nfs/dbraw/zinc/61/36/14/720613614.db2.gz RWQLLDIHLCMWLS-RZUBCFFCSA-N 1 1 403.534 3.113 20 0 HGADMO CC(C)[N@@H+]1[C@@H]2CCN(c3ccc(-c4ccccn4)nn3)C[C@@H]2C[C@H]1Cn1cccn1 ZINC001164841662 720621735 /nfs/dbraw/zinc/62/17/35/720621735.db2.gz UAZWXTWACXEGAK-CNNODRBYSA-N 1 1 403.534 3.113 20 0 HGADMO CSc1cc(N2CC[C@@H]3[C@@H](C[C@H](Cn4cccn4)[N@H+]3C(C)C)C2)nc(SC)n1 ZINC001164839788 720644812 /nfs/dbraw/zinc/64/48/12/720644812.db2.gz KGUTXFWBLKKFLA-GVDBMIGSSA-N 1 1 418.636 3.495 20 0 HGADMO Clc1cc(Cl)c(N2CC[N@@H+]3C[C@H](Oc4cncnc4)C[C@@H]3C2)c(Cl)n1 ZINC001164738190 720656446 /nfs/dbraw/zinc/65/64/46/720656446.db2.gz IMEIDNSGMMLAFK-GHMZBOCLSA-N 1 1 400.697 3.174 20 0 HGADMO Clc1cc(Cl)c(N2CC[N@H+]3C[C@H](Oc4cncnc4)C[C@@H]3C2)c(Cl)n1 ZINC001164738190 720656458 /nfs/dbraw/zinc/65/64/58/720656458.db2.gz IMEIDNSGMMLAFK-GHMZBOCLSA-N 1 1 400.697 3.174 20 0 HGADMO C[N@@H+](Cc1ccccc1)[C@H]1COC2(C1)CCN(c1ccc(C(=O)NC3CC3)cn1)CC2 ZINC001164843402 720694832 /nfs/dbraw/zinc/69/48/32/720694832.db2.gz PPGMMMLKDLOOLH-JOCHJYFZSA-N 1 1 420.557 3.234 20 0 HGADMO CCNC(=O)c1cccnc1N1CCC2(C[C@H]([N@@H+](C)Cc3ccccc3)CO2)CC1 ZINC001164839720 720700010 /nfs/dbraw/zinc/70/00/10/720700010.db2.gz BNMQVDNLAAAOHC-FQEVSTJZSA-N 1 1 408.546 3.091 20 0 HGADMO CCOC(=O)Cc1ccnc(N2CCC3(C[C@@H]([N@@H+](C)Cc4ccccc4)CO3)CC2)c1 ZINC001164836915 720728206 /nfs/dbraw/zinc/72/82/06/720728206.db2.gz BVKUADJDPCCYRP-JOCHJYFZSA-N 1 1 423.557 3.447 20 0 HGADMO CC(C)(C)c1cc(N2CC[N@H+]3C[C@@H](Oc4cncnc4)C[C@H]3C2)nc(C(C)(C)C)n1 ZINC001164737240 720755663 /nfs/dbraw/zinc/75/56/63/720755663.db2.gz BGXXWHTZJITIKF-IRXDYDNUSA-N 1 1 410.566 3.204 20 0 HGADMO CC[C@H](C)c1nc(Cl)c(C)c(N2CC[N@H+]3C[C@@H](Oc4cncnc4)C[C@@H]3C2)n1 ZINC001164745961 720800887 /nfs/dbraw/zinc/80/08/87/720800887.db2.gz KZVKQMIKWFTOPT-IMJJTQAJSA-N 1 1 402.930 3.084 20 0 HGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2C[C@@H]3C(=O)N(Cc4ccncc4)C[C@@H]3C2)nc1 ZINC001164853574 720814067 /nfs/dbraw/zinc/81/40/67/720814067.db2.gz QOOGRTLWHGJLDY-FDFHNCONSA-N 1 1 405.546 3.118 20 0 HGADMO Clc1ccnc2cc(N3CC[C@@H]4[C@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)ncc12 ZINC001164742113 720825971 /nfs/dbraw/zinc/82/59/71/720825971.db2.gz PWMYTJAHZKZCJG-LLGFUMIMSA-N 1 1 423.952 3.254 20 0 HGADMO F[C@H](c1ccnc(Cl)c1)N1CC[C@@H]2[C@@H](C[C@@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164744621 720828028 /nfs/dbraw/zinc/82/80/28/720828028.db2.gz VPYSRWBOKQBMCC-GNBUJSLZSA-N 1 1 404.921 3.170 20 0 HGADMO Clc1ccc2cnc(N3CC[C@@H]4[C@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)nc2c1 ZINC001164748759 720834104 /nfs/dbraw/zinc/83/41/04/720834104.db2.gz UVMFJQWIOLVYCN-YFVAEKQCSA-N 1 1 423.952 3.254 20 0 HGADMO Clc1ccnc2nc(N3CC[C@@H]4[C@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)ccc12 ZINC001164742977 720835051 /nfs/dbraw/zinc/83/50/51/720835051.db2.gz HQQTUOALANNEQS-FUHIMQAGSA-N 1 1 423.952 3.254 20 0 HGADMO COCC[N@H+]1CCO[C@H]2CN(C(F)(F)c3cc(Cl)ncc3Cl)CC[C@@H]2C1 ZINC001164855168 720835941 /nfs/dbraw/zinc/83/59/41/720835941.db2.gz SVCHRITVJOKSDO-DOMZBBRYSA-N 1 1 410.292 3.107 20 0 HGADMO c1csc(-c2ccc(N3CC[C@@H]4[C@@H](C[C@H](Cn5cncn5)[N@@H+]4CC4CC4)C3)nn2)c1 ZINC001164751124 720836097 /nfs/dbraw/zinc/83/60/97/720836097.db2.gz YNPRRLRFRVPDRM-NLWGTHIKSA-N 1 1 421.574 3.176 20 0 HGADMO COCC[N@H+]1CCO[C@@H]2CN(C(F)(F)c3cc(Cl)ncc3Cl)CC[C@H]2C1 ZINC001164855173 720836197 /nfs/dbraw/zinc/83/61/97/720836197.db2.gz SVCHRITVJOKSDO-SWLSCSKDSA-N 1 1 410.292 3.107 20 0 HGADMO COCC[N@H+]1CCO[C@@H]2CN(C(F)(F)c3cc(Cl)cnc3Cl)CC[C@H]2C1 ZINC001164856524 720836811 /nfs/dbraw/zinc/83/68/11/720836811.db2.gz WSDOOMZNMKRDRA-SWLSCSKDSA-N 1 1 410.292 3.107 20 0 HGADMO Fc1cccc2ccc(N3CC[C@@H]4[C@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)nc12 ZINC001164742392 720841882 /nfs/dbraw/zinc/84/18/82/720841882.db2.gz GEODDBNWWGOUSX-SVFBPWRDSA-N 1 1 406.509 3.345 20 0 HGADMO COCC[N@H+]1CCO[C@@H]2CN(c3nc(Cl)nc4c(Cl)cccc43)CC[C@@H]2C1 ZINC001164851453 720850608 /nfs/dbraw/zinc/85/06/08/720850608.db2.gz HGHOSPPWIZKBOH-CZUORRHYSA-N 1 1 411.333 3.110 20 0 HGADMO Cc1cc(N2CC[C@@H]3[C@@H](C[C@@H](Cn4cncn4)[N@H+]3CC3CC3)C2)nc(C(C)(C)C)n1 ZINC001164744579 720850987 /nfs/dbraw/zinc/85/09/87/720850987.db2.gz KSJJDSIOIPMSOR-SLFFLAALSA-N 1 1 409.582 3.053 20 0 HGADMO Cc1cc2ncnc(N3CC[C@@H]4[C@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)c2cc1C ZINC001164751123 720856195 /nfs/dbraw/zinc/85/61/95/720856195.db2.gz QCCOEQUCZKRYGY-TXTKFYIRSA-N 1 1 417.561 3.218 20 0 HGADMO c1ncn(C[C@@H]2C[C@H]3CN(c4nccc5c6c([nH]c54)CCC6)CC[C@H]3[N@H+]2CC2CC2)n1 ZINC001164753873 720857730 /nfs/dbraw/zinc/85/77/30/720857730.db2.gz YUWJZZIGOPYDQE-NPPFBWRTSA-N 1 1 417.561 3.023 20 0 HGADMO Cc1cc(C)nc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COCc2cccnc2)n1 ZINC001164748449 720869838 /nfs/dbraw/zinc/86/98/38/720869838.db2.gz DXOJWWPVYVEGNW-LADGPHEKSA-N 1 1 407.562 3.244 20 0 HGADMO CCc1cnc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COCc2cccnc2)nc1 ZINC001164750881 720871076 /nfs/dbraw/zinc/87/10/76/720871076.db2.gz KDYOACUUCDMTPN-ISKFKSNPSA-N 1 1 407.562 3.189 20 0 HGADMO Clc1cncc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COCc2cccnc2)n1 ZINC001164747942 720871978 /nfs/dbraw/zinc/87/19/78/720871978.db2.gz CQPIJNXMTSQWRW-DENIHFKCSA-N 1 1 413.953 3.280 20 0 HGADMO CCOc1ccc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COCc2cccnc2)nn1 ZINC001164750520 720873082 /nfs/dbraw/zinc/87/30/82/720873082.db2.gz JFRNTRAUSXXHJM-ZJSXRUAMSA-N 1 1 423.561 3.025 20 0 HGADMO Cc1ncc(F)c(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COCc2cccnc2)n1 ZINC001164752913 720879150 /nfs/dbraw/zinc/87/91/50/720879150.db2.gz NLELSHWUZNHXPI-OFNKIYASSA-N 1 1 411.525 3.074 20 0 HGADMO Cc1nc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COCc2cccnc2)ncc1F ZINC001164755063 720886705 /nfs/dbraw/zinc/88/67/05/720886705.db2.gz KMRNXVYJBRGGFU-REWPJTCUSA-N 1 1 411.525 3.074 20 0 HGADMO COCC[N@H+]1CCO[C@H]2CN(C(F)(F)Sc3ccc(Cl)nc3)CC[C@@H]2C1 ZINC001164860007 720890071 /nfs/dbraw/zinc/89/00/71/720890071.db2.gz NVAZILHLZPEFSU-HIFRSBDPSA-N 1 1 407.914 3.047 20 0 HGADMO COCC[N@H+]1CCO[C@@H]2CN(C(F)(F)Sc3ccc(Cl)nc3)CC[C@@H]2C1 ZINC001164860008 720890393 /nfs/dbraw/zinc/89/03/93/720890393.db2.gz NVAZILHLZPEFSU-UKRRQHHQSA-N 1 1 407.914 3.047 20 0 HGADMO COCC[N@H+]1CCO[C@@H]2CN(c3c(Cl)ccc4c(Cl)ncnc43)CC[C@@H]2C1 ZINC001164863848 720891069 /nfs/dbraw/zinc/89/10/69/720891069.db2.gz UUQWCKLHGONBPQ-CZUORRHYSA-N 1 1 411.333 3.110 20 0 HGADMO CCc1ccc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COCc2cccnc2)nn1 ZINC001164758435 720897988 /nfs/dbraw/zinc/89/79/88/720897988.db2.gz YCEWLAWMHUCHBN-QPPBQGQZSA-N 1 1 407.562 3.189 20 0 HGADMO COC(=O)c1ccc2nc(N3CCn4c(C[N@@H+](C)C(C)C)cnc4[C@H]3C)ncc2c1 ZINC001164853953 720935098 /nfs/dbraw/zinc/93/50/98/720935098.db2.gz CNMROEMXVWAGSL-OAHLLOKOSA-N 1 1 408.506 3.034 20 0 HGADMO FC(F)(c1cc(C2CC2)nnc1Cl)N1CCc2[nH+]cc(Cn3cccn3)n2CC1 ZINC001164861129 721033436 /nfs/dbraw/zinc/03/34/36/721033436.db2.gz COSYKXQBGMARHV-UHFFFAOYSA-N 1 1 419.867 3.056 20 0 HGADMO FC(F)(Sc1ccc(Cl)nc1)N1CCc2[nH+]cc(Cn3cccn3)n2CC1 ZINC001164862634 721033512 /nfs/dbraw/zinc/03/35/12/721033512.db2.gz NJMPCFCPLFOIMR-UHFFFAOYSA-N 1 1 410.881 3.377 20 0 HGADMO COc1cc(C(F)(F)N2CC[N@H+]3C[C@@H](OCc4cccnc4)C[C@@H]3C2)cc(Cl)n1 ZINC001164867790 721053939 /nfs/dbraw/zinc/05/39/39/721053939.db2.gz KLJXYCWRMSQCDR-SJORKVTESA-N 1 1 424.879 3.163 20 0 HGADMO FC(F)(Oc1cccnc1Cl)N1CC[N@H+]2C[C@@H](OCc3cccnc3)C[C@@H]2C1 ZINC001164867954 721064919 /nfs/dbraw/zinc/06/49/19/721064919.db2.gz LJIGDVYBRKNOMS-CVEARBPZSA-N 1 1 410.852 3.034 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4ccc(-c5ccc(Cl)cc5)nn4)C[C@H]3C2)cn1 ZINC001164766627 721087285 /nfs/dbraw/zinc/08/72/85/721087285.db2.gz KYSNERGQJCIDDL-RTBURBONSA-N 1 1 408.937 3.489 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4nc(Cl)nc5cccc(F)c54)C[C@H]3C2)cn1 ZINC001164773929 721108741 /nfs/dbraw/zinc/10/87/41/721108741.db2.gz ZHLBBWOWMBDRJD-LSDHHAIUSA-N 1 1 400.889 3.114 20 0 HGADMO CCOC(=O)c1cc(N2C[C@H]3CC[N@@H+](Cc4cnn(C)c4)C[C@@H]3C2)nc2ccccc21 ZINC001164769014 721125857 /nfs/dbraw/zinc/12/58/57/721125857.db2.gz OTYGXKRIBRHWFM-RTBURBONSA-N 1 1 419.529 3.103 20 0 HGADMO CC(C)(C)c1cc(Cl)nc(N2CC[N@H+]3C[C@H](OCc4cccnc4)C[C@H]3C2)n1 ZINC001164872615 721128088 /nfs/dbraw/zinc/12/80/88/721128088.db2.gz HXWHLZCVOXFKNA-DLBZAZTESA-N 1 1 401.942 3.302 20 0 HGADMO CC(C)(C)c1cc(Cl)nc(N2CC[N@H+]3C[C@H](OCc4cccnc4)C[C@@H]3C2)n1 ZINC001164872616 721128680 /nfs/dbraw/zinc/12/86/80/721128680.db2.gz HXWHLZCVOXFKNA-IAGOWNOFSA-N 1 1 401.942 3.302 20 0 HGADMO Cc1ccc(-c2ccc(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@@H]4C3)nn2)cc1 ZINC001164880445 721137950 /nfs/dbraw/zinc/13/79/50/721137950.db2.gz WRVPPKWPIFZYTK-YADHBBJMSA-N 1 1 401.514 3.327 20 0 HGADMO c1cncc(CO[C@H]2C[C@@H]3CN(c4ncnc5sc6c(c54)CCC6)CC[N@H+]3C2)c1 ZINC001164876443 721139640 /nfs/dbraw/zinc/13/96/40/721139640.db2.gz MLDVJRXKMUXIGJ-SJORKVTESA-N 1 1 407.543 3.055 20 0 HGADMO Cc1cccc(-c2ccc(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@H]4C3)nn2)c1 ZINC001164878970 721146217 /nfs/dbraw/zinc/14/62/17/721146217.db2.gz RDGAAKFPKNMLNH-VXKWHMMOSA-N 1 1 401.514 3.327 20 0 HGADMO COc1ccccc1-c1ccc(N2CC[N@H+]3C[C@@H](OCc4cccnc4)C[C@@H]3C2)nn1 ZINC001164872509 721146356 /nfs/dbraw/zinc/14/63/56/721146356.db2.gz HJVWIQARMKVMHK-UXHICEINSA-N 1 1 417.513 3.027 20 0 HGADMO Fc1ccc(-c2ccc(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@@H]4C3)nn2)cc1 ZINC001164874573 721156395 /nfs/dbraw/zinc/15/63/95/721156395.db2.gz KSTDSHGXTKLHFY-RTWAWAEBSA-N 1 1 405.477 3.157 20 0 HGADMO Fc1ccc(-c2ccc(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@@H]4C3)nn2)cc1 ZINC001164874572 721157819 /nfs/dbraw/zinc/15/78/19/721157819.db2.gz KSTDSHGXTKLHFY-NHCUHLMSSA-N 1 1 405.477 3.157 20 0 HGADMO Cc1cc(N2CC[N@H+]3C[C@@H](OCc4cccnc4)C[C@@H]3C2)nc(-c2cccs2)n1 ZINC001164872228 721161463 /nfs/dbraw/zinc/16/14/63/721161463.db2.gz HAFILQZRSQZXDM-MOPGFXCFSA-N 1 1 407.543 3.388 20 0 HGADMO Fc1ccccc1-c1ccc(N2CC[N@H+]3C[C@@H](OCc4cccnc4)C[C@@H]3C2)nn1 ZINC001164877633 721163616 /nfs/dbraw/zinc/16/36/16/721163616.db2.gz PJPGKZHWGYNQBH-MOPGFXCFSA-N 1 1 405.477 3.157 20 0 HGADMO Cc1nc(C)c(-c2ccc(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@H]4C3)nn2)s1 ZINC001164873550 721172802 /nfs/dbraw/zinc/17/28/02/721172802.db2.gz IOYDERMBNDBGML-RBUKOAKNSA-N 1 1 422.558 3.092 20 0 HGADMO CSc1ccc2ncnc(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@H]4C3)c2c1 ZINC001164878640 721180524 /nfs/dbraw/zinc/18/05/24/721180524.db2.gz QTWPWRHSLOSFGB-ROUUACIJSA-N 1 1 407.543 3.226 20 0 HGADMO CC(C)n1ccc2c1nc(Cl)nc2N1C[C@@H]2CC[N@@H+](Cc3cnn(C)c3)C[C@H]2C1 ZINC001164771440 721184909 /nfs/dbraw/zinc/18/49/09/721184909.db2.gz PVBLRPXTMJMCMD-IRXDYDNUSA-N 1 1 413.957 3.357 20 0 HGADMO CCc1nc2sc3c(c2c(N2C[C@@H]4C[N@H+](Cc5cnn(C)c5)CC[C@@H]4C2)n1)CCC3 ZINC001164771829 721195562 /nfs/dbraw/zinc/19/55/62/721195562.db2.gz RBLDZVNIWIFQHO-SJORKVTESA-N 1 1 422.602 3.434 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4ccc(-c5c(F)cccc5F)nn4)C[C@H]3C2)cn1 ZINC001164771883 721215759 /nfs/dbraw/zinc/21/57/59/721215759.db2.gz RRZFJMUFEABVPG-IAGOWNOFSA-N 1 1 410.472 3.114 20 0 HGADMO CCOc1ccc(-c2ccc(N3C[C@H]4CC[N@@H+](Cc5cnn(C)c5)C[C@@H]4C3)nn2)cc1 ZINC001164770101 721217254 /nfs/dbraw/zinc/21/72/54/721217254.db2.gz NBCPWSSIWJCMJX-NHCUHLMSSA-N 1 1 418.545 3.234 20 0 HGADMO CCN1C(=O)[C@]2(CC[C@@H]3CN(c4ccc([C@H]5CCCC[N@H+]5CC)cn4)C[C@H]32)N=C1C ZINC001164876234 721234477 /nfs/dbraw/zinc/23/44/77/721234477.db2.gz YWUFKWXJEXYYMQ-GECPAALWSA-N 1 1 409.578 3.494 20 0 HGADMO C[NH+]1CCC(Oc2ccnc(N3CC[C@@H]4O[C@H](COc5cccnc5)CC[C@@H]43)c2)CC1 ZINC001164872738 721252014 /nfs/dbraw/zinc/25/20/14/721252014.db2.gz FPVNHILDEMFTHC-VABKMULXSA-N 1 1 424.545 3.155 20 0 HGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@@]2(CCCN(c3nc(C)nc4ccoc43)C2)C1 ZINC001164778070 721332206 /nfs/dbraw/zinc/33/22/06/721332206.db2.gz UGCNCYIRRXZIBJ-QFIPXVFZSA-N 1 1 411.506 3.255 20 0 HGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@]2(CCCN(c3nccc4ncccc43)C2)C1 ZINC001164778404 721338041 /nfs/dbraw/zinc/33/80/41/721338041.db2.gz VLWDZRVMNVYJJX-HSZRJFAPSA-N 1 1 407.518 3.354 20 0 HGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@@]2(CCCN(c3cnc(-c4ccco4)cn3)C2)C1 ZINC001164779398 721346549 /nfs/dbraw/zinc/34/65/49/721346549.db2.gz SYBYWGFBKSEIIW-QHCPKHFHSA-N 1 1 423.517 3.460 20 0 HGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@@]2(CCCN(c3cnc(-c4ccco4)cn3)C2)C1 ZINC001164779398 721346553 /nfs/dbraw/zinc/34/65/53/721346553.db2.gz SYBYWGFBKSEIIW-QHCPKHFHSA-N 1 1 423.517 3.460 20 0 HGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@@]2(CCCN(c3ccc4ncccc4n3)C2)C1 ZINC001164779047 721347564 /nfs/dbraw/zinc/34/75/64/721347564.db2.gz PNYFAVGLLAHRNR-QHCPKHFHSA-N 1 1 407.518 3.354 20 0 HGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@]2(CCCN(c3ncc(Cl)nc3C)C2)C1 ZINC001164776471 721352774 /nfs/dbraw/zinc/35/27/74/721352774.db2.gz BYJPLCMSPVOOAP-HXUWFJFHSA-N 1 1 405.930 3.162 20 0 HGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@]2(CCCN(c3ncc(Cl)nc3C)C2)C1 ZINC001164776471 721352775 /nfs/dbraw/zinc/35/27/75/721352775.db2.gz BYJPLCMSPVOOAP-HXUWFJFHSA-N 1 1 405.930 3.162 20 0 HGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@@]2(CCCN(c3nc(C)c(Cl)c(C)n3)C2)C1 ZINC001164786069 721355742 /nfs/dbraw/zinc/35/57/42/721355742.db2.gz VQKKZTUGHYYXBB-NRFANRHFSA-N 1 1 419.957 3.471 20 0 HGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@@]2(CCCN(c3nc(C)c(Cl)c(C)n3)C2)C1 ZINC001164786069 721355745 /nfs/dbraw/zinc/35/57/45/721355745.db2.gz VQKKZTUGHYYXBB-NRFANRHFSA-N 1 1 419.957 3.471 20 0 HGADMO C[NH+]1CCN(C[C@H]2CCC[C@]3(CCN(C(F)(F)c4cccc(Cl)n4)C3)O2)CC1 ZINC001164894578 721382467 /nfs/dbraw/zinc/38/24/67/721382467.db2.gz ZDFRDEBACHWHNJ-VQIMIIECSA-N 1 1 414.928 3.045 20 0 HGADMO C[NH+]1CCN(C[C@H]2CCC[C@@]3(CCN(c4ncnc5ccc(Cl)cc54)C3)O2)CC1 ZINC001164892260 721392735 /nfs/dbraw/zinc/39/27/35/721392735.db2.gz SMSKQCDKAVEKKO-GCJKJVERSA-N 1 1 415.969 3.049 20 0 HGADMO CCOC(=O)c1cnc(Cl)c(C)c1N1C[C@@H]2C[NH+](Cc3nccs3)C[C@H]2C1 ZINC001164783949 721413783 /nfs/dbraw/zinc/41/37/83/721413783.db2.gz JKKLLHUTPKXMQM-KBPBESRZSA-N 1 1 406.939 3.245 20 0 HGADMO CC(C)(C)NC(=O)c1ccc(Cl)nc1N1C[C@@H]2C[NH+](Cc3nccs3)C[C@H]2C1 ZINC001164791055 721414734 /nfs/dbraw/zinc/41/47/34/721414734.db2.gz ZDEWLSSOJGCRQB-KBPBESRZSA-N 1 1 419.982 3.288 20 0 HGADMO C[NH+]1CCN(C[C@@H]2CCC[C@]3(CCN(c4ccc5c(Cl)ccnc5n4)C3)O2)CC1 ZINC001164889518 721419637 /nfs/dbraw/zinc/41/96/37/721419637.db2.gz RJEZUUNNRWPRSH-HTAPYJJXSA-N 1 1 415.969 3.049 20 0 HGADMO CC(C)(C)OC(=O)Nc1ccc(N2C[C@@H]3C[N@@H+](Cc4nccs4)C[C@@H]3C2)nc1 ZINC001164788060 721423572 /nfs/dbraw/zinc/42/35/72/721423572.db2.gz RXAKGPAOVWBECE-GASCZTMLSA-N 1 1 401.536 3.453 20 0 HGADMO CC(C)(C)OC(=O)Nc1ccc(N2C[C@@H]3C[N@H+](Cc4nccs4)C[C@@H]3C2)nc1 ZINC001164788060 721423575 /nfs/dbraw/zinc/42/35/75/721423575.db2.gz RXAKGPAOVWBECE-GASCZTMLSA-N 1 1 401.536 3.453 20 0 HGADMO Cc1cc(N2C[C@@H]3C[NH+](Cc4nccs4)C[C@H]3C2)nc(NC(=O)c2ccccc2)n1 ZINC001164791258 721433425 /nfs/dbraw/zinc/43/34/25/721433425.db2.gz ZSKNLLMVRXIXPJ-ROUUACIJSA-N 1 1 420.542 3.062 20 0 HGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1nc(C)cnc1Cl)CC2 ZINC001164783921 721460714 /nfs/dbraw/zinc/46/07/14/721460714.db2.gz GJMWAZZLHTYQHC-SFHVURJKSA-N 1 1 408.974 3.172 20 0 HGADMO C[N@@H+](Cc1ccc(N2Cc3nccn3C[C@H](COCc3ccccn3)C2)nc1)C1CC1 ZINC001164888974 721470524 /nfs/dbraw/zinc/47/05/24/721470524.db2.gz GTARGSWODHANFV-FQEVSTJZSA-N 1 1 418.545 3.121 20 0 HGADMO COC(=O)c1c[n-]c2nc[nH+]c(N3CCC4(CC([N@@H+](C)Cc5ccncc5)C4)CC3)c12 ZINC001164793000 721497339 /nfs/dbraw/zinc/49/73/39/721497339.db2.gz YFIQILOVLIIPTR-UHFFFAOYSA-N 1 1 420.517 3.021 20 0 HGADMO COC(=O)c1c[nH]c2ncnc(N3CCC4(CC([N@H+](C)Cc5ccncc5)C4)CC3)c12 ZINC001164793000 721497348 /nfs/dbraw/zinc/49/73/48/721497348.db2.gz YFIQILOVLIIPTR-UHFFFAOYSA-N 1 1 420.517 3.021 20 0 HGADMO COC(=O)c1c[nH]c2ncnc(N3CCC4(CC([N@@H+](C)Cc5ccncc5)C4)CC3)c12 ZINC001164793000 721497351 /nfs/dbraw/zinc/49/73/51/721497351.db2.gz YFIQILOVLIIPTR-UHFFFAOYSA-N 1 1 420.517 3.021 20 0 HGADMO CNC(=O)c1nc(N2CCC3(CC([N@@H+](C)Cc4ccncc4)C3)CC2)ccc1Cl ZINC001164792562 721497465 /nfs/dbraw/zinc/49/74/65/721497465.db2.gz QVXLJBUOOJQXGA-UHFFFAOYSA-N 1 1 413.953 3.371 20 0 HGADMO COc1cnc2c(c1)ncnc2N1CCC2(CC([N@@H+](C)Cc3ccncc3)C2)CC1 ZINC001164795759 721498525 /nfs/dbraw/zinc/49/85/25/721498525.db2.gz LTMKHHCVMULBGS-UHFFFAOYSA-N 1 1 404.518 3.309 20 0 HGADMO COC(=O)c1ccc(Cl)nc1N1CC[N@H+]2C[C@@H](Oc3cccc(F)c3)C[C@H]2C1 ZINC001164901711 721510407 /nfs/dbraw/zinc/51/04/07/721510407.db2.gz YDTBOJGHHCMLOC-HOCLYGCPSA-N 1 1 405.857 3.003 20 0 HGADMO CCOC(=O)/C=C\c1cccnc1N1CC[N@H+]2C[C@H](Oc3cccc(F)c3)C[C@@H]2C1 ZINC001164902232 721513574 /nfs/dbraw/zinc/51/35/74/721513574.db2.gz ZZNUCMNUTZVNKX-BVUSGXHMSA-N 1 1 411.477 3.139 20 0 HGADMO COC(=O)c1cc(Cl)nc(N2CC[N@H+]3C[C@@H](Oc4cccc(F)c4)C[C@@H]3C2)c1 ZINC001164900663 721514142 /nfs/dbraw/zinc/51/41/42/721514142.db2.gz SORNLRDCRBXZTC-WBVHZDCISA-N 1 1 405.857 3.003 20 0 HGADMO COC(=O)c1cc(Cl)nc(N2CC[N@H+]3C[C@@H](Oc4cccc(F)c4)C[C@H]3C2)c1 ZINC001164900662 721514450 /nfs/dbraw/zinc/51/44/50/721514450.db2.gz SORNLRDCRBXZTC-RDJZCZTQSA-N 1 1 405.857 3.003 20 0 HGADMO CSc1nc(Cl)cc(N2C[C@H]([N@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@H]32)n1 ZINC001164794428 721526603 /nfs/dbraw/zinc/52/66/03/721526603.db2.gz DBHOMIIKXVIRFJ-RVKKMQEKSA-N 1 1 405.955 3.115 20 0 HGADMO CSc1nc(Cl)cc(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@H]32)n1 ZINC001164794428 721526605 /nfs/dbraw/zinc/52/66/05/721526605.db2.gz DBHOMIIKXVIRFJ-RVKKMQEKSA-N 1 1 405.955 3.115 20 0 HGADMO CCOC(=O)c1nc(N2CC[N@H+]3C[C@H](Oc4cccc(F)c4)C[C@@H]3C2)ccc1Cl ZINC001164902980 721547713 /nfs/dbraw/zinc/54/77/13/721547713.db2.gz BPDYEWRHLJPOAB-NVXWUHKLSA-N 1 1 419.884 3.393 20 0 HGADMO CCOC(=O)c1cnc2cc(N3CC[N@H+]4C[C@@H](Oc5cccc(F)c5)C[C@@H]4C3)[nH]cc1-2 ZINC001164908709 721550892 /nfs/dbraw/zinc/55/08/92/721550892.db2.gz QGZZADVWTBGHRX-AEFFLSMTSA-N 1 1 424.476 3.221 20 0 HGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN([C@H](F)Oc2cccc(Cl)n2)[C@@H]2CCCO[C@@H]12 ZINC001164798541 721553963 /nfs/dbraw/zinc/55/39/63/721553963.db2.gz BGTYMGKSRIAWSM-SMOSDQRPSA-N 1 1 406.889 3.126 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN([C@H](F)Oc2cccc(Cl)n2)[C@@H]2CCCO[C@@H]12 ZINC001164798541 721553965 /nfs/dbraw/zinc/55/39/65/721553965.db2.gz BGTYMGKSRIAWSM-SMOSDQRPSA-N 1 1 406.889 3.126 20 0 HGADMO CCCSc1ncnc(N2CC[N@H+]3C[C@H](Oc4cccc(F)c4)C[C@H]3C2)c1OC ZINC001164904210 721566381 /nfs/dbraw/zinc/56/63/81/721566381.db2.gz DJIZPNFNEZLRPQ-FUHWJXTLSA-N 1 1 418.538 3.468 20 0 HGADMO CSc1cc(N2CC[N@H+]3C[C@@H](Oc4cccc(F)c4)C[C@@H]3C2)nc(SC)n1 ZINC001164907228 721566450 /nfs/dbraw/zinc/56/64/50/721566450.db2.gz MWLAYWIKSNVDQC-ZBFHGGJFSA-N 1 1 406.552 3.401 20 0 HGADMO CSc1cnc(Cl)c(N2C[C@H]([N@H+](C)Cc3cccnc3)[C@H]3OCCC[C@@H]32)n1 ZINC001164806784 721572879 /nfs/dbraw/zinc/57/28/79/721572879.db2.gz RRPLVJBKOKXPNB-ZOBUZTSGSA-N 1 1 405.955 3.115 20 0 HGADMO CSc1cnc(Cl)c(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@H]3OCCC[C@@H]32)n1 ZINC001164806784 721572880 /nfs/dbraw/zinc/57/28/80/721572880.db2.gz RRPLVJBKOKXPNB-ZOBUZTSGSA-N 1 1 405.955 3.115 20 0 HGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(C(F)(F)c2cnc(Cl)c(N)c2)[C@@H]2CCCO[C@H]12 ZINC001164806678 721573687 /nfs/dbraw/zinc/57/36/87/721573687.db2.gz QQUDIXWSOBIKFJ-KURKYZTESA-N 1 1 423.895 3.125 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(C(F)(F)c2cnc(Cl)c(N)c2)[C@@H]2CCCO[C@H]12 ZINC001164806678 721573690 /nfs/dbraw/zinc/57/36/90/721573690.db2.gz QQUDIXWSOBIKFJ-KURKYZTESA-N 1 1 423.895 3.125 20 0 HGADMO Cc1cnc(N2CCC(F)(F)[C@]3(CC[N@@H+](Cc4ccccn4)C3)C2)nc1NC1CC1 ZINC001164906309 721582598 /nfs/dbraw/zinc/58/25/98/721582598.db2.gz ZXDZWESYJZVKLI-NRFANRHFSA-N 1 1 414.504 3.492 20 0 HGADMO CCN(C)c1ccnc(N2CCC(F)(F)[C@@]3(CC[N@@H+](Cc4ccccn4)C3)C2)n1 ZINC001164903020 721582977 /nfs/dbraw/zinc/58/29/77/721582977.db2.gz KCXUCWILZLLYFU-HXUWFJFHSA-N 1 1 402.493 3.065 20 0 HGADMO Cc1nc(-c2ccncc2)cc(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@H]3OCCC[C@@H]32)n1 ZINC001164810211 721583133 /nfs/dbraw/zinc/58/31/33/721583133.db2.gz VDTUXYSMILZREX-FIXSFTCYSA-N 1 1 416.529 3.110 20 0 HGADMO Cc1ccc(-c2ccc(N3C[C@H]([N@H+](C)Cc4cccnc4)[C@H]4OCCC[C@H]43)nn2)o1 ZINC001164810226 721583484 /nfs/dbraw/zinc/58/34/84/721583484.db2.gz VGNJLHUGTJENRA-QTEQDKRBSA-N 1 1 405.502 3.308 20 0 HGADMO Cc1ccc(-c2ccc(N3C[C@H]([N@@H+](C)Cc4cccnc4)[C@H]4OCCC[C@H]43)nn2)o1 ZINC001164810226 721583489 /nfs/dbraw/zinc/58/34/89/721583489.db2.gz VGNJLHUGTJENRA-QTEQDKRBSA-N 1 1 405.502 3.308 20 0 HGADMO COc1cnc(Cl)nc1N1CCC(F)(F)[C@@]2(CC[N@@H+](Cc3ccccn3)C2)C1 ZINC001164906656 721584627 /nfs/dbraw/zinc/58/46/27/721584627.db2.gz OBAKEPBJKOYYJR-GOSISDBHSA-N 1 1 409.868 3.271 20 0 HGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2nc3c(nc2Cl)CCCC3)[C@@H]2CCCO[C@H]21 ZINC001164810191 721590977 /nfs/dbraw/zinc/59/09/77/721590977.db2.gz VCLAPYXEWYLONO-VAMGGRTRSA-N 1 1 413.953 3.272 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2nc3c(nc2Cl)CCCC3)[C@@H]2CCCO[C@H]21 ZINC001164810191 721590979 /nfs/dbraw/zinc/59/09/79/721590979.db2.gz VCLAPYXEWYLONO-VAMGGRTRSA-N 1 1 413.953 3.272 20 0 HGADMO CN(C)c1cc(Cl)nc(N2CCC(F)(F)[C@@]3(CC[N@@H+](Cc4ccccn4)C3)C2)n1 ZINC001164906464 721708812 /nfs/dbraw/zinc/70/88/12/721708812.db2.gz MBWNJLYKOLLOJQ-LJQANCHMSA-N 1 1 422.911 3.329 20 0 HGADMO CC(C)Oc1cncc(N2CCC(F)(F)[C@]3(CC[N@@H+](Cc4ccccn4)C3)C2)n1 ZINC001164912204 721725182 /nfs/dbraw/zinc/72/51/82/721725182.db2.gz MVZPIWOMHZVQFO-FQEVSTJZSA-N 1 1 403.477 3.397 20 0 HGADMO FC1(F)CCN(c2cc(-c3nnco3)ccn2)C[C@@]12CC[N@@H+](Cc1ccccn1)C2 ZINC001164913435 721729087 /nfs/dbraw/zinc/72/90/87/721729087.db2.gz VUFQAXWDDVRTDX-FQEVSTJZSA-N 1 1 412.444 3.264 20 0 HGADMO CN(C)C(=O)C[NH+]1CCC2(CCCN2C(F)(F)c2ccc(Cl)c(Cl)n2)CC1 ZINC001165010680 721737252 /nfs/dbraw/zinc/73/72/52/721737252.db2.gz KHQHZETZFBFTQG-UHFFFAOYSA-N 1 1 421.319 3.456 20 0 HGADMO C[N@H+](Cc1ccco1)Cc1cncc2c1CCN(c1ncnc3cnc(F)cc31)C2 ZINC001164909979 721750270 /nfs/dbraw/zinc/75/02/70/721750270.db2.gz WBHMUBLXFJYOPF-UHFFFAOYSA-N 1 1 404.449 3.347 20 0 HGADMO C[N@@H+](Cc1ccco1)Cc1cncc2c1CCN(c1ncnc3cnc(F)cc31)C2 ZINC001164909979 721750274 /nfs/dbraw/zinc/75/02/74/721750274.db2.gz WBHMUBLXFJYOPF-UHFFFAOYSA-N 1 1 404.449 3.347 20 0 HGADMO CC(C)OC(=O)c1ccc(N2C[C@@H]3CCC[C@H]([N@@H+](C)Cc4ccccn4)[C@@H]3C2)nn1 ZINC001165027339 721805439 /nfs/dbraw/zinc/80/54/39/721805439.db2.gz VNRKOXDODYOKJX-DSKINZAPSA-N 1 1 409.534 3.174 20 0 HGADMO Cc1nc2nc(Cl)nc(N3C[C@@H]4CCC[C@@H]([N@@H+](C)Cc5ccccn5)[C@@H]4C3)c2[nH]1 ZINC001165021342 721807617 /nfs/dbraw/zinc/80/76/17/721807617.db2.gz GKOVXZRBGDLQJO-USXIJHARSA-N 1 1 411.941 3.447 20 0 HGADMO Cc1nc2c(nc(Cl)nc2N2C[C@@H]3CCC[C@@H]([N@H+](C)Cc4ccccn4)[C@@H]3C2)[nH]1 ZINC001165021342 721807618 /nfs/dbraw/zinc/80/76/18/721807618.db2.gz GKOVXZRBGDLQJO-USXIJHARSA-N 1 1 411.941 3.447 20 0 HGADMO Cc1nc2c(nc(Cl)nc2N2C[C@@H]3CCC[C@@H]([N@@H+](C)Cc4ccccn4)[C@@H]3C2)[nH]1 ZINC001165021342 721807619 /nfs/dbraw/zinc/80/76/19/721807619.db2.gz GKOVXZRBGDLQJO-USXIJHARSA-N 1 1 411.941 3.447 20 0 HGADMO Cc1nc2nc(Cl)nc(N3C[C@@H]4CCC[C@H]([N@@H+](C)Cc5ccccn5)[C@H]4C3)c2[nH]1 ZINC001165021345 721807672 /nfs/dbraw/zinc/80/76/72/721807672.db2.gz GKOVXZRBGDLQJO-XIRDDKMYSA-N 1 1 411.941 3.447 20 0 HGADMO Cc1nc2c(nc(Cl)nc2N2C[C@@H]3CCC[C@H]([N@H+](C)Cc4ccccn4)[C@H]3C2)[nH]1 ZINC001165021345 721807673 /nfs/dbraw/zinc/80/76/73/721807673.db2.gz GKOVXZRBGDLQJO-XIRDDKMYSA-N 1 1 411.941 3.447 20 0 HGADMO Cc1nc2c(nc(Cl)nc2N2C[C@@H]3CCC[C@H]([N@@H+](C)Cc4ccccn4)[C@H]3C2)[nH]1 ZINC001165021345 721807676 /nfs/dbraw/zinc/80/76/76/721807676.db2.gz GKOVXZRBGDLQJO-XIRDDKMYSA-N 1 1 411.941 3.447 20 0 HGADMO COC(=O)c1cc(F)c(C)nc1N1C[C@@H]2CCC[C@H]([N@@H+](C)Cc3ccccn3)[C@@H]2C1 ZINC001165023586 721812327 /nfs/dbraw/zinc/81/23/27/721812327.db2.gz HYLJCIMQTFGXQR-SCWSEQNSSA-N 1 1 412.509 3.448 20 0 HGADMO CCOC(=O)Cc1ccc(N2C[C@@H]3CCC[C@H]([N@@H+](C)Cc4ccccn4)[C@@H]3C2)nc1 ZINC001165026242 721812892 /nfs/dbraw/zinc/81/28/92/721812892.db2.gz POVUMDWPJYGLKG-NNWRFLSQSA-N 1 1 408.546 3.319 20 0 HGADMO COC(=O)c1nc(Cl)cnc1N1C[C@@H]2CCC[C@H]([N@@H+](C)Cc3ccccn3)[C@@H]2C1 ZINC001165028983 721813516 /nfs/dbraw/zinc/81/35/16/721813516.db2.gz YJSXHGHXPIKXRN-UAGQMJEPSA-N 1 1 415.925 3.049 20 0 HGADMO COC(=O)c1nc(Cl)cnc1N1C[C@@H]2CCC[C@H]([N@@H+](C)Cc3ccccn3)[C@H]2C1 ZINC001165028986 721813755 /nfs/dbraw/zinc/81/37/55/721813755.db2.gz YJSXHGHXPIKXRN-XIRDDKMYSA-N 1 1 415.925 3.049 20 0 HGADMO CN(C)c1cc(Cl)nc(N2C[C@@H]3CCC[C@H]([N@@H+](C)Cc4ccccn4)[C@@H]3C2)n1 ZINC001165026861 721814556 /nfs/dbraw/zinc/81/45/56/721814556.db2.gz RUMHQRYCZMWCHB-JQHSSLGASA-N 1 1 400.958 3.328 20 0 HGADMO C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@H]2CN(c3nc(C(N)=O)cc4ccccc43)C[C@@H]21 ZINC001165030544 721825938 /nfs/dbraw/zinc/82/59/38/721825938.db2.gz ZSKMLURMGQOBJV-AVCGJXAMSA-N 1 1 415.541 3.466 20 0 HGADMO C[NH+]1CCC(Oc2ccnc(N3CCC4(CC3)C(=O)Nc3c4cccc3F)c2)CC1 ZINC001165020081 721833326 /nfs/dbraw/zinc/83/33/26/721833326.db2.gz CGHAZCPLCBLNBW-UHFFFAOYSA-N 1 1 410.493 3.184 20 0 HGADMO C[C@@H]1CCCCN1c1nc2ccccc2nc1N1CC[C@H]2[C@H]1CC[N@@H+]2CCN(C)C ZINC001164936281 721878456 /nfs/dbraw/zinc/87/84/56/721878456.db2.gz ZDPGHOKKDAQHLU-BVYCBKJFSA-N 1 1 408.594 3.223 20 0 HGADMO C[C@@H]1CCCCN1c1nc2ccccc2nc1N1CC[C@H]2[C@H]1CC[N@H+]2CCN(C)C ZINC001164936281 721878459 /nfs/dbraw/zinc/87/84/59/721878459.db2.gz ZDPGHOKKDAQHLU-BVYCBKJFSA-N 1 1 408.594 3.223 20 0 HGADMO CN(C)CC[N@@H+]1CC[C@H]2[C@H]1CCN2c1ccc(-c2ccc(N3CCCCC3)cc2)nn1 ZINC001164935139 721885871 /nfs/dbraw/zinc/88/58/71/721885871.db2.gz WNCABUMVKLEYPC-RPWUZVMVSA-N 1 1 420.605 3.349 20 0 HGADMO CN(C)CC[N@H+]1CC[C@H]2[C@H]1CCN2c1ccc(-c2ccc(N3CCCCC3)cc2)nn1 ZINC001164935139 721885872 /nfs/dbraw/zinc/88/58/72/721885872.db2.gz WNCABUMVKLEYPC-RPWUZVMVSA-N 1 1 420.605 3.349 20 0 HGADMO CN(C)CC[N@H+]1CC[C@@H]2[C@H]1CCN2c1ncnc2cc(OCc3ccccc3)ccc21 ZINC001164934398 721887976 /nfs/dbraw/zinc/88/79/76/721887976.db2.gz RILKHGWLICZWEB-DNQXCXABSA-N 1 1 417.557 3.423 20 0 HGADMO C[NH+](C)CCN1CC[C@@H]2[C@H]1CCN2c1ncnc2cc(OCc3ccccc3)ccc21 ZINC001164934398 721887977 /nfs/dbraw/zinc/88/79/77/721887977.db2.gz RILKHGWLICZWEB-DNQXCXABSA-N 1 1 417.557 3.423 20 0 HGADMO c1cc(C[N@H+]2C[C@H]3C[C@@H](C2)N(c2ccc(-c4ccc5c(c4)OCCO5)nn2)C3)co1 ZINC001164931965 721901386 /nfs/dbraw/zinc/90/13/86/721901386.db2.gz YGKZJEYOAWJHGP-MJGOQNOKSA-N 1 1 404.470 3.219 20 0 HGADMO COC(=O)c1ccc(N2CCC3(CC2)C[N@@H+](Cc2ccc(C)cc2)CCO3)nc1C ZINC001164939000 721925418 /nfs/dbraw/zinc/92/54/18/721925418.db2.gz GLRYJGCPGBRAAN-UHFFFAOYSA-N 1 1 409.530 3.356 20 0 HGADMO COc1cc(N2CCC3(CC2)C[N@@H+](Cc2ccc(C)cc2)CCO3)nc(SC)n1 ZINC001164939379 721925972 /nfs/dbraw/zinc/92/59/72/721925972.db2.gz KUEGOADKXNGBBI-UHFFFAOYSA-N 1 1 414.575 3.387 20 0 HGADMO CCOC(=O)c1c(C)ncnc1N1CCC2(CC1)C[N@@H+](Cc1ccc(C)cc1)CCO2 ZINC001164939338 721926837 /nfs/dbraw/zinc/92/68/37/721926837.db2.gz JDZLDIKYCYQPSH-UHFFFAOYSA-N 1 1 424.545 3.142 20 0 HGADMO Cc1ccc(CN2CCOC3(CCN(c4cccc(N5CCOCC5)[nH+]4)CC3)C2)cc1 ZINC001164938724 721929272 /nfs/dbraw/zinc/92/92/72/721929272.db2.gz FQAGDQJSGOFCNF-UHFFFAOYSA-N 1 1 422.573 3.098 20 0 HGADMO CC(C)(C)NC(=O)c1cc(Cl)nc(N2CC[NH+](CCOc3ccccc3)CC2)c1 ZINC001165043810 721957255 /nfs/dbraw/zinc/95/72/55/721957255.db2.gz CTPZHMPPQXALJR-UHFFFAOYSA-N 1 1 416.953 3.464 20 0 HGADMO Clc1nc2ccoc2c(N2CCC3(CC2)COCC[N@@H+](Cc2ccncc2)C3)n1 ZINC001164958808 722053742 /nfs/dbraw/zinc/05/37/42/722053742.db2.gz GQIVJRUVHKNHKZ-UHFFFAOYSA-N 1 1 413.909 3.390 20 0 HGADMO COc1nc2ccccc2nc1N1CCC2(CC1)COCC[N@@H+](Cc1ccncc1)C2 ZINC001164958066 722054013 /nfs/dbraw/zinc/05/40/13/722054013.db2.gz BITJPDCBBUZQLU-UHFFFAOYSA-N 1 1 419.529 3.152 20 0 HGADMO CC(C)Sc1ccc(N2CCC3(CC2)COCC[N@@H+](Cc2ccncc2)C3)nn1 ZINC001164962208 722060955 /nfs/dbraw/zinc/06/09/55/722060955.db2.gz PYMYCNMBANGHEL-UHFFFAOYSA-N 1 1 413.591 3.491 20 0 HGADMO Fc1cccc(Oc2nc(Cl)ncc2N2C[C@@H]3C[N@H+](CC4CC4)C[C@H](C2)O3)c1 ZINC001164967921 722077546 /nfs/dbraw/zinc/07/75/46/722077546.db2.gz MUPPSMLJOOIRQM-CALCHBBNSA-N 1 1 404.873 3.361 20 0 HGADMO O=C(NC1CCC1)[C@@H]1C[C@H]2CN(c3nc(Cl)ccc3C[NH+]3CCCC3)C[C@H]2C1 ZINC001164976512 722085140 /nfs/dbraw/zinc/08/51/40/722085140.db2.gz VMKPXXLQIKBMRN-BCDXTJNWSA-N 1 1 402.970 3.462 20 0 HGADMO CN(C)C(=O)N[C@@H]1c2ccccc2[C@@H]2CN(c3ccc(C[N@@H+](C)C4CC4)cn3)C[C@H]21 ZINC001164985858 722098190 /nfs/dbraw/zinc/09/81/90/722098190.db2.gz XFFVRTQIIRDTCB-QZNHQXDQSA-N 1 1 405.546 3.222 20 0 HGADMO COc1ccc2c(ccnc2N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)c1 ZINC001164979917 722107112 /nfs/dbraw/zinc/10/71/12/722107112.db2.gz IIQFCPSQKZJBAM-REWPJTCUSA-N 1 1 404.514 3.366 20 0 HGADMO Clc1ccc2ncc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)nc2c1 ZINC001164981085 722113108 /nfs/dbraw/zinc/11/31/08/722113108.db2.gz SKLVFPHLHRQPSB-UWJYYQICSA-N 1 1 409.921 3.406 20 0 HGADMO Fc1ccc(-c2ccnc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)n2)cc1 ZINC001164971889 722113632 /nfs/dbraw/zinc/11/36/32/722113632.db2.gz DAWSLIUCNQDMNH-REWPJTCUSA-N 1 1 419.504 3.405 20 0 HGADMO c1ccc2c(c1)[nH]c1ncnc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)c21 ZINC001164976415 722123363 /nfs/dbraw/zinc/12/33/63/722123363.db2.gz LNTWVRFKXNLGLE-WIYYLYMNSA-N 1 1 414.513 3.233 20 0 HGADMO CCOc1ccc(Cl)nc1N1CC[C@@H]2C[N@@H+](Cc3cccnc3)CCO[C@@H]2C1 ZINC001164981169 722125157 /nfs/dbraw/zinc/12/51/57/722125157.db2.gz UADDAZHNWPJOSI-IEBWSBKVSA-N 1 1 402.926 3.256 20 0 HGADMO c1cncc(C[N@H+]2CCO[C@@H]3CN(c4ccc(-c5ccncc5)cn4)CC[C@H]3C2)c1 ZINC001164985476 722138365 /nfs/dbraw/zinc/13/83/65/722138365.db2.gz ZPGZUAMJQJUGRO-XZOQPEGZSA-N 1 1 401.514 3.266 20 0 HGADMO Cc1cc(C(F)(F)N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)c(Cl)nn1 ZINC001164979697 722143269 /nfs/dbraw/zinc/14/32/69/722143269.db2.gz LTJUJBGYAWGQLX-FUHWJXTLSA-N 1 1 423.895 3.106 20 0 HGADMO CC(C)c1c(Cl)ncnc1N1CC[C@H]2C[N@@H+](Cc3cccnc3)CCO[C@@H]2C1 ZINC001164973803 722153536 /nfs/dbraw/zinc/15/35/36/722153536.db2.gz LXYYDISJJXIYRI-ZWKOTPCHSA-N 1 1 401.942 3.376 20 0 HGADMO CC(C)c1c(Cl)ncnc1N1CC[C@@H]2C[N@@H+](Cc3cccnc3)CCO[C@@H]2C1 ZINC001164973355 722153659 /nfs/dbraw/zinc/15/36/59/722153659.db2.gz LXYYDISJJXIYRI-QZTJIDSGSA-N 1 1 401.942 3.376 20 0 HGADMO c1cncc(C[N@H+]2CCO[C@@H]3CN(c4nccc5c6c([nH]c54)CCC6)CC[C@H]3C2)c1 ZINC001164971200 722154000 /nfs/dbraw/zinc/15/40/00/722154000.db2.gz BCMJXPGGJVTUHP-PGRDOPGGSA-N 1 1 403.530 3.174 20 0 HGADMO C[NH+]1CCN(c2ncnc3c2CCN(c2ccc4cccc(Cl)c4n2)CC3)CC1 ZINC001164996432 722232216 /nfs/dbraw/zinc/23/22/16/722232216.db2.gz HDUQYRHIVTWHLV-UHFFFAOYSA-N 1 1 408.937 3.035 20 0 HGADMO C[NH+]1CCN(c2ncnc3c2CCN(c2cc(Cl)nc4sccc42)CC3)CC1 ZINC001164996012 722232322 /nfs/dbraw/zinc/23/23/22/722232322.db2.gz AAQYXJNLKBBZNP-UHFFFAOYSA-N 1 1 414.966 3.097 20 0 HGADMO OCC1([NH2+]Cc2nc(-c3cc(Br)cs3)no2)Cc2ccccc2C1 ZINC000510248350 1126095456 /nfs/dbraw/zinc/09/54/56/1126095456.db2.gz HTAWYQMWVFDOLI-UHFFFAOYSA-N 1 1 406.305 3.180 20 0 HGADMO OCC1([NH2+]Cc2nnc(-c3ccc(Br)s3)o2)Cc2ccccc2C1 ZINC000735493003 1126106803 /nfs/dbraw/zinc/10/68/03/1126106803.db2.gz NFOQXSLGDWCYDF-UHFFFAOYSA-N 1 1 406.305 3.180 20 0 HGADMO COc1cccc2c1CC[C@]2(CO)[NH2+]Cc1c[nH]c(=NC(=O)OC(C)(C)C)s1 ZINC001179447673 1126152227 /nfs/dbraw/zinc/15/22/27/1126152227.db2.gz NYOLOMIGVYYVCK-HXUWFJFHSA-N 1 1 405.520 3.422 20 0 HGADMO COc1ccc(C[C@@](C)(CO)[NH2+]Cc2noc(-c3ccc(F)cc3F)n2)cc1OC ZINC001198229810 1126155541 /nfs/dbraw/zinc/15/55/41/1126155541.db2.gz MQGNMFPWLNMMNE-NRFANRHFSA-N 1 1 419.428 3.115 20 0 HGADMO C[C@](CO)(Cc1ccc(Br)cc1)[NH2+]Cc1n[nH]cc1Br ZINC001206855622 1126159621 /nfs/dbraw/zinc/15/96/21/1126159621.db2.gz IGXIZJTYHYGLOA-CQSZACIVSA-N 1 1 403.118 3.018 20 0 HGADMO COc1ccc(C[C@](C)(CO)[NH2+]Cc2nc3ccccn3c2Br)cc1 ZINC001474697696 1126204968 /nfs/dbraw/zinc/20/49/68/1126204968.db2.gz CDEQBNOGYUTYRH-LJQANCHMSA-N 1 1 404.308 3.189 20 0 HGADMO CN(C)Cc1ccc(C[NH2+][C@@](C)(CO)Cc2ccccc2F)c2c1OC(F)(F)O2 ZINC001560548144 1126211984 /nfs/dbraw/zinc/21/19/84/1126211984.db2.gz CNNCSSIFORCVAG-HXUWFJFHSA-N 1 1 410.436 3.292 20 0 HGADMO CCOC(=O)c1c[nH]c2ncnc(N3CCC[C@@H]4C[N@@H+](Cc5ccccc5)C[C@@H]43)c12 ZINC001164624928 719066002 /nfs/dbraw/zinc/06/60/02/719066002.db2.gz MACWEWALEXCXHD-MJGOQNOKSA-N 1 1 405.502 3.235 20 0 HGADMO CCOC(=O)c1c[nH]c2ncnc(N3CCC[C@@H]4C[N@@H+](Cc5ccccc5)C[C@H]43)c12 ZINC001164624927 719066188 /nfs/dbraw/zinc/06/61/88/719066188.db2.gz MACWEWALEXCXHD-IEBWSBKVSA-N 1 1 405.502 3.235 20 0 HGADMO NC(=O)c1cc(Cl)ncc1C(F)(F)N1CCC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]21 ZINC001164631684 719094179 /nfs/dbraw/zinc/09/41/79/719094179.db2.gz ZCRFENRSUBQYKN-CRAIPNDOSA-N 1 1 420.891 3.480 20 0 HGADMO Cc1noc([C@@H]2C[C@H]3CCN(c4nc(Cl)ccc4C[NH+]4CCCC4)C[C@@H]3O2)n1 ZINC001164648046 719299616 /nfs/dbraw/zinc/29/96/16/719299616.db2.gz FQIOFNKJKNQWOY-PVAVHDDUSA-N 1 1 403.914 3.379 20 0 HGADMO CCOC(=O)c1cc(N2CCc3c(C[NH+](C)C)nn(C(C)C)c3C2)ncc1Cl ZINC001164649017 719307366 /nfs/dbraw/zinc/30/73/66/719307366.db2.gz SWRXIRZLNIOHAA-UHFFFAOYSA-N 1 1 405.930 3.313 20 0 HGADMO CC(C)n1nc(C[NH+](C)C)c2c1CN(c1ncc(C(N)=S)c3ccsc31)CC2 ZINC001164650152 719317779 /nfs/dbraw/zinc/31/77/79/719317779.db2.gz COMLZBHLYVLXFY-UHFFFAOYSA-N 1 1 414.604 3.332 20 0 HGADMO C[N@H+]1CCO[C@@H]2CN(c3nc(Cl)nc(-c4ccc(-c5ccccc5)cc4)n3)C[C@@H]21 ZINC001164669313 719394555 /nfs/dbraw/zinc/39/45/55/719394555.db2.gz URFGRJWHWVRFHQ-RBUKOAKNSA-N 1 1 407.905 3.378 20 0 HGADMO C[N@H+]1CCO[C@H]2CN(c3nc(Cl)nc(-c4ccc(-c5ccccc5)cc4)n3)C[C@@H]21 ZINC001164669311 719395103 /nfs/dbraw/zinc/39/51/03/719395103.db2.gz URFGRJWHWVRFHQ-OALUTQOASA-N 1 1 407.905 3.378 20 0 HGADMO C[N@H+]1CCO[C@@H]2CN(c3nc(-c4cccnc4)nc4sc5c(c43)CCCC5)C[C@@H]21 ZINC000301684045 719433644 /nfs/dbraw/zinc/43/36/44/719433644.db2.gz WIDIEGFCNZTWRM-DLBZAZTESA-N 1 1 407.543 3.151 20 0 HGADMO CNC(=O)C[N@H+]1CCCC12CCN(c1nc3cc(C)c(C)cc3nc1Cl)CC2 ZINC001164683735 719730221 /nfs/dbraw/zinc/73/02/21/719730221.db2.gz FAZRREMGUATLDU-UHFFFAOYSA-N 1 1 401.942 3.081 20 0 HGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2CC[C@H]3[C@@H]2CC(=O)N3Cc2cccnc2)nc1 ZINC001164690671 719775433 /nfs/dbraw/zinc/77/54/33/719775433.db2.gz GVYHETYTSDFZSO-FSSWDIPSSA-N 1 1 405.546 3.403 20 0 HGADMO Cc1nc(C[N@H+]2CCCC23CCN(c2ccc(Cl)c(C(N)=O)n2)CC3)cs1 ZINC001164690890 719804779 /nfs/dbraw/zinc/80/47/79/719804779.db2.gz BWPRGSMLHFPKQI-UHFFFAOYSA-N 1 1 405.955 3.234 20 0 HGADMO Cc1nc(C[N@H+]2CCCC23CCN(c2ncc4ncnc(Cl)c4n2)CC3)cs1 ZINC001164691526 719811366 /nfs/dbraw/zinc/81/13/66/719811366.db2.gz GCEWLCLXZDIXJE-UHFFFAOYSA-N 1 1 415.954 3.473 20 0 HGADMO COC(=O)[C@]1(C)C[C@@H]([NH+]2CCOCC2)CCN1c1nc(Cl)cc2cc(F)ccc21 ZINC001164705779 719837807 /nfs/dbraw/zinc/83/78/07/719837807.db2.gz VOKYWGZPQHIUHD-KKSFZXQISA-N 1 1 421.900 3.260 20 0 HGADMO COC(=O)[C@@]1(C)C[C@@H]([NH+]2CCOCC2)CCN1c1ncnc2sc(C(C)C)cc21 ZINC001164707036 719838331 /nfs/dbraw/zinc/83/83/31/719838331.db2.gz YXCYYGQGOVUGOL-YCRPNKLZSA-N 1 1 418.563 3.047 20 0 HGADMO CCOC(=O)c1cc(Cl)nc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COC)c1 ZINC001164815743 720067579 /nfs/dbraw/zinc/06/75/79/720067579.db2.gz ZJNIZJNLZDQCRP-DYESRHJHSA-N 1 1 407.942 3.096 20 0 HGADMO CCC[N@H+]1CCCC[C@@H]1c1ccc(N2CC[C@@H]3[C@@H]2CC(=O)N3c2cnn(C)c2)nc1 ZINC001164711314 720076440 /nfs/dbraw/zinc/07/64/40/720076440.db2.gz LJWZBAURNXBAQN-NJYVYQBISA-N 1 1 408.550 3.136 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1nc(Cl)nc3c1CSCC3)C2 ZINC001164811658 720081929 /nfs/dbraw/zinc/08/19/29/720081929.db2.gz OTHCTKPLMUWYMJ-MGPUTAFESA-N 1 1 408.999 3.104 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1cc(C(=O)OC(C)(C)C)ccn1)C2 ZINC001164811287 720082752 /nfs/dbraw/zinc/08/27/52/720082752.db2.gz NSLSEFQSRJTTHA-AUSIDOKSSA-N 1 1 401.551 3.222 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1cncc(OCc3ccccc3)n1)C2 ZINC001164809292 720087174 /nfs/dbraw/zinc/08/71/74/720087174.db2.gz JFSXOPCWBFHBGX-URXFXBBRSA-N 1 1 408.546 3.240 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(C(F)(F)c1cc(C)nc(Cl)n1)C2 ZINC001164812352 720098058 /nfs/dbraw/zinc/09/80/58/720098058.db2.gz QTKNGDNURCGOKO-MAUKXSAKSA-N 1 1 400.901 3.168 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1ccnc(NC(=O)OC(C)(C)C)n1)C2 ZINC001164814801 720098676 /nfs/dbraw/zinc/09/86/76/720098676.db2.gz WVKFZKAVOWVRGL-JTSKRJEESA-N 1 1 417.554 3.008 20 0 HGADMO COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1cc(N)cc(Cl)n1)CC2 ZINC001164714898 720110579 /nfs/dbraw/zinc/11/05/79/720110579.db2.gz DQEBNSFCCACFNN-SFHVURJKSA-N 1 1 401.942 3.220 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(C(F)(F)COc1ccnc(Cl)c1)C2 ZINC001164812031 720111340 /nfs/dbraw/zinc/11/13/40/720111340.db2.gz OBLBPSQNMKJCCW-LPHOPBHVSA-N 1 1 415.912 3.387 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(C(F)(F)c1ccc(OC)nc1Cl)C2 ZINC001164811731 720112782 /nfs/dbraw/zinc/11/27/82/720112782.db2.gz NBJURTGXLJSHMH-BEFAXECRSA-N 1 1 415.912 3.473 20 0 HGADMO COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1ncc(N)cc1Cl)CC2 ZINC001164715581 720119539 /nfs/dbraw/zinc/11/95/39/720119539.db2.gz IDQSFKQHRXMUSG-GOSISDBHSA-N 1 1 401.942 3.220 20 0 HGADMO COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1nccc(C(F)F)n1)CC2 ZINC001164712174 720134546 /nfs/dbraw/zinc/13/45/46/720134546.db2.gz KQQULTYRGQFVTE-QGZVFWFLSA-N 1 1 403.477 3.317 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1cnc(OCc3ccccc3)cn1)C2 ZINC001164816716 720148891 /nfs/dbraw/zinc/14/88/91/720148891.db2.gz MGJIFPAVCBPGHB-QPPBQGQZSA-N 1 1 408.546 3.240 20 0 HGADMO CCc1cc2c(nc(Cl)nc2N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COC)[nH]1 ZINC001164814240 720155570 /nfs/dbraw/zinc/15/55/70/720155570.db2.gz FDPTUTOJPRGERR-BTYIYWSLSA-N 1 1 403.958 3.358 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1cc(-c3ccc(OC)cc3)ncn1)C2 ZINC001164817855 720175088 /nfs/dbraw/zinc/17/50/88/720175088.db2.gz QNHPFGMKNFGVBP-GBXCKJPGSA-N 1 1 408.546 3.337 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1nc(-c3cccnc3)nc3c1CCC3)C2 ZINC001164816576 720184763 /nfs/dbraw/zinc/18/47/63/720184763.db2.gz LOGUCLZTIJRCFX-CJFMBICVSA-N 1 1 419.573 3.212 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1ccc3c(cccc3C(=O)OC)n1)C2 ZINC001164812435 720186822 /nfs/dbraw/zinc/18/68/22/720186822.db2.gz AQKGTLXCATVIJE-MHECFPHRSA-N 1 1 409.530 3.206 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1ncnc3c1ncn3-c1ccccc1)C2 ZINC001164819733 720190758 /nfs/dbraw/zinc/19/07/58/720190758.db2.gz XYIWFTNVHZWBST-CYFREDJKSA-N 1 1 418.545 3.000 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1cc(-c3nc(C4CC4)no3)ccn1)C2 ZINC001164817546 720190945 /nfs/dbraw/zinc/19/09/45/720190945.db2.gz PUXZSBWBHZITLM-CVDCTZTESA-N 1 1 409.534 3.194 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1nc(Cl)cc(-c3ccncc3)n1)C2 ZINC001164812691 720197089 /nfs/dbraw/zinc/19/70/89/720197089.db2.gz LXEFSTKLUWXGKG-PGRDOPGGSA-N 1 1 413.953 3.377 20 0 HGADMO CCOC(=O)c1c(C)cc(Cl)nc1N1CC[C@@H]2[C@@H]1CC[N@H+]2Cc1cccnc1 ZINC001164725927 720364709 /nfs/dbraw/zinc/36/47/09/720364709.db2.gz OEPBAFHQYGLFHE-SJORKVTESA-N 1 1 400.910 3.468 20 0 HGADMO CCOC(=O)c1cc(Cl)nc(N2CC[C@H]3[C@H]2CC[N@H+]3Cc2cccnc2)c1C ZINC001164724329 720380134 /nfs/dbraw/zinc/38/01/34/720380134.db2.gz JQVYYQVBSPPGHD-ZWKOTPCHSA-N 1 1 400.910 3.468 20 0 HGADMO COC(=O)c1cc(Cl)nc(C(F)(F)N2CC[C@H]3[C@H]2CC[N@@H+]3Cc2cccnc2)c1 ZINC001164730401 720398594 /nfs/dbraw/zinc/39/85/94/720398594.db2.gz XHODZFVMTASPMG-JKSUJKDBSA-N 1 1 422.863 3.315 20 0 HGADMO COC(=O)c1cc(Cl)nc(C(F)(F)N2CC[C@H]3[C@H]2CC[N@H+]3Cc2cccnc2)c1 ZINC001164730401 720398599 /nfs/dbraw/zinc/39/85/99/720398599.db2.gz XHODZFVMTASPMG-JKSUJKDBSA-N 1 1 422.863 3.315 20 0 HGADMO FC(F)(c1ccc2ncnc(Cl)c2n1)N1CC[C@H]2[C@H]1CC[N@@H+]2Cc1cccnc1 ZINC001164723953 720403430 /nfs/dbraw/zinc/40/34/30/720403430.db2.gz IGZOUXIWRODKIA-JKSUJKDBSA-N 1 1 416.863 3.471 20 0 HGADMO FC(F)(c1ccc2ncnc(Cl)c2n1)N1CC[C@H]2[C@H]1CC[N@H+]2Cc1cccnc1 ZINC001164723953 720403435 /nfs/dbraw/zinc/40/34/35/720403435.db2.gz IGZOUXIWRODKIA-JKSUJKDBSA-N 1 1 416.863 3.471 20 0 HGADMO FC(F)(c1ccc2ncnc(Cl)c2n1)N1CC[C@@H]2[C@H]1CC[N@@H+]2Cc1cccnc1 ZINC001164723951 720403855 /nfs/dbraw/zinc/40/38/55/720403855.db2.gz IGZOUXIWRODKIA-HZPDHXFCSA-N 1 1 416.863 3.471 20 0 HGADMO FC(F)(c1ccc2ncnc(Cl)c2n1)N1CC[C@@H]2[C@H]1CC[N@H+]2Cc1cccnc1 ZINC001164723951 720403867 /nfs/dbraw/zinc/40/38/67/720403867.db2.gz IGZOUXIWRODKIA-HZPDHXFCSA-N 1 1 416.863 3.471 20 0 HGADMO COC(=O)c1cc2c(N3CC[C@@H]4[C@@H]3CC[N@H+]4Cc3cccnc3)[nH]c(Cl)cc-2n1 ZINC001164731715 720412954 /nfs/dbraw/zinc/41/29/54/720412954.db2.gz MDLFKLCVALUDAD-MSOLQXFVSA-N 1 1 411.893 3.251 20 0 HGADMO CC1CCN(C(=O)c2ccc(N3CC[C@@H]4[C@@H]3CC[N@H+]4Cc3cccnc3)nc2)CC1 ZINC001164734524 720436583 /nfs/dbraw/zinc/43/65/83/720436583.db2.gz SYKTXNDIVCFIFE-YADHBBJMSA-N 1 1 405.546 3.202 20 0 HGADMO FC(F)(c1c2c(nnc1Cl)CCC2)N1CC[C@@H]2[C@H]1CC[N@@H+]2Cc1cccnc1 ZINC001164732031 720444659 /nfs/dbraw/zinc/44/46/59/720444659.db2.gz MVNWVROQKWLVLH-IAGOWNOFSA-N 1 1 405.880 3.412 20 0 HGADMO FC(F)(c1c2c(nnc1Cl)CCC2)N1CC[C@@H]2[C@H]1CC[N@H+]2Cc1cccnc1 ZINC001164732031 720444665 /nfs/dbraw/zinc/44/46/65/720444665.db2.gz MVNWVROQKWLVLH-IAGOWNOFSA-N 1 1 405.880 3.412 20 0 HGADMO COC(=O)c1nc(N2CC[C@@H]3[C@H]2CC[N@H+]3Cc2cccnc2)c2ccccc2c1OC ZINC001164735072 720459336 /nfs/dbraw/zinc/45/93/36/720459336.db2.gz VMWBOBHGKAUJSN-WOJBJXKFSA-N 1 1 418.497 3.278 20 0 HGADMO CC(C)[N@@H+]1[C@@H]2CCN(c3nc(Cl)nc4c3ccn4C)C[C@H]2C[C@H]1Cn1cccn1 ZINC001164841136 720527255 /nfs/dbraw/zinc/52/72/55/720527255.db2.gz XORXQDDDOSMBTE-SOLBZPMBSA-N 1 1 413.957 3.196 20 0 HGADMO CSc1nc(Cl)ncc1N1CC[C@@H]2[C@H](C[C@@H](Cn3cccn3)[N@H+]2C(C)C)C1 ZINC001164842021 720543410 /nfs/dbraw/zinc/54/34/10/720543410.db2.gz WDBXCOFZXJEDLS-OWCLPIDISA-N 1 1 406.987 3.426 20 0 HGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@@H]2CN([C@H](F)Oc3cccc(Cl)n3)CC[C@@H]21 ZINC001164836385 720544808 /nfs/dbraw/zinc/54/48/08/720544808.db2.gz JTEQUSWTQGTXOQ-YLAKUSLOSA-N 1 1 407.921 3.437 20 0 HGADMO CC(C)[N@@H+]1[C@@H]2CCN(c3nnc(Cl)c4cccnc43)C[C@H]2C[C@H]1Cn1cccn1 ZINC001164841448 720546351 /nfs/dbraw/zinc/54/63/51/720546351.db2.gz VXRKUHMPJAEGQP-SOLBZPMBSA-N 1 1 411.941 3.253 20 0 HGADMO COc1ccc2ncc(N3CC[C@@H]4[C@H](C[C@@H](Cn5cccn5)[N@H+]4C(C)C)C3)nc2c1 ZINC001164838085 720546815 /nfs/dbraw/zinc/54/68/15/720546815.db2.gz NUULEVMRVRDWOT-KGVIQGDOSA-N 1 1 406.534 3.213 20 0 HGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@@H]2CN(c3nc(Cl)nc4ncsc43)CC[C@@H]21 ZINC001164838500 720548161 /nfs/dbraw/zinc/54/81/61/720548161.db2.gz ODFPUEYPFPJFCE-ILXRZTDVSA-N 1 1 417.970 3.314 20 0 HGADMO COc1ccc2nc(N3CC[C@@H]4[C@H](C[C@H](Cn5cccn5)[N@H+]4C(C)C)C3)ncc2c1 ZINC001164836405 720551130 /nfs/dbraw/zinc/55/11/30/720551130.db2.gz JYYXVOAQRPWTIF-WOIUINJBSA-N 1 1 406.534 3.213 20 0 HGADMO CCOc1c(Cl)ncnc1N1CC[C@@H]2[C@@H](C[C@H](Cn3cccn3)[N@H+]2C(C)C)C1 ZINC001164840188 720553789 /nfs/dbraw/zinc/55/37/89/720553789.db2.gz SBQKXMAREOWGRX-GVDBMIGSSA-N 1 1 404.946 3.103 20 0 HGADMO COc1nc(N2CC[C@@H]3[C@@H](C[C@H](Cn4cccn4)[N@H+]3C(C)C)C2)nc2ccccc21 ZINC001164833630 720557090 /nfs/dbraw/zinc/55/70/90/720557090.db2.gz AYPQMDKMTCWTHR-WAOWUJCRSA-N 1 1 406.534 3.213 20 0 HGADMO CC(C)[N@@H+]1[C@@H]2CCN(C(F)(F)c3cc(N)cc(Cl)n3)C[C@@H]2C[C@H]1Cn1cccn1 ZINC001164840180 720560060 /nfs/dbraw/zinc/56/00/60/720560060.db2.gz SBOQOKWMTHRRDP-BHYGNILZSA-N 1 1 424.927 3.436 20 0 HGADMO CCOC(=O)/C=C\c1ccc(N2CC[C@@H]3[C@H](C[C@H](Cn4cccn4)[N@H+]3C(C)C)C2)nc1 ZINC001164838552 720569448 /nfs/dbraw/zinc/56/94/48/720569448.db2.gz OLFNMUDEAJOVRW-KFUJGGTHSA-N 1 1 423.561 3.232 20 0 HGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@@H]2CN(c3cc(N4CCCCC4)ncn3)CC[C@@H]21 ZINC001164842808 720600746 /nfs/dbraw/zinc/60/07/46/720600746.db2.gz VQIQWWVXDKKQRN-HKBOAZHASA-N 1 1 409.582 3.041 20 0 HGADMO COc1cccc2c(N3CC[N@H+]4C[C@@H](Oc5cncnc5)C[C@@H]4C3)cc(Cl)nc12 ZINC001164743738 720607277 /nfs/dbraw/zinc/60/72/77/720607277.db2.gz QKMRAPJLWLSNOI-CABCVRRESA-N 1 1 411.893 3.029 20 0 HGADMO CC(C)[N@@H+]1[C@@H]2CCN(c3cc(-c4ccncc4)ncn3)C[C@@H]2C[C@H]1Cn1cccn1 ZINC001164841332 720614072 /nfs/dbraw/zinc/61/40/72/720614072.db2.gz RWQLLDIHLCMWLS-JAXLGGSGSA-N 1 1 403.534 3.113 20 0 HGADMO CC(C)(C)c1cc2ncnc(N3CC[N@H+]4C[C@@H](Oc5cncnc5)C[C@H]4C3)c2s1 ZINC001164743211 720656151 /nfs/dbraw/zinc/65/61/51/720656151.db2.gz XBRONWLHIBIQOW-GJZGRUSLSA-N 1 1 410.547 3.121 20 0 HGADMO C[N@@H+](Cc1ccccc1)[C@@H]1COC2(C1)CCN(c1cc(C(N)=O)cc(Cl)n1)CC2 ZINC001164838186 720664703 /nfs/dbraw/zinc/66/47/03/720664703.db2.gz GDBQVUQFXGZCHB-SFHVURJKSA-N 1 1 414.937 3.094 20 0 HGADMO COc1ccc2c(c1)nc(Cl)cc2N1CC[N@H+]2C[C@H](Oc3cncnc3)C[C@H]2C1 ZINC001164744334 720692831 /nfs/dbraw/zinc/69/28/31/720692831.db2.gz ZJVWJCMGFHRSCN-GOEBONIOSA-N 1 1 411.893 3.029 20 0 HGADMO COc1ccc2c(c1)nc(Cl)cc2N1CC[N@H+]2C[C@@H](Oc3cncnc3)C[C@H]2C1 ZINC001164744335 720693625 /nfs/dbraw/zinc/69/36/25/720693625.db2.gz ZJVWJCMGFHRSCN-HOCLYGCPSA-N 1 1 411.893 3.029 20 0 HGADMO Clc1cccc2nc(Cl)nc(N3CC[N@H+]4C[C@H](Oc5cncnc5)C[C@@H]4C3)c12 ZINC001164737950 720695701 /nfs/dbraw/zinc/69/57/01/720695701.db2.gz HWMBHCURWKQZQC-CHWSQXEVSA-N 1 1 417.300 3.069 20 0 HGADMO Clc1cnc(Cl)c(N2CC[N@@H+]3C[C@H](Oc4cncnc4)C[C@H]3C2)c1Cl ZINC001164736832 720706681 /nfs/dbraw/zinc/70/66/81/720706681.db2.gz BKZRKMSQUFPIIC-WDEREUQCSA-N 1 1 400.697 3.174 20 0 HGADMO Clc1cnc(Cl)c(N2CC[N@H+]3C[C@H](Oc4cncnc4)C[C@H]3C2)c1Cl ZINC001164736832 720706686 /nfs/dbraw/zinc/70/66/86/720706686.db2.gz BKZRKMSQUFPIIC-WDEREUQCSA-N 1 1 400.697 3.174 20 0 HGADMO FC(F)(c1cnc(Cl)c(C2CC2)c1)N1CC[N@@H+]2C[C@@H](Oc3cncnc3)C[C@@H]2C1 ZINC001164751143 720806439 /nfs/dbraw/zinc/80/64/39/720806439.db2.gz WZNBKRUNMLKMQB-CVEARBPZSA-N 1 1 421.879 3.289 20 0 HGADMO FC(F)(c1cnc(Cl)c(C2CC2)c1)N1CC[N@H+]2C[C@@H](Oc3cncnc3)C[C@@H]2C1 ZINC001164751143 720806442 /nfs/dbraw/zinc/80/64/42/720806442.db2.gz WZNBKRUNMLKMQB-CVEARBPZSA-N 1 1 421.879 3.289 20 0 HGADMO Clc1cc2[nH]ccc2c(N2CC[C@@H]3[C@H](C[C@@H](Cn4cncn4)[N@H+]3CC3CC3)C2)n1 ZINC001164737412 720817849 /nfs/dbraw/zinc/81/78/49/720817849.db2.gz AYGZGFSVJBAAMF-JTDSTZFVSA-N 1 1 411.941 3.187 20 0 HGADMO Clc1nc2ccccc2nc1N1CC[C@@H]2[C@@H](C[C@@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164739795 720823604 /nfs/dbraw/zinc/82/36/04/720823604.db2.gz IRAHDJVHQJAXBI-ABSDTBQOSA-N 1 1 423.952 3.254 20 0 HGADMO F[C@H](c1ccnc(Cl)c1)N1CC[C@@H]2[C@H](C[C@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164744630 720827718 /nfs/dbraw/zinc/82/77/18/720827718.db2.gz VPYSRWBOKQBMCC-MLYOOKFZSA-N 1 1 404.921 3.170 20 0 HGADMO Fc1cnc(N2CC[C@@H]3[C@@H](C[C@@H](Cn4cncn4)[N@H+]3CC3CC3)C2)c2ccccc12 ZINC001164738471 720830770 /nfs/dbraw/zinc/83/07/70/720830770.db2.gz FXDIEVDQHJQGQQ-NPPFBWRTSA-N 1 1 406.509 3.345 20 0 HGADMO Fc1cnc(N2CC[C@@H]3[C@H](C[C@@H](Cn4cncn4)[N@H+]3CC3CC3)C2)c2ccccc12 ZINC001164738466 720830873 /nfs/dbraw/zinc/83/08/73/720830873.db2.gz FXDIEVDQHJQGQQ-KGVIQGDOSA-N 1 1 406.509 3.345 20 0 HGADMO Clc1cc2cc[nH]c2nc1N1CC[C@@H]2[C@@H](C[C@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164741146 720835193 /nfs/dbraw/zinc/83/51/93/720835193.db2.gz DGUOBVABMMREBP-YQVWRLOYSA-N 1 1 411.941 3.139 20 0 HGADMO COCC[N@H+]1CCO[C@H]2CN(C(F)(F)c3ccc(Cl)nc3Cl)CC[C@H]2C1 ZINC001164857158 720835360 /nfs/dbraw/zinc/83/53/60/720835360.db2.gz XXGNQZBMXKMBNP-JSGCOSHPSA-N 1 1 410.292 3.107 20 0 HGADMO c1ncn(C[C@@H]2C[C@@H]3CN(c4nccc5c6c([nH]c54)CCC6)CC[C@H]3[N@H+]2CC2CC2)n1 ZINC001164753866 720857378 /nfs/dbraw/zinc/85/73/78/720857378.db2.gz YUWJZZIGOPYDQE-KGVIQGDOSA-N 1 1 417.561 3.023 20 0 HGADMO CC(C)(c1ccnc(Cl)c1)N1CC[C@@H]2[C@H](C[C@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164752851 720861340 /nfs/dbraw/zinc/86/13/40/720861340.db2.gz UTVZFICNOKFJQO-MISYRCLQSA-N 1 1 414.985 3.437 20 0 HGADMO CCc1cnc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COCc2cccnc2)nc1 ZINC001164750892 720871146 /nfs/dbraw/zinc/87/11/46/720871146.db2.gz KDYOACUUCDMTPN-VWNXMTODSA-N 1 1 407.562 3.189 20 0 HGADMO Clc1ccc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COCc2cccnc2)nn1 ZINC001164751573 720876712 /nfs/dbraw/zinc/87/67/12/720876712.db2.gz LBKCDQONUICTFU-DENIHFKCSA-N 1 1 413.953 3.280 20 0 HGADMO CCOc1cnc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COCc2cccnc2)nc1 ZINC001164751585 720882278 /nfs/dbraw/zinc/88/22/78/720882278.db2.gz CNWQRHGLRXAQGY-XUZZJYLKSA-N 1 1 423.561 3.025 20 0 HGADMO COCc1ccnc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COCc2cccnc2)c1 ZINC001164757185 720882949 /nfs/dbraw/zinc/88/29/49/720882949.db2.gz UEVPINJZCKAJIR-UKILVPOCSA-N 1 1 422.573 3.378 20 0 HGADMO CCOc1ccnc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COCc2cccnc2)n1 ZINC001164756818 720884431 /nfs/dbraw/zinc/88/44/31/720884431.db2.gz RDHHMVALLICLTI-ZJSXRUAMSA-N 1 1 423.561 3.025 20 0 HGADMO COCC[N@H+]1CCO[C@H]2CN(c3nc4c(Cl)cccc4nc3Cl)CC[C@H]2C1 ZINC001164865231 720886755 /nfs/dbraw/zinc/88/67/55/720886755.db2.gz ZAOVIBDCCFQDMZ-BBRMVZONSA-N 1 1 411.333 3.110 20 0 HGADMO COCC[N@H+]1CCO[C@H]2CN(c3c(Cl)ccc4c(Cl)ncnc43)CC[C@H]2C1 ZINC001164863839 720890775 /nfs/dbraw/zinc/89/07/75/720890775.db2.gz UUQWCKLHGONBPQ-BBRMVZONSA-N 1 1 411.333 3.110 20 0 HGADMO CCc1ccc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COCc2cccnc2)nn1 ZINC001164758437 720898090 /nfs/dbraw/zinc/89/80/90/720898090.db2.gz YCEWLAWMHUCHBN-XUZZJYLKSA-N 1 1 407.562 3.189 20 0 HGADMO COCc1ccc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COCc2cccnc2)nc1 ZINC001164751336 720914661 /nfs/dbraw/zinc/91/46/61/720914661.db2.gz LJVLADKKHRJONE-ZCYQVOJMSA-N 1 1 422.573 3.378 20 0 HGADMO COC(=O)c1ccc2c(c1)ncnc2N1CCn2c(C[N@@H+](C)C(C)C)cnc2[C@H]1C ZINC001164856577 720932509 /nfs/dbraw/zinc/93/25/09/720932509.db2.gz KKGARJWGPUUQLN-OAHLLOKOSA-N 1 1 408.506 3.034 20 0 HGADMO CCOC(=O)c1cc2ccc(N3CCn4c(C[N@@H+](C)C(C)C)cnc4[C@@H]3C)[nH]c-2n1 ZINC001164862791 720982230 /nfs/dbraw/zinc/98/22/30/720982230.db2.gz UQPASAWZQCRPFX-HNNXBMFYSA-N 1 1 410.522 3.358 20 0 HGADMO CCOC(=O)c1cc2ccc(N3CCn4c(C[N@H+](C)C(C)C)cnc4[C@@H]3C)nc2[nH]1 ZINC001164862791 720982261 /nfs/dbraw/zinc/98/22/61/720982261.db2.gz UQPASAWZQCRPFX-HNNXBMFYSA-N 1 1 410.522 3.358 20 0 HGADMO CCOC(=O)c1cc2ccc(N3CCn4c(C[N@@H+](C)C(C)C)cnc4[C@@H]3C)nc2[nH]1 ZINC001164862791 720982277 /nfs/dbraw/zinc/98/22/77/720982277.db2.gz UQPASAWZQCRPFX-HNNXBMFYSA-N 1 1 410.522 3.358 20 0 HGADMO CC(C)[N@@H+](C)Cc1cnc2n1CCN(C(F)(F)c1nc3[nH]cnc3c(Cl)n1)[C@@H]2C ZINC001164858146 721005784 /nfs/dbraw/zinc/00/57/84/721005784.db2.gz IFELZUGVVRVDLT-LLVKDONJSA-N 1 1 424.887 3.121 20 0 HGADMO COC(=O)[C@H](C)c1c(Cl)ncnc1N1CCn2c(C[N@@H+](C)C(C)C)cnc2[C@@H]1C ZINC001164858855 721022182 /nfs/dbraw/zinc/02/21/82/721022182.db2.gz IABAUWMZOJVHRO-KGLIPLIRSA-N 1 1 420.945 3.024 20 0 HGADMO CCC[N@H+]1CCCC[C@@H]1c1ccc(N2CC[C@@H]3[C@H]2CCN3C(=O)c2cnn(C)c2)nc1 ZINC001164761557 721038978 /nfs/dbraw/zinc/03/89/78/721038978.db2.gz GJZKBBLMMLMUNZ-YPAWHYETSA-N 1 1 422.577 3.246 20 0 HGADMO Clc1nnc(N2CC[N@H+]3C[C@@H](OCc4cccnc4)C[C@@H]3C2)c2sccc21 ZINC001164866040 721065436 /nfs/dbraw/zinc/06/54/36/721065436.db2.gz BXOAOACGAZETRB-CABCVRRESA-N 1 1 401.923 3.219 20 0 HGADMO Fc1cccc2nc(Cl)nc(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@@H]4C3)c12 ZINC001164866858 721072152 /nfs/dbraw/zinc/07/21/52/721072152.db2.gz GJLYGNGPUBMWPE-CVEARBPZSA-N 1 1 413.884 3.297 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(C(F)(F)c4cnc(Cl)nc4Cl)C[C@H]3C2)cn1 ZINC001164772612 721077275 /nfs/dbraw/zinc/07/72/75/721077275.db2.gz VFWJQXRZNREDML-CHWSQXEVSA-N 1 1 417.291 3.020 20 0 HGADMO Clc1nc2c(c(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@H]4C3)n1)CCCCC2 ZINC001164866969 721081852 /nfs/dbraw/zinc/08/18/52/721081852.db2.gz VRXLBUUMFSVPSS-ZWKOTPCHSA-N 1 1 413.953 3.274 20 0 HGADMO Cc1sc2nc(C)nc(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@@H]4C3)c2c1C ZINC001164865417 721084855 /nfs/dbraw/zinc/08/48/55/721084855.db2.gz LEWUPMXRFNNXDP-RTBURBONSA-N 1 1 409.559 3.491 20 0 HGADMO CCc1c(Cl)nnc(N2CC[N@H+]3C[C@H](OCc4cccnc4)C[C@H]3C2)c1CC ZINC001164865762 721091263 /nfs/dbraw/zinc/09/12/63/721091263.db2.gz PHDKRSVTTQTSCM-DLBZAZTESA-N 1 1 401.942 3.130 20 0 HGADMO Cc1cc2c(nc(Cl)nc2N2C[C@H]3CC[N@H+](Cc4cnn(C)c4)C[C@@H]3C2)s1 ZINC001164768954 721104871 /nfs/dbraw/zinc/10/48/71/721104871.db2.gz OJKHNFRXESROFZ-HUUCEWRRSA-N 1 1 402.955 3.345 20 0 HGADMO Cc1cc2c(nc(Cl)nc2N2C[C@@H]3CC[N@H+](Cc4cnn(C)c4)C[C@H]3C2)s1 ZINC001164768953 721104915 /nfs/dbraw/zinc/10/49/15/721104915.db2.gz OJKHNFRXESROFZ-GJZGRUSLSA-N 1 1 402.955 3.345 20 0 HGADMO Cc1cc2c(nc(Cl)nc2N2C[C@@H]3C[N@@H+](Cc4cnn(C)c4)CC[C@@H]3C2)s1 ZINC001164768952 721106006 /nfs/dbraw/zinc/10/60/06/721106006.db2.gz OJKHNFRXESROFZ-CABCVRRESA-N 1 1 402.955 3.345 20 0 HGADMO Cc1nc(C(F)(F)N2CC[N@H+]3C[C@H](OCc4cccnc4)C[C@@H]3C2)nc(Cl)c1C ZINC001164867335 721108459 /nfs/dbraw/zinc/10/84/59/721108459.db2.gz XYCZGALYDKDCSP-IAGOWNOFSA-N 1 1 423.895 3.166 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4nc(Cl)nc5c4CCCCC5)C[C@H]3C2)cn1 ZINC001164773258 721120977 /nfs/dbraw/zinc/12/09/77/721120977.db2.gz XOASRQFQZMHGJK-DLBZAZTESA-N 1 1 400.958 3.091 20 0 HGADMO Fc1cc2ncnc(Cl)c2c(N2CC[N@H+]3C[C@@H](OCc4cccnc4)C[C@H]3C2)c1 ZINC001164879572 721127633 /nfs/dbraw/zinc/12/76/33/721127633.db2.gz UAVVYXYQOFXPSG-IRXDYDNUSA-N 1 1 413.884 3.297 20 0 HGADMO CCc1cc2c(nc(Cl)nc2N2CC[N@H+]3C[C@H](OCc4cccnc4)C[C@@H]3C2)[nH]1 ZINC001164879093 721130297 /nfs/dbraw/zinc/13/02/97/721130297.db2.gz RTDVVZMHQUHGQY-IAGOWNOFSA-N 1 1 412.925 3.048 20 0 HGADMO c1cncc(CO[C@H]2C[C@H]3CN(c4ncnc5sc6c(c54)CCC6)CC[N@H+]3C2)c1 ZINC001164876440 721140117 /nfs/dbraw/zinc/14/01/17/721140117.db2.gz MLDVJRXKMUXIGJ-IRXDYDNUSA-N 1 1 407.543 3.055 20 0 HGADMO CCc1nc(Cl)c(N2CC[N@@H+]3C[C@@H](OCc4cccnc4)C[C@@H]3C2)c(Cl)n1 ZINC001164871565 721159513 /nfs/dbraw/zinc/15/95/13/721159513.db2.gz FLJULTQRZVKRRL-CABCVRRESA-N 1 1 408.333 3.221 20 0 HGADMO CCc1nc(Cl)c(N2CC[N@H+]3C[C@@H](OCc4cccnc4)C[C@@H]3C2)c(Cl)n1 ZINC001164871565 721159519 /nfs/dbraw/zinc/15/95/19/721159519.db2.gz FLJULTQRZVKRRL-CABCVRRESA-N 1 1 408.333 3.221 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4cccc(OCc5ccccc5)n4)C[C@H]3C2)cn1 ZINC001164768700 721174439 /nfs/dbraw/zinc/17/44/39/721174439.db2.gz LOQYPSZFKIPFES-FCHUYYIVSA-N 1 1 403.530 3.352 20 0 HGADMO Clc1cc(-c2ccncc2)nc(N2CC[N@H+]3C[C@@H](OCc4cccnc4)C[C@H]3C2)n1 ZINC001164880735 721182880 /nfs/dbraw/zinc/18/28/80/721182880.db2.gz XJLHLSBQYMOXNE-OALUTQOASA-N 1 1 422.920 3.067 20 0 HGADMO CCc1nc(Cl)nc(Cl)c1N1CC[N@H+]2C[C@@H](OCc3cccnc3)C[C@H]2C1 ZINC001164866459 721184963 /nfs/dbraw/zinc/18/49/63/721184963.db2.gz AXJJTHLDXBMCGQ-GJZGRUSLSA-N 1 1 408.333 3.221 20 0 HGADMO Fc1ccc2c(Cl)ncnc2c1N1CC[N@H+]2C[C@@H](OCc3cccnc3)C[C@@H]2C1 ZINC001164868050 721190197 /nfs/dbraw/zinc/19/01/97/721190197.db2.gz JQZVOHAFZIBLBN-CVEARBPZSA-N 1 1 413.884 3.297 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4ncccc4OCc4ccccc4)C[C@@H]3C2)cn1 ZINC001164768642 721191544 /nfs/dbraw/zinc/19/15/44/721191544.db2.gz LKHNUVCAWNMHHO-VXKWHMMOSA-N 1 1 403.530 3.352 20 0 HGADMO CCOc1ccc(-c2ccc(N3C[C@@H]4CC[N@@H+](Cc5cnn(C)c5)C[C@@H]4C3)nn2)cc1 ZINC001164770100 721218304 /nfs/dbraw/zinc/21/83/04/721218304.db2.gz NBCPWSSIWJCMJX-LEWJYISDSA-N 1 1 418.545 3.234 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4nnc(Cl)c5ccc(F)cc54)C[C@@H]3C2)cn1 ZINC001164763271 721224715 /nfs/dbraw/zinc/22/47/15/721224715.db2.gz FDNVRLLJPMMGQE-CABCVRRESA-N 1 1 400.889 3.114 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4nccc(SCc5ccccc5)n4)C[C@@H]3C2)cn1 ZINC001164767207 721229562 /nfs/dbraw/zinc/22/95/62/721229562.db2.gz WFNDHPQQKNPDJH-SFTDATJTSA-N 1 1 420.586 3.461 20 0 HGADMO Cc1c(Cl)nc(CC(C)C)nc1N1C[C@H]2CC[N@@H+](Cc3cnn(C)c3)C[C@@H]2C1 ZINC001164763939 721235637 /nfs/dbraw/zinc/23/56/37/721235637.db2.gz OHBMFIUUECDXRR-QZTJIDSGSA-N 1 1 402.974 3.329 20 0 HGADMO CCOC(=O)c1ccc2nc(Cl)nc(N3CC4(C3)CC[N@@H+](CC3CC3)C4)c2c1 ZINC001164770409 721297019 /nfs/dbraw/zinc/29/70/19/721297019.db2.gz RWFVJYHUGUXAMN-UHFFFAOYSA-N 1 1 400.910 3.382 20 0 HGADMO C[NH+]1CCC(Oc2ccnc(N3CCO[C@@H]4C[C@@H](COc5ccccn5)C[C@H]43)c2)CC1 ZINC001164880063 721315202 /nfs/dbraw/zinc/31/52/02/721315202.db2.gz PAJRMBSLQPYMBF-VLCRHTCISA-N 1 1 424.545 3.012 20 0 HGADMO COc1ccc(Cl)c(N2CCC[C@]3(C2)COCC[N@H+](Cc2c(C)noc2C)C3)n1 ZINC001164776724 721351127 /nfs/dbraw/zinc/35/11/27/721351127.db2.gz CEMLPIOFVNTVHN-NRFANRHFSA-N 1 1 420.941 3.467 20 0 HGADMO COc1ccc(Cl)c(N2CCC[C@]3(C2)COCC[N@@H+](Cc2c(C)noc2C)C3)n1 ZINC001164776724 721351129 /nfs/dbraw/zinc/35/11/29/721351129.db2.gz CEMLPIOFVNTVHN-NRFANRHFSA-N 1 1 420.941 3.467 20 0 HGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@]2(CCCN(c3nc(C)c(Cl)c(C)n3)C2)C1 ZINC001164786070 721355645 /nfs/dbraw/zinc/35/56/45/721355645.db2.gz VQKKZTUGHYYXBB-OAQYLSRUSA-N 1 1 419.957 3.471 20 0 HGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@]2(CCCN(c3nc(C)c(Cl)c(C)n3)C2)C1 ZINC001164786070 721355648 /nfs/dbraw/zinc/35/56/48/721355648.db2.gz VQKKZTUGHYYXBB-OAQYLSRUSA-N 1 1 419.957 3.471 20 0 HGADMO Cc1sc2ncnc(N3CC[C@]4(C3)CCC[C@@H](CN3CC[NH+](C)CC3)O4)c2c1C ZINC001164887428 721388992 /nfs/dbraw/zinc/38/89/92/721388992.db2.gz ICIFTOZNAAXXGS-AVRDEDQJSA-N 1 1 415.607 3.074 20 0 HGADMO C[NH+]1CCN(C[C@H]2CCC[C@@]3(CCN(c4nccc5cc(Cl)ncc54)C3)O2)CC1 ZINC001164885730 721400343 /nfs/dbraw/zinc/40/03/43/721400343.db2.gz HDBYXSODCAWIDO-GCJKJVERSA-N 1 1 415.969 3.049 20 0 HGADMO C[NH+]1CCN(C[C@@H]2CCC[C@@]3(CCN(c4nccc5cc(Cl)ncc54)C3)O2)CC1 ZINC001164885726 721400465 /nfs/dbraw/zinc/40/04/65/721400465.db2.gz HDBYXSODCAWIDO-AVRDEDQJSA-N 1 1 415.969 3.049 20 0 HGADMO C[NH+]1CCN(C[C@@H]2CCC[C@]3(CCN(c4cnc5c(Cl)cccc5n4)C3)O2)CC1 ZINC001164886681 721402318 /nfs/dbraw/zinc/40/23/18/721402318.db2.gz KSQQEAONQICCAO-HTAPYJJXSA-N 1 1 415.969 3.049 20 0 HGADMO CCOC(=O)c1cnc(Cl)c(C)c1N1C[C@@H]2C[N@@H+](Cc3nccs3)C[C@@H]2C1 ZINC001164783953 721413949 /nfs/dbraw/zinc/41/39/49/721413949.db2.gz JKKLLHUTPKXMQM-OKILXGFUSA-N 1 1 406.939 3.245 20 0 HGADMO CCOC(=O)c1cnc(Cl)c(C)c1N1C[C@@H]2C[N@H+](Cc3nccs3)C[C@@H]2C1 ZINC001164783953 721413950 /nfs/dbraw/zinc/41/39/50/721413950.db2.gz JKKLLHUTPKXMQM-OKILXGFUSA-N 1 1 406.939 3.245 20 0 HGADMO C[NH+]1CCN(C[C@H]2CCC[C@]3(CCN(c4cc5ccc(Cl)nc5cn4)C3)O2)CC1 ZINC001164886205 721415781 /nfs/dbraw/zinc/41/57/81/721415781.db2.gz ICYZEMWGZOKHPM-XMSQKQJNSA-N 1 1 415.969 3.049 20 0 HGADMO FC(F)(COc1cccc(Cl)n1)N1C[C@@H]2C[N@@H+](Cc3nccs3)C[C@@H]2C1 ZINC001164785011 721417217 /nfs/dbraw/zinc/41/72/17/721417217.db2.gz MCRPVFJGEWEKOZ-BETUJISGSA-N 1 1 400.882 3.227 20 0 HGADMO FC(F)(COc1cccc(Cl)n1)N1C[C@@H]2C[N@H+](Cc3nccs3)C[C@@H]2C1 ZINC001164785011 721417219 /nfs/dbraw/zinc/41/72/19/721417219.db2.gz MCRPVFJGEWEKOZ-BETUJISGSA-N 1 1 400.882 3.227 20 0 HGADMO C[NH+]1CCN(C[C@H]2CCC[C@]3(CCN(c4ncc5ccc(Cl)cc5n4)C3)O2)CC1 ZINC001164884545 721419118 /nfs/dbraw/zinc/41/91/18/721419118.db2.gz DUUYYIXZKGTTSW-DENIHFKCSA-N 1 1 415.969 3.049 20 0 HGADMO CSc1ccnc(Cl)c1N1CC[C@@]2(C1)CCC[C@@H](CN1CC[NH+](C)CC1)O2 ZINC001164890593 721421339 /nfs/dbraw/zinc/42/13/39/721421339.db2.gz TZNGPQZEXVOWHW-OXJNMPFZSA-N 1 1 411.015 3.222 20 0 HGADMO C[NH+]1CCN(C[C@@H]2CCC[C@]3(CCN(c4cc5c(Cl)ccnc5cn4)C3)O2)CC1 ZINC001164892993 721421481 /nfs/dbraw/zinc/42/14/81/721421481.db2.gz ZUXCSUANCPIBOW-HTAPYJJXSA-N 1 1 415.969 3.049 20 0 HGADMO COC(=O)C[C@H](c1ccnc(N2C[C@@H]3C[NH+](Cc4nccs4)C[C@H]3C2)c1)C1CC1 ZINC001164787350 721423605 /nfs/dbraw/zinc/42/36/05/721423605.db2.gz QGPODZSMJDHFFR-FHWLQOOXSA-N 1 1 412.559 3.163 20 0 HGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1ncnc3sccc31)CC2 ZINC001164784482 721448361 /nfs/dbraw/zinc/44/83/61/721448361.db2.gz FSAQZNGSWOOIDL-SFHVURJKSA-N 1 1 416.591 3.425 20 0 HGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1ncnc3[nH]c(C)cc31)CC2 ZINC001164787695 721455686 /nfs/dbraw/zinc/45/56/86/721455686.db2.gz PLTANMFXNUGDIF-LJQANCHMSA-N 1 1 413.566 3.000 20 0 HGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1nc(C)nc3c1CCC3)CC2 ZINC001164788592 721464122 /nfs/dbraw/zinc/46/41/22/721464122.db2.gz ULOQPDNVGHDWDP-HXUWFJFHSA-N 1 1 414.594 3.008 20 0 HGADMO CCCc1ccc(N2CCC3(C[C@@H](COCC4CC4)[N@@H+](CCOC)C3)CC2)nn1 ZINC001164791719 721467353 /nfs/dbraw/zinc/46/73/53/721467353.db2.gz XZCJKEOHXKSEKX-NRFANRHFSA-N 1 1 402.583 3.163 20 0 HGADMO COC(=O)c1nc(Cl)cnc1N1CCC2(CC([N@@H+](C)Cc3ccncc3)C2)CC1 ZINC001164792899 721496026 /nfs/dbraw/zinc/49/60/26/721496026.db2.gz UYTAQJCCTLMQJO-UHFFFAOYSA-N 1 1 415.925 3.193 20 0 HGADMO C[N@@H+](Cc1ccncc1)C1CC2(C1)CCN(c1ncc3ncnc(Cl)c3n1)CC2 ZINC001164795737 721497831 /nfs/dbraw/zinc/49/78/31/721497831.db2.gz LDSFUFJNOUIIQK-UHFFFAOYSA-N 1 1 409.925 3.349 20 0 HGADMO C[N@@H+](Cc1ccc(N2CCC3(CCC(=O)N3Cc3ccncc3)CC2)nc1)C1CC1 ZINC001164899916 721507346 /nfs/dbraw/zinc/50/73/46/721507346.db2.gz MJEFNOJUHFTVMO-UHFFFAOYSA-N 1 1 405.546 3.232 20 0 HGADMO COC(=O)c1cnc(N2CC[N@H+]3C[C@H](Oc4cccc(F)c4)C[C@H]3C2)c(Cl)c1 ZINC001164900460 721508890 /nfs/dbraw/zinc/50/88/90/721508890.db2.gz RCQMGVOYLYJVAZ-DOTOQJQBSA-N 1 1 405.857 3.003 20 0 HGADMO COc1cc2ncc(N3CC[N@H+]4C[C@@H](Oc5cccc(F)c5)C[C@H]4C3)nc2cc1OC ZINC001164905203 721531427 /nfs/dbraw/zinc/53/14/27/721531427.db2.gz GNPSHJCHAWJTJF-WMZOPIPTSA-N 1 1 424.476 3.128 20 0 HGADMO COc1ccc2nc(N3CC[N@H+]4C[C@@H](Oc5cccc(F)c5)C[C@H]4C3)nc(C)c2c1 ZINC001164912011 721540736 /nfs/dbraw/zinc/54/07/36/721540736.db2.gz YDDVAFXYBDTDCT-PXNSSMCTSA-N 1 1 408.477 3.428 20 0 HGADMO Cc1nc2cc(F)ccc2c(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@H]32)n1 ZINC001164805586 721541854 /nfs/dbraw/zinc/54/18/54/721541854.db2.gz MKVLHEXOWJHGKI-BHIFYINESA-N 1 1 407.493 3.341 20 0 HGADMO CCOC(=O)c1nc(N2CC[N@H+]3C[C@@H](Oc4cccc(F)c4)C[C@@H]3C2)ccc1Cl ZINC001164902982 721547744 /nfs/dbraw/zinc/54/77/44/721547744.db2.gz BPDYEWRHLJPOAB-WBVHZDCISA-N 1 1 419.884 3.393 20 0 HGADMO Cc1cc(N2CC[N@H+]3C[C@H](Oc4cccc(F)c4)C[C@@H]3C2)nc(-c2ccncc2)n1 ZINC001164903178 721551467 /nfs/dbraw/zinc/55/14/67/721551467.db2.gz BHXZKYHBLIYUKN-TZIWHRDSSA-N 1 1 405.477 3.328 20 0 HGADMO Fc1cccc(O[C@@H]2C[C@@H]3CN(c4cc(-c5nc(C6CC6)no5)ccn4)CC[N@H+]3C2)c1 ZINC001164910451 721562605 /nfs/dbraw/zinc/56/26/05/721562605.db2.gz WZIMIDPETLMIQL-UYAOXDASSA-N 1 1 421.476 3.490 20 0 HGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2cnc(-c3ccccc3)cn2)[C@@H]2CCCO[C@H]12 ZINC001164809893 721577157 /nfs/dbraw/zinc/57/71/57/721577157.db2.gz XYJCHHWHKDHWGK-AKFKNWHVSA-N 1 1 401.514 3.407 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2cnc(-c3ccccc3)cn2)[C@@H]2CCCO[C@H]12 ZINC001164809893 721577158 /nfs/dbraw/zinc/57/71/58/721577158.db2.gz XYJCHHWHKDHWGK-AKFKNWHVSA-N 1 1 401.514 3.407 20 0 HGADMO FC1(F)CCN(c2nc(Cl)nc3nc[nH]c32)C[C@@]12CC[N@@H+](Cc1ccccn1)C2 ZINC001164906700 721584152 /nfs/dbraw/zinc/58/41/52/721584152.db2.gz OWZXOEPIMNKYIW-SFHVURJKSA-N 1 1 419.867 3.139 20 0 HGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(C(F)(F)Oc2ccnc(Cl)c2)[C@@H]2CCCO[C@H]12 ZINC001164805104 721588807 /nfs/dbraw/zinc/58/88/07/721588807.db2.gz KRERYWRDCDSFDT-LMMKCTJWSA-N 1 1 424.879 3.423 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(C(F)(F)Oc2ccnc(Cl)c2)[C@@H]2CCCO[C@H]12 ZINC001164805104 721588809 /nfs/dbraw/zinc/58/88/09/721588809.db2.gz KRERYWRDCDSFDT-LMMKCTJWSA-N 1 1 424.879 3.423 20 0 HGADMO COC(=O)c1ccc(N2CCC(F)(F)[C@@]3(CC[N@@H+](Cc4ccccn4)C3)C2)nc1C ZINC001164908006 721700086 /nfs/dbraw/zinc/70/00/86/721700086.db2.gz XXQBRCXUMWFTIR-OAQYLSRUSA-N 1 1 416.472 3.309 20 0 HGADMO CCN(CC)c1cncc(N2CCC(F)(F)[C@]3(CC[N@@H+](Cc4ccccn4)C3)C2)n1 ZINC001164908545 721716029 /nfs/dbraw/zinc/71/60/29/721716029.db2.gz XSUXESGQJHXIIU-NRFANRHFSA-N 1 1 416.520 3.456 20 0 HGADMO CN(C)C(=O)C[NH+]1CCC2(CCCN2C(F)(F)c2cnc(Cl)cc2Cl)CC1 ZINC001165007407 721731107 /nfs/dbraw/zinc/73/11/07/721731107.db2.gz CKUQGFKGPLQXPP-UHFFFAOYSA-N 1 1 421.319 3.456 20 0 HGADMO Cc1cnc2c(ccnc2N2CCC(F)(F)[C@]3(CC[N@@H+](Cc4ccccn4)C3)C2)n1 ZINC001164910779 721732207 /nfs/dbraw/zinc/73/22/07/721732207.db2.gz HUNLOAOFVDBUFG-NRFANRHFSA-N 1 1 410.472 3.466 20 0 HGADMO CCOC(=O)c1ccc(N2CCc3c(C[N@H+](C)Cc4ccco4)cncc3C2)nc1 ZINC001164910059 721744711 /nfs/dbraw/zinc/74/47/11/721744711.db2.gz ZYLXGZDRFIAVSX-UHFFFAOYSA-N 1 1 406.486 3.441 20 0 HGADMO CCOC(=O)c1ccc(N2CCc3c(C[N@@H+](C)Cc4ccco4)cncc3C2)nc1 ZINC001164910059 721744722 /nfs/dbraw/zinc/74/47/22/721744722.db2.gz ZYLXGZDRFIAVSX-UHFFFAOYSA-N 1 1 406.486 3.441 20 0 HGADMO C[N@H+](Cc1ccco1)Cc1cncc2c1CCN(c1ncc(Cl)cc1C(N)=O)C2 ZINC001164908890 721746872 /nfs/dbraw/zinc/74/68/72/721746872.db2.gz NRGAGYGGPUVVLX-UHFFFAOYSA-N 1 1 411.893 3.017 20 0 HGADMO C[N@@H+](Cc1ccco1)Cc1cncc2c1CCN(c1ncc(Cl)cc1C(N)=O)C2 ZINC001164908890 721746878 /nfs/dbraw/zinc/74/68/78/721746878.db2.gz NRGAGYGGPUVVLX-UHFFFAOYSA-N 1 1 411.893 3.017 20 0 HGADMO CCOC(=O)c1cnc(C)nc1N1CCc2c(C[N@H+](C)Cc3ccco3)cncc2C1 ZINC001164910028 721751405 /nfs/dbraw/zinc/75/14/05/721751405.db2.gz YOUBPQFIEILDIC-UHFFFAOYSA-N 1 1 421.501 3.144 20 0 HGADMO CCOC(=O)c1cnc(C)nc1N1CCc2c(C[N@@H+](C)Cc3ccco3)cncc2C1 ZINC001164910028 721751407 /nfs/dbraw/zinc/75/14/07/721751407.db2.gz YOUBPQFIEILDIC-UHFFFAOYSA-N 1 1 421.501 3.144 20 0 HGADMO C[N@H+](Cc1ccco1)Cc1cncc2c1CCN(c1ncnc3c1ncn3C1CC1)C2 ZINC001164909483 721762093 /nfs/dbraw/zinc/76/20/93/721762093.db2.gz BGAPZQCEADQKNM-UHFFFAOYSA-N 1 1 415.501 3.344 20 0 HGADMO C[N@@H+](Cc1ccco1)Cc1cncc2c1CCN(c1ncnc3c1ncn3C1CC1)C2 ZINC001164909483 721762097 /nfs/dbraw/zinc/76/20/97/721762097.db2.gz BGAPZQCEADQKNM-UHFFFAOYSA-N 1 1 415.501 3.344 20 0 HGADMO C[N@H+](Cc1ccco1)Cc1cncc2c1CCN(c1c(Cl)nccc1C(N)=O)C2 ZINC001164910966 721764620 /nfs/dbraw/zinc/76/46/20/721764620.db2.gz MKHBCKPFEKDALG-UHFFFAOYSA-N 1 1 411.893 3.017 20 0 HGADMO C[N@@H+](Cc1ccco1)Cc1cncc2c1CCN(c1c(Cl)nccc1C(N)=O)C2 ZINC001164910966 721764626 /nfs/dbraw/zinc/76/46/26/721764626.db2.gz MKHBCKPFEKDALG-UHFFFAOYSA-N 1 1 411.893 3.017 20 0 HGADMO COC(=O)c1cnc(N2C[C@@H]3CCC[C@H]([N@@H+](C)Cc4ccccn4)[C@H]3C2)cc1OC ZINC001165023952 721803451 /nfs/dbraw/zinc/80/34/51/721803451.db2.gz KJSZWJQYTCNXMD-VDGAXYAQSA-N 1 1 410.518 3.009 20 0 HGADMO COC(=O)c1cc(OC)cnc1N1C[C@@H]2CCC[C@H]([N@@H+](C)Cc3ccccn3)[C@H]2C1 ZINC001165024047 721807425 /nfs/dbraw/zinc/80/74/25/721807425.db2.gz KVVSHVDYPNKTGG-NDXORKPFSA-N 1 1 410.518 3.009 20 0 HGADMO Cc1nc2nc(Cl)nc(N3C[C@@H]4CCC[C@@H]([N@@H+](C)Cc5ccccn5)[C@H]4C3)c2[nH]1 ZINC001165021336 721807555 /nfs/dbraw/zinc/80/75/55/721807555.db2.gz GKOVXZRBGDLQJO-BHYGNILZSA-N 1 1 411.941 3.447 20 0 HGADMO Cc1nc2c(nc(Cl)nc2N2C[C@@H]3CCC[C@@H]([N@H+](C)Cc4ccccn4)[C@H]3C2)[nH]1 ZINC001165021336 721807557 /nfs/dbraw/zinc/80/75/57/721807557.db2.gz GKOVXZRBGDLQJO-BHYGNILZSA-N 1 1 411.941 3.447 20 0 HGADMO Cc1nc2c(nc(Cl)nc2N2C[C@@H]3CCC[C@@H]([N@@H+](C)Cc4ccccn4)[C@H]3C2)[nH]1 ZINC001165021336 721807559 /nfs/dbraw/zinc/80/75/59/721807559.db2.gz GKOVXZRBGDLQJO-BHYGNILZSA-N 1 1 411.941 3.447 20 0 HGADMO CN(C)CC[N@H+]1CC[C@H]2[C@H]1CCN2c1ncnc2cc(OCc3ccccc3)ccc21 ZINC001164934399 721887861 /nfs/dbraw/zinc/88/78/61/721887861.db2.gz RILKHGWLICZWEB-RPWUZVMVSA-N 1 1 417.557 3.423 20 0 HGADMO C[NH+](C)CCN1CC[C@H]2[C@H]1CCN2c1ncnc2cc(OCc3ccccc3)ccc21 ZINC001164934399 721887864 /nfs/dbraw/zinc/88/78/64/721887864.db2.gz RILKHGWLICZWEB-RPWUZVMVSA-N 1 1 417.557 3.423 20 0 HGADMO COc1cccc(Oc2nc(Cl)ncc2N2CC[C@H]3[C@@H]2CC[N@@H+]3CCN(C)C)c1 ZINC001164932572 721888671 /nfs/dbraw/zinc/88/86/71/721888671.db2.gz JEXDYKRJIVQUIY-ROUUACIJSA-N 1 1 417.941 3.146 20 0 HGADMO COc1cccc(Oc2nc(Cl)ncc2N2CC[C@H]3[C@@H]2CC[N@H+]3CCN(C)C)c1 ZINC001164932572 721888672 /nfs/dbraw/zinc/88/86/72/721888672.db2.gz JEXDYKRJIVQUIY-ROUUACIJSA-N 1 1 417.941 3.146 20 0 HGADMO CC[NH+](CC)Cc1nc2sc(C)c(C)c2c(N2CC[C@H]3[C@H]2CCC(=O)N3C)n1 ZINC001164932385 721893226 /nfs/dbraw/zinc/89/32/26/721893226.db2.gz HJGHZMZKCKJHDM-JKSUJKDBSA-N 1 1 401.580 3.349 20 0 HGADMO COC(=O)c1cc(N2CCC3(CC2)C[N@@H+](Cc2ccc(C)cc2)CCO3)ncc1F ZINC001164938912 721924761 /nfs/dbraw/zinc/92/47/61/721924761.db2.gz AYMQQVNPFXPCSK-UHFFFAOYSA-N 1 1 413.493 3.187 20 0 HGADMO CCNC(=O)c1ccc(N2CCC3(CC2)C[N@@H+](Cc2ccc(C)cc2)CCO3)nc1 ZINC001164940691 721930238 /nfs/dbraw/zinc/93/02/38/721930238.db2.gz XDHHGLHZCARUSB-UHFFFAOYSA-N 1 1 408.546 3.011 20 0 HGADMO O=C(NC1CCCCC1)c1cccnc1N1CC[NH+](CCOc2ccccc2)CC1 ZINC001165042802 721952944 /nfs/dbraw/zinc/95/29/44/721952944.db2.gz RPTGBDQUPPIWLD-UHFFFAOYSA-N 1 1 408.546 3.345 20 0 HGADMO CCN(CCC(N)=O)c1nc(C[NH+]2CCCC2)nc2sc3c(c21)CC[C@H](C)C3 ZINC001165046746 721984219 /nfs/dbraw/zinc/98/42/19/721984219.db2.gz BYEJNZZMEGPAFY-AWEZNQCLSA-N 1 1 401.580 3.114 20 0 HGADMO C[C@H]1CCc2c(sc3nc(C[NH+]4CCCC4)nc(N4CCNC(=O)C4(C)C)c32)C1 ZINC001165052062 721994757 /nfs/dbraw/zinc/99/47/57/721994757.db2.gz QNNFEBUDCMZNRT-AWEZNQCLSA-N 1 1 413.591 3.127 20 0 HGADMO COC(=O)c1cnc(N2CCC3(CC[N@@H+](Cc4cccnc4)C3)CC2)c(Cl)c1 ZINC001164953689 722011926 /nfs/dbraw/zinc/01/19/26/722011926.db2.gz GAAIUNRRQNLVIF-UHFFFAOYSA-N 1 1 400.910 3.409 20 0 HGADMO CCOC(=O)c1nnc(Cl)cc1N1CCC2(CC[N@@H+](Cc3cccnc3)C2)CC1 ZINC001164953187 722016314 /nfs/dbraw/zinc/01/63/14/722016314.db2.gz SOTNGXJZSACLHS-UHFFFAOYSA-N 1 1 415.925 3.194 20 0 HGADMO O=C(c1ccco1)N1CC[C@H]2CN(c3nc(Cl)ccc3C[NH+]3CCCC3)C[C@H]21 ZINC001164960813 722047307 /nfs/dbraw/zinc/04/73/07/722047307.db2.gz XHMJWMQRQUOTTB-DOTOQJQBSA-N 1 1 400.910 3.275 20 0 HGADMO CCOC(=O)c1ccc(C)c(N2CCC3(CC2)COCC[N@@H+](Cc2ccncc2)C3)n1 ZINC001164958114 722051773 /nfs/dbraw/zinc/05/17/73/722051773.db2.gz CRAATRYLXIGNRU-UHFFFAOYSA-N 1 1 424.545 3.081 20 0 HGADMO Fc1ccc2ncnc(N3CCC4(CC3)COCC[N@@H+](Cc3ccncc3)C4)c2c1 ZINC001164961935 722053314 /nfs/dbraw/zinc/05/33/14/722053314.db2.gz ZETCWXQTSKFDCA-UHFFFAOYSA-N 1 1 407.493 3.283 20 0 HGADMO COc1nnc(N2CCC3(CC2)COCC[N@@H+](Cc2ccncc2)C3)c2ccccc21 ZINC001164959969 722059352 /nfs/dbraw/zinc/05/93/52/722059352.db2.gz AZECWUNHCBMVMU-UHFFFAOYSA-N 1 1 419.529 3.152 20 0 HGADMO CCC[N@H+]1CCCC[C@H]1c1ccc(N2CCCn3c(Cn4cccn4)nnc3C2)nc1 ZINC001164971818 722089094 /nfs/dbraw/zinc/08/90/94/722089094.db2.gz DOSXWZDTIOZXDW-FQEVSTJZSA-N 1 1 420.565 3.265 20 0 HGADMO FC(F)(c1ccnc(Cl)c1)N1CC[C@H]2C[N@@H+](Cc3cccnc3)CCO[C@H]2C1 ZINC001164986543 722100470 /nfs/dbraw/zinc/10/04/70/722100470.db2.gz ZGZOVUHCEZCHKK-WMZOPIPTSA-N 1 1 408.880 3.402 20 0 HGADMO c1ccc(-c2nccc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)n2)cc1 ZINC001164984721 722104661 /nfs/dbraw/zinc/10/46/61/722104661.db2.gz UEBFQJKJTJFHRQ-YADHBBJMSA-N 1 1 401.514 3.266 20 0 HGADMO Clc1cc2ccnc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)c2cn1 ZINC001164982179 722109670 /nfs/dbraw/zinc/10/96/70/722109670.db2.gz WCYNLUCMQOMAMA-QUCCMNQESA-N 1 1 409.921 3.406 20 0 HGADMO Clc1ccc2nc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)cnc2c1 ZINC001164975660 722110535 /nfs/dbraw/zinc/11/05/35/722110535.db2.gz KEQIMXURVIJJDY-LAUBAEHRSA-N 1 1 409.921 3.406 20 0 HGADMO Clc1nnc(N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)c2c1CCCC2 ZINC001164970861 722113153 /nfs/dbraw/zinc/11/31/53/722113153.db2.gz AAQIZFWVPWVFFF-YLJYHZDGSA-N 1 1 413.953 3.131 20 0 HGADMO COc1ccc2nc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)nc(C)c2c1 ZINC001164981114 722125605 /nfs/dbraw/zinc/12/56/05/722125605.db2.gz SQUMFKIFJJCENS-XXBNENTESA-N 1 1 419.529 3.069 20 0 HGADMO COc1ccc2cnc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)cc2c1 ZINC001164980961 722132814 /nfs/dbraw/zinc/13/28/14/722132814.db2.gz OGLNRLBBEMEMMR-NFBKMPQASA-N 1 1 404.514 3.366 20 0 HGADMO CC(C)(C)c1nc2[nH]ccc2c(N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)n1 ZINC001164975200 722135832 /nfs/dbraw/zinc/13/58/32/722135832.db2.gz FQVPZPGWTKNJKV-QUCCMNQESA-N 1 1 420.561 3.378 20 0 HGADMO COc1cccc2c1ccnc2N1CC[C@H]2C[N@@H+](Cc3cccnc3)CCO[C@@H]2C1 ZINC001164972817 722146502 /nfs/dbraw/zinc/14/65/02/722146502.db2.gz ARYLSBFNYSQPFK-WMZHIEFXSA-N 1 1 404.514 3.366 20 0 HGADMO Cc1csc2nc(C)nc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)c12 ZINC001164984573 722148120 /nfs/dbraw/zinc/14/81/20/722148120.db2.gz XCVLXYQBZOZZEU-RBUKOAKNSA-N 1 1 409.559 3.430 20 0 HGADMO c1cncc(C[N@H+]2CCO[C@H]3CN(c4ccc(COC5CCC5)cn4)CC[C@@H]3C2)c1 ZINC001164974801 722152127 /nfs/dbraw/zinc/15/21/27/722152127.db2.gz QRLIEBRMWFLKFT-GGAORHGYSA-N 1 1 408.546 3.273 20 0 HGADMO Cc1cc2ncnc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)c2cc1C ZINC001164972652 722152499 /nfs/dbraw/zinc/15/24/99/722152499.db2.gz IVMMVXOCEGGQHZ-NFBKMPQASA-N 1 1 403.530 3.369 20 0 HGADMO CN1CCN(c2cccc(N3CCC[C@@]4(CC[N@@H+]4Cc4cccc(F)c4)C3)n2)CC1 ZINC001164995944 722203351 /nfs/dbraw/zinc/20/33/51/722203351.db2.gz QEXBFAZPMFIGSE-XMMPIXPASA-N 1 1 409.553 3.217 20 0 HGADMO CN1CCN(c2cccc(N3CCC[C@@]4(CC[N@H+]4Cc4cccc(F)c4)C3)n2)CC1 ZINC001164995944 722203353 /nfs/dbraw/zinc/20/33/53/722203353.db2.gz QEXBFAZPMFIGSE-XMMPIXPASA-N 1 1 409.553 3.217 20 0 HGADMO O=C1CCC(=O)N1Cc1ccc(N2CCC[C@]3(CC[N@@H+]3Cc3cccc(F)c3)C2)nc1 ZINC001164995509 722203980 /nfs/dbraw/zinc/20/39/80/722203980.db2.gz NXIRLRHPVPANQU-DEOSSOPVSA-N 1 1 422.504 3.115 20 0 HGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2CCO[C@@H]3C[C@@H](C(=O)NC(C)C)C[C@H]32)nc1 ZINC001164997850 722216903 /nfs/dbraw/zinc/21/69/03/722216903.db2.gz SMXIPZSKMWHYGF-DOIPELPJSA-N 1 1 400.567 3.137 20 0 HGADMO Cc1cc(N2CCc3ncnc(N4CC[NH+](C)CC4)c3CC2)nc2cc(Cl)ccc12 ZINC001164996780 722235286 /nfs/dbraw/zinc/23/52/86/722235286.db2.gz IYGMHOJCRMUGAC-UHFFFAOYSA-N 1 1 422.964 3.344 20 0 HGADMO Cc1ccc(F)c2cc(C)c(N3CCc4ncnc(N5CC[NH+](C)CC5)c4CC3)nc12 ZINC001164996374 722235629 /nfs/dbraw/zinc/23/56/29/722235629.db2.gz FATBRIGVXSPYGM-UHFFFAOYSA-N 1 1 420.536 3.138 20 0 HGADMO COc1ccccc1N(C(C)=O)c1nc(C[NH2+]C2(CO)Cc3ccccc3C2)cs1 ZINC000555683710 1126096977 /nfs/dbraw/zinc/09/69/77/1126096977.db2.gz GLJJCFQCUBSKBK-UHFFFAOYSA-N 1 1 423.538 3.456 20 0 HGADMO C[C@@](CO)(Cc1ccccc1F)[NH2+]Cc1cn(-c2ccccc2Br)nn1 ZINC001461673166 1126196106 /nfs/dbraw/zinc/19/61/06/1126196106.db2.gz RKQFLEZRDXYNKU-IBGZPJMESA-N 1 1 419.298 3.252 20 0 HGADMO CC(C)C[C@H](C(=O)N1CC[NH+](Cc2ccccc2)CC1)N1Cc2ccccc2C1=O ZINC000020531368 568627144 /nfs/dbraw/zinc/62/71/44/568627144.db2.gz KIYIIQVZZLOBRB-HSZRJFAPSA-N 1 1 405.542 3.402 20 0 HGADMO CCOC(=O)c1cc(Cl)nnc1N1CCC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21 ZINC001164629647 719067231 /nfs/dbraw/zinc/06/72/31/719067231.db2.gz YKQPSIOHIPGYGL-AEFFLSMTSA-N 1 1 400.910 3.408 20 0 HGADMO CCOC(=O)c1ncnc(Cl)c1N1CCC[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21 ZINC001164625986 719093248 /nfs/dbraw/zinc/09/32/48/719093248.db2.gz HVOLGXXATQPDKE-IRXDYDNUSA-N 1 1 400.910 3.408 20 0 HGADMO CCCNC(=O)c1cc(Cl)nc(N2CCC[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)n1 ZINC001164621886 719114512 /nfs/dbraw/zinc/11/45/12/719114512.db2.gz BJZRICKTUAKMRS-PKOBYXMFSA-N 1 1 413.953 3.371 20 0 HGADMO CCOC(=O)c1cc(Cl)nc(N2CCc3c(C[NH+](C)C)nn(C(C)C)c3C2)c1 ZINC001164646495 719306404 /nfs/dbraw/zinc/30/64/04/719306404.db2.gz FFIKDNQNVNVBEL-UHFFFAOYSA-N 1 1 405.930 3.313 20 0 HGADMO COc1nc(Cl)ncc1C(F)(F)N1CCc2c(C[NH+](C)C)nn(C(C)C)c2C1 ZINC001164652802 719314158 /nfs/dbraw/zinc/31/41/58/719314158.db2.gz QGRXYUUMYBIJKY-UHFFFAOYSA-N 1 1 414.888 3.085 20 0 HGADMO CN(C[C@@H](O)CO)c1nc(C[NH+]2CCCCC2)nc2scc(-c3ccccc3)c21 ZINC001164668393 719366065 /nfs/dbraw/zinc/36/60/65/719366065.db2.gz NDXRIUISVYWNSQ-QGZVFWFLSA-N 1 1 412.559 3.134 20 0 HGADMO CNC(=O)C[N@H+]1CCCC12CCN(c1nc(Cl)nc3c(Cl)cccc31)CC2 ZINC001164683402 719716686 /nfs/dbraw/zinc/71/66/86/719716686.db2.gz KAOPGMMYCCMVMB-UHFFFAOYSA-N 1 1 408.333 3.117 20 0 HGADMO CCOC(=O)c1cncc(N2CCC3(CCC[N@H+]3Cc3csc(C)n3)CC2)n1 ZINC001164692931 719807698 /nfs/dbraw/zinc/80/76/98/719807698.db2.gz NVJOLZCLMVGDAT-UHFFFAOYSA-N 1 1 401.536 3.053 20 0 HGADMO COC(=O)[C@@]1(C)C[C@@H]([NH+]2CCOCC2)CCN1c1nc(Cl)cc2ccc(F)cc21 ZINC001164699335 719847099 /nfs/dbraw/zinc/84/70/99/719847099.db2.gz HMPGNGNQYSQDMH-HRAATJIYSA-N 1 1 421.900 3.260 20 0 HGADMO COC(=O)[C@@]1(C)C[C@@H]([NH+]2CCOCC2)CCN1c1cc(F)cc2ccc(Cl)nc21 ZINC001164704710 719855067 /nfs/dbraw/zinc/85/50/67/719855067.db2.gz SLNIYNQBDRPONI-HRAATJIYSA-N 1 1 421.900 3.260 20 0 HGADMO CN(C)c1nc(Cl)cc(N2CCC3(CC2)C[N@@H+](Cc2cccs2)CCO3)n1 ZINC001164696611 719886373 /nfs/dbraw/zinc/88/63/73/719886373.db2.gz AIXKJZOZBLTOML-UHFFFAOYSA-N 1 1 407.971 3.129 20 0 HGADMO CCCNC(=O)c1ccc(N2CCC3(CC2)C[N@@H+](Cc2cccs2)CCO3)nc1 ZINC001164705378 719898804 /nfs/dbraw/zinc/89/88/04/719898804.db2.gz AXXSYQOPDPEUNM-UHFFFAOYSA-N 1 1 414.575 3.154 20 0 HGADMO NC(=O)c1cc2ccccc2c(N2CCC3(CC2)C[N@@H+](Cc2cccs2)CCO3)n1 ZINC001164707896 719899734 /nfs/dbraw/zinc/89/97/34/719899734.db2.gz YMWQTBDRGLVRMM-UHFFFAOYSA-N 1 1 422.554 3.267 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(C(F)(F)Oc1ccc(Cl)nc1)C2 ZINC001164813194 720095691 /nfs/dbraw/zinc/09/56/91/720095691.db2.gz TUJYGKMTBDLDID-MAUKXSAKSA-N 1 1 401.885 3.344 20 0 HGADMO CCOC(=O)c1cnc(Cl)c(C)c1N1CC[C@@]2(C1)C[N@@H+](CC1CC1)C[C@H]2COC ZINC001164810587 720126012 /nfs/dbraw/zinc/12/60/12/720126012.db2.gz KGPPEDNHULYZOL-JTSKRJEESA-N 1 1 421.969 3.405 20 0 HGADMO CCN(CC)c1cc(N2CCC3(C[C@H](COC)[N@@H+](Cc4ccccn4)C3)CC2)ncn1 ZINC001164712259 720130805 /nfs/dbraw/zinc/13/08/05/720130805.db2.gz LZAXOWXZLUYQDK-OAQYLSRUSA-N 1 1 424.593 3.225 20 0 HGADMO COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1nc(Cl)c(F)cc1N)CC2 ZINC001164714775 720132760 /nfs/dbraw/zinc/13/27/60/720132760.db2.gz YVPRKRZMRVRWAO-INIZCTEOSA-N 1 1 419.932 3.359 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(C(F)(F)COc1cccc(Cl)n1)C2 ZINC001164815858 720137185 /nfs/dbraw/zinc/13/71/85/720137185.db2.gz WLNGXAPZHSPWFK-LPHOPBHVSA-N 1 1 415.912 3.387 20 0 HGADMO CCCN(CCC)c1cc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COC)ncn1 ZINC001164807409 720143731 /nfs/dbraw/zinc/14/37/31/720143731.db2.gz CGMYRGZZWIBCLB-NFBKMPQASA-N 1 1 401.599 3.288 20 0 HGADMO CCc1cc2c(nc(Cl)nc2N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COC)[nH]1 ZINC001164814242 720154618 /nfs/dbraw/zinc/15/46/18/720154618.db2.gz FDPTUTOJPRGERR-QVKFZJNVSA-N 1 1 403.958 3.358 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1nc(Cl)cc(-c3ccncc3)n1)C2 ZINC001164812697 720196523 /nfs/dbraw/zinc/19/65/23/720196523.db2.gz LXEFSTKLUWXGKG-XMSQKQJNSA-N 1 1 413.953 3.377 20 0 HGADMO CC(C)[N@@H+](C)Cc1cc(=O)n2c(n1)CN(c1nnc(Cl)c3ccccc31)CCC2 ZINC001164815213 720213914 /nfs/dbraw/zinc/21/39/14/720213914.db2.gz XBEXVRCBLYOQFM-UHFFFAOYSA-N 1 1 412.925 3.090 20 0 HGADMO CC[N@H+]1CCCC[C@H]1c1ccc(N2Cc3ccnn3C[C@@H](C(=O)N3CCCC3)C2)nc1 ZINC001164820322 720268194 /nfs/dbraw/zinc/26/81/94/720268194.db2.gz VSQHYQBOYBPLHV-UNMCSNQZSA-N 1 1 422.577 3.084 20 0 HGADMO CCOC(=O)c1cc2cccnc2nc1N1CC[C@H]2[C@H]1CC[N@H+]2Cc1cccnc1 ZINC001164725400 720379814 /nfs/dbraw/zinc/37/98/14/720379814.db2.gz NFOLIKPSHNJBMZ-VQTJNVASSA-N 1 1 403.486 3.055 20 0 HGADMO Cc1nc(CO[C@@H]2CN(c3ccc(C[N@H+](C)C4CC4)cn3)[C@@H]3CCCO[C@@H]23)cs1 ZINC001164825781 720392128 /nfs/dbraw/zinc/39/21/28/720392128.db2.gz VIGJJECOEFKKEN-KCZVDYSFSA-N 1 1 414.575 3.394 20 0 HGADMO COC(=O)c1cnc(Cl)c(C(F)(F)N2CC[C@H]3[C@@H]2CC[N@@H+]3Cc2cccnc2)c1 ZINC001164734399 720426802 /nfs/dbraw/zinc/42/68/02/720426802.db2.gz RXWXSZNJYVOLCW-IRXDYDNUSA-N 1 1 422.863 3.315 20 0 HGADMO COC(=O)c1cnc(Cl)c(C(F)(F)N2CC[C@H]3[C@@H]2CC[N@H+]3Cc2cccnc2)c1 ZINC001164734399 720426810 /nfs/dbraw/zinc/42/68/10/720426810.db2.gz RXWXSZNJYVOLCW-IRXDYDNUSA-N 1 1 422.863 3.315 20 0 HGADMO c1cncc(C[N@H+]2CC[C@@H]3[C@H]2CCN3c2ccc(-c3ccc4c(c3)OCCO4)nn2)c1 ZINC001164734741 720442274 /nfs/dbraw/zinc/44/22/74/720442274.db2.gz TZXBXDOVVJNCPI-NHCUHLMSSA-N 1 1 415.497 3.163 20 0 HGADMO COC(=O)c1nc(N2CC[C@@H]3[C@@H]2CC[N@H+]3Cc2cccnc2)c2ccccc2c1OC ZINC001164735070 720461068 /nfs/dbraw/zinc/46/10/68/720461068.db2.gz VMWBOBHGKAUJSN-UXHICEINSA-N 1 1 418.497 3.278 20 0 HGADMO CC(C)(c1ccnc(Cl)c1)[N@@H+]1CC[C@H]2OCC[C@@]2(C(=O)Nc2cccnc2)C1 ZINC001164729883 720504436 /nfs/dbraw/zinc/50/44/36/720504436.db2.gz KGRMCMGTUINVDI-DYESRHJHSA-N 1 1 400.910 3.485 20 0 HGADMO CC(C)(c1ccnc(Cl)c1)[N@H+]1CC[C@H]2OCC[C@@]2(C(=O)Nc2cccnc2)C1 ZINC001164729883 720504443 /nfs/dbraw/zinc/50/44/43/720504443.db2.gz KGRMCMGTUINVDI-DYESRHJHSA-N 1 1 400.910 3.485 20 0 HGADMO COC(=O)c1c(Cl)ccnc1N1CC[C@@H]2[C@@H](C[C@@H](Cn3cccn3)[N@H+]2C(C)C)C1 ZINC001164840073 720513068 /nfs/dbraw/zinc/51/30/68/720513068.db2.gz WHBXIDSVFSPAQO-XYJFISCASA-N 1 1 417.941 3.096 20 0 HGADMO CSc1ncc(Cl)c(N2CC[C@@H]3[C@H](C[C@H](Cn4cccn4)[N@H+]3C(C)C)C2)n1 ZINC001164833807 720517869 /nfs/dbraw/zinc/51/78/69/720517869.db2.gz DRKJNHOLUUGWDR-BFYDXBDKSA-N 1 1 406.987 3.426 20 0 HGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@H]2CN(c3nc(Cl)nc4cccnc43)CC[C@@H]21 ZINC001164840058 720520904 /nfs/dbraw/zinc/52/09/04/720520904.db2.gz WFIIDIQKALAFKX-BQFCYCMXSA-N 1 1 411.941 3.253 20 0 HGADMO CCOc1nc(Cl)cc(N2CC[C@@H]3[C@H](C[C@H](Cn4cccn4)[N@H+]3C(C)C)C2)n1 ZINC001164836567 720527939 /nfs/dbraw/zinc/52/79/39/720527939.db2.gz NGFAEHJFVORBAU-BRWVUGGUSA-N 1 1 404.946 3.103 20 0 HGADMO CCOC(=O)c1cc(N2CC[C@@H]3[C@H](C[C@H](Cn4cccn4)[N@H+]3C(C)C)C2)ncc1C ZINC001164842988 720553050 /nfs/dbraw/zinc/55/30/50/720553050.db2.gz ZKIACYLTHCTCNU-SFHLNBCPSA-N 1 1 411.550 3.141 20 0 HGADMO CCOc1c(Cl)ncnc1N1CC[C@@H]2[C@@H](C[C@@H](Cn3cccn3)[N@H+]2C(C)C)C1 ZINC001164840190 720554569 /nfs/dbraw/zinc/55/45/69/720554569.db2.gz SBQKXMAREOWGRX-YESZJQIVSA-N 1 1 404.946 3.103 20 0 HGADMO COc1nc(N2CC[C@@H]3[C@@H](C[C@@H](Cn4cccn4)[N@H+]3C(C)C)C2)nc2ccccc21 ZINC001164833627 720557498 /nfs/dbraw/zinc/55/74/98/720557498.db2.gz AYPQMDKMTCWTHR-BBTUJRGHSA-N 1 1 406.534 3.213 20 0 HGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@@H]2CN(c3ccnc(-c4cccnc4)n3)CC[C@@H]21 ZINC001164835438 720558015 /nfs/dbraw/zinc/55/80/15/720558015.db2.gz HJHFTHLXUSOCIG-HKBOAZHASA-N 1 1 403.534 3.113 20 0 HGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@@H]2CN(c3nccc(N4CCCCC4)n3)CC[C@@H]21 ZINC001164837398 720567719 /nfs/dbraw/zinc/56/77/19/720567719.db2.gz MGVXQIBBNXAMLL-HKBOAZHASA-N 1 1 409.582 3.041 20 0 HGADMO CCOCc1cnc(Cl)nc1N1CC[C@@H]2[C@@H](C[C@H](Cn3cccn3)[N@H+]2C(C)C)C1 ZINC001164840286 720587613 /nfs/dbraw/zinc/58/76/13/720587613.db2.gz PWRKLWBFFYKWFY-QXAKKESOSA-N 1 1 418.973 3.241 20 0 HGADMO Cc1nc(-c2ccncc2)cc(N2CC[C@@H]3[C@H](C[C@@H](Cn4cccn4)[N@@H+]3C(C)C)C2)n1 ZINC001164838156 720620078 /nfs/dbraw/zinc/62/00/78/720620078.db2.gz KCSMWCVSPKIPAN-FUPPJEDESA-N 1 1 417.561 3.421 20 0 HGADMO CC(C)(C)c1cc2ncnc(N3CC[N@H+]4C[C@@H](Oc5cncnc5)C[C@@H]4C3)c2s1 ZINC001164743210 720657856 /nfs/dbraw/zinc/65/78/56/720657856.db2.gz XBRONWLHIBIQOW-CABCVRRESA-N 1 1 410.547 3.121 20 0 HGADMO C[N@@H+](Cc1ccccc1)[C@@H]1COC2(C1)CCN(c1cc(Cl)ncc1C(N)=O)CC2 ZINC001164843221 720665754 /nfs/dbraw/zinc/66/57/54/720665754.db2.gz VNOAKHSEYDMIFF-KRWDZBQOSA-N 1 1 414.937 3.094 20 0 HGADMO CN(C)C(=O)c1ccc(N2CCC3(C[C@H]([N@@H+](C)Cc4ccccc4)CO3)CC2)nc1 ZINC001164841083 720683548 /nfs/dbraw/zinc/68/35/48/720683548.db2.gz HNQVIFDAFBCJJG-NRFANRHFSA-N 1 1 408.546 3.043 20 0 HGADMO CN(C)c1cc(Cl)nc(N2CCC3(C[C@@H]([N@@H+](C)Cc4ccccc4)CO3)CC2)n1 ZINC001164845323 720694255 /nfs/dbraw/zinc/69/42/55/720694255.db2.gz YEHACTPWHUINPI-GOSISDBHSA-N 1 1 415.969 3.456 20 0 HGADMO CC(C)c1nc(N(C)C)nc(N2CCC3(C[C@H]([N@@H+](C)Cc4ccccc4)CO3)CC2)n1 ZINC001164842623 720698173 /nfs/dbraw/zinc/69/81/73/720698173.db2.gz LSRAGLGRZGYMAO-FQEVSTJZSA-N 1 1 424.593 3.321 20 0 HGADMO C[N@@H+](Cc1ccccc1)[C@@H]1COC2(C1)CCN(c1c(Cl)nccc1C(N)=O)CC2 ZINC001164836499 720724818 /nfs/dbraw/zinc/72/48/18/720724818.db2.gz BNOHZWZQASMXQV-KRWDZBQOSA-N 1 1 414.937 3.094 20 0 HGADMO Cc1cc2nc(Cl)c(N3CC[N@H+]4C[C@@H](Oc5cncnc5)C[C@H]4C3)nc2cc1C ZINC001164742334 720726535 /nfs/dbraw/zinc/72/65/35/720726535.db2.gz OEMRUNCMTDEAAR-HOTGVXAUSA-N 1 1 410.909 3.032 20 0 HGADMO Cc1csc2c1nc(Cl)cc2N1CC[N@H+]2C[C@H](Oc3cncnc3)C[C@@H]2C1 ZINC001164737878 720735350 /nfs/dbraw/zinc/73/53/50/720735350.db2.gz DDLBAHAXKDIQAH-ZIAGYGMSSA-N 1 1 401.923 3.390 20 0 HGADMO c1ccc2c(c1)cccc2-c1ccc(N2CC[N@@H+]3C[C@@H](Oc4cncnc4)C[C@@H]3C2)nn1 ZINC001164742939 720782988 /nfs/dbraw/zinc/78/29/88/720782988.db2.gz PQYOINHLSFGUGW-UXHICEINSA-N 1 1 424.508 3.429 20 0 HGADMO c1ccc2c(c1)cccc2-c1ccc(N2CC[N@@H+]3C[C@@H](Oc4cncnc4)C[C@H]3C2)nn1 ZINC001164742938 720783777 /nfs/dbraw/zinc/78/37/77/720783777.db2.gz PQYOINHLSFGUGW-PMACEKPBSA-N 1 1 424.508 3.429 20 0 HGADMO Clc1ccc2c(Cl)nnc(N3CC[N@H+]4C[C@H](Oc5cncnc5)C[C@H]4C3)c2c1 ZINC001164748901 720792031 /nfs/dbraw/zinc/79/20/31/720792031.db2.gz RVBRDRQTFZODOV-UONOGXRCSA-N 1 1 417.300 3.069 20 0 HGADMO COc1cc2cnc(Cl)cc2cc1N1CC[N@H+]2C[C@@H](Oc3cncnc3)C[C@H]2C1 ZINC001164749829 720807383 /nfs/dbraw/zinc/80/73/83/720807383.db2.gz UPKWFEQHBRGWQG-IRXDYDNUSA-N 1 1 411.893 3.029 20 0 HGADMO FC(F)(c1ccnc(Cl)c1)N1CC[C@@H]2[C@@H](C[C@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164748954 720810397 /nfs/dbraw/zinc/81/03/97/720810397.db2.gz SBWRLIJANJRMJQ-CGTJXYLNSA-N 1 1 422.911 3.251 20 0 HGADMO Fc1ccc2nc(N3CC[C@@H]4[C@@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)ccc2c1 ZINC001164744446 720824705 /nfs/dbraw/zinc/82/47/05/720824705.db2.gz UGFTVTGNNCDOOT-CZTZKLFOSA-N 1 1 406.509 3.345 20 0 HGADMO Clc1ccc2ncc(N3CC[C@@H]4[C@@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)nc2c1 ZINC001164741412 720824926 /nfs/dbraw/zinc/82/49/26/720824926.db2.gz NTBVMPBLDHSJFO-YRISNDGFSA-N 1 1 423.952 3.254 20 0 HGADMO COC[C@@]12CCCO[C@@H]1CCN(c1ncnc3c1CC[N@H+](Cc1ccccc1)C3)C2 ZINC001164851045 720825675 /nfs/dbraw/zinc/82/56/75/720825675.db2.gz WJADUFLBWFOKCT-VWNXMTODSA-N 1 1 408.546 3.057 20 0 HGADMO COC[C@@]12CCCO[C@@H]1CCN(c1ncnc3c1CC[N@@H+](Cc1ccccc1)C3)C2 ZINC001164851045 720825677 /nfs/dbraw/zinc/82/56/77/720825677.db2.gz WJADUFLBWFOKCT-VWNXMTODSA-N 1 1 408.546 3.057 20 0 HGADMO Clc1ccnc(Cl)c1N1CC[C@@H]2[C@@H](C[C@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164745093 720826139 /nfs/dbraw/zinc/82/61/39/720826139.db2.gz WDOAWEQZFHQVEQ-ZMSDIMECSA-N 1 1 407.349 3.359 20 0 HGADMO COCC[N@H+]1CCO[C@@H]2CN(C(F)(F)c3cnc(Cl)c(Cl)c3)CC[C@H]2C1 ZINC001164852914 720835211 /nfs/dbraw/zinc/83/52/11/720835211.db2.gz MIKTYJAEQXFWPD-SWLSCSKDSA-N 1 1 410.292 3.107 20 0 HGADMO COCC[N@H+]1CCO[C@@H]2CN(C(F)(F)c3ccc(Cl)nc3Cl)CC[C@H]2C1 ZINC001164857156 720835224 /nfs/dbraw/zinc/83/52/24/720835224.db2.gz XXGNQZBMXKMBNP-GXTWGEPZSA-N 1 1 410.292 3.107 20 0 HGADMO COCC[N@H+]1CCO[C@H]2CN(C(F)(F)c3cc(Cl)cnc3Cl)CC[C@@H]2C1 ZINC001164856517 720836567 /nfs/dbraw/zinc/83/65/67/720836567.db2.gz WSDOOMZNMKRDRA-DOMZBBRYSA-N 1 1 410.292 3.107 20 0 HGADMO COCC[N@H+]1CCO[C@@H]2CN(c3ncnc4cc(C(C)(C)C)sc43)CC[C@H]2C1 ZINC001164857564 720844137 /nfs/dbraw/zinc/84/41/37/720844137.db2.gz YGCNKLKGDUMKLZ-DOTOQJQBSA-N 1 1 404.580 3.162 20 0 HGADMO COCC[N@H+]1CCO[C@H]2CN(c3nc(-c4ccccc4)nc4ccccc43)CC[C@H]2C1 ZINC001164853213 720849465 /nfs/dbraw/zinc/84/94/65/720849465.db2.gz NBONUUIWPCIXLP-REWPJTCUSA-N 1 1 418.541 3.470 20 0 HGADMO c1cc(-c2ccc(N3CC[C@H]4[C@H](C[C@@H](Cn5cncn5)[N@@H+]4CC4CC4)C3)nn2)cs1 ZINC001164749675 720855345 /nfs/dbraw/zinc/85/53/45/720855345.db2.gz OAWZZMMJLBJXLD-DYXWJJEUSA-N 1 1 421.574 3.176 20 0 HGADMO Cc1cc2ncnc(N3CC[C@@H]4[C@@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)c2cc1C ZINC001164751120 720856350 /nfs/dbraw/zinc/85/63/50/720856350.db2.gz QCCOEQUCZKRYGY-SXWKCWPCSA-N 1 1 417.561 3.218 20 0 HGADMO CCOc1cncc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COCc2cccnc2)n1 ZINC001164753934 720869051 /nfs/dbraw/zinc/86/90/51/720869051.db2.gz QKNSQKOWFOGBEN-ZJSXRUAMSA-N 1 1 423.561 3.025 20 0 HGADMO COCC[N@H+]1CCO[C@@H]2CN(C(F)(F)c3cc(SC)cnc3Cl)CC[C@H]2C1 ZINC001164861384 720871246 /nfs/dbraw/zinc/87/12/46/720871246.db2.gz XTYSYISYVKRTIZ-XJKSGUPXSA-N 1 1 421.941 3.175 20 0 HGADMO c1cncc(COC[C@H]2C[N@@H+](CC3CC3)C[C@]23CCN(c2ncnc4c2CCC4)C3)c1 ZINC001164755315 720875155 /nfs/dbraw/zinc/87/51/55/720875155.db2.gz WMXKITJJPZKTOO-BWKNWUBXSA-N 1 1 419.573 3.115 20 0 HGADMO Cc1ncc(F)c(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COCc2cccnc2)n1 ZINC001164752910 720879069 /nfs/dbraw/zinc/87/90/69/720879069.db2.gz NLELSHWUZNHXPI-NFBKMPQASA-N 1 1 411.525 3.074 20 0 HGADMO COCC[N@H+]1CCO[C@H]2CN(c3ccc(-c4cccc5ccccc54)nn3)CC[C@H]2C1 ZINC001164853904 720882143 /nfs/dbraw/zinc/88/21/43/720882143.db2.gz DSOMWAUEEZCXPL-RDPSFJRHSA-N 1 1 418.541 3.470 20 0 HGADMO COCC[N@H+]1CCO[C@H]2CN(c3c(Cl)ccc4c(Cl)ncnc43)CC[C@@H]2C1 ZINC001164863843 720890806 /nfs/dbraw/zinc/89/08/06/720890806.db2.gz UUQWCKLHGONBPQ-CJNGLKHVSA-N 1 1 411.333 3.110 20 0 HGADMO COCC[N@H+]1CCO[C@@H]2CN(c3cc(Cl)nc4c(F)ccc(F)c34)CC[C@@H]2C1 ZINC001164853843 720890854 /nfs/dbraw/zinc/89/08/54/720890854.db2.gz DAIVNBDEGDNFPY-CXAGYDPISA-N 1 1 411.880 3.340 20 0 HGADMO CCc1nccc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COCc2cccnc2)n1 ZINC001164751671 720895741 /nfs/dbraw/zinc/89/57/41/720895741.db2.gz DBKUZRZVTQZXOV-ZJSXRUAMSA-N 1 1 407.562 3.189 20 0 HGADMO COC(=O)c1cccc2nc(N3CCn4c(C[N@@H+](C)C(C)C)cnc4[C@@H]3C)ncc21 ZINC001164861855 720945502 /nfs/dbraw/zinc/94/55/02/720945502.db2.gz UNNFXZUQHGHQSO-HNNXBMFYSA-N 1 1 408.506 3.034 20 0 HGADMO CC(C)[N@@H+](C)Cc1cnc2n1CCN(C(F)(F)Oc1cnc(Cl)cn1)[C@@H]2C ZINC001164858838 721022684 /nfs/dbraw/zinc/02/26/84/721022684.db2.gz HVBKWRMSFPNIGC-GFCCVEGCSA-N 1 1 400.861 3.173 20 0 HGADMO FC(F)(c1cnc(Cl)c(Cl)c1)N1CCc2[nH+]cc(Cn3cccn3)n2CC1 ZINC001164861982 721030964 /nfs/dbraw/zinc/03/09/64/721030964.db2.gz JFNVNAAWKVYEEA-UHFFFAOYSA-N 1 1 413.259 3.437 20 0 HGADMO Cc1cc(C(F)(F)N2CC[N@H+]3C[C@H](OCc4cccnc4)C[C@H]3C2)cc(Cl)n1 ZINC001164867685 721048687 /nfs/dbraw/zinc/04/86/87/721048687.db2.gz JQYCFIBYZLDMJZ-ZWKOTPCHSA-N 1 1 408.880 3.463 20 0 HGADMO Fc1ccc2nc(Cl)nc(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@H]4C3)c2c1 ZINC001164868731 721055333 /nfs/dbraw/zinc/05/53/33/721055333.db2.gz QEIAVNRWQBHIAY-DLBZAZTESA-N 1 1 413.884 3.297 20 0 HGADMO Fc1ccc2nc(Cl)nc(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@@H]4C3)c2c1 ZINC001164868733 721056406 /nfs/dbraw/zinc/05/64/06/721056406.db2.gz QEIAVNRWQBHIAY-IAGOWNOFSA-N 1 1 413.884 3.297 20 0 HGADMO Fc1ccc(C(F)(F)N2CC[N@H+]3C[C@@H](OCc4cccnc4)C[C@H]3C2)nc1Cl ZINC001164868746 721057090 /nfs/dbraw/zinc/05/70/90/721057090.db2.gz QFSQQRSXMNYEQG-GJZGRUSLSA-N 1 1 412.843 3.294 20 0 HGADMO Cc1ccc2nc(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@H]4C3)c(Cl)nc2c1 ZINC001164863974 721080948 /nfs/dbraw/zinc/08/09/48/721080948.db2.gz DKYPTTNWOIOMTF-ZWKOTPCHSA-N 1 1 409.921 3.466 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(C(F)(F)c4nc(Cl)cc(Cl)n4)C[C@H]3C2)cn1 ZINC001164772561 721082873 /nfs/dbraw/zinc/08/28/73/721082873.db2.gz VCNLQXKXBDQCTE-QWHCGFSZSA-N 1 1 417.291 3.020 20 0 HGADMO COc1ccc(C(F)(F)N2CC[N@H+]3C[C@@H](OCc4cccnc4)C[C@H]3C2)c(Cl)n1 ZINC001164865403 721084773 /nfs/dbraw/zinc/08/47/73/721084773.db2.gz LBUVSBOMRHZPIB-HOTGVXAUSA-N 1 1 424.879 3.163 20 0 HGADMO COc1ccc(-c2ccc(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@H]4C3)nn2)cc1 ZINC001164870249 721140942 /nfs/dbraw/zinc/14/09/42/721140942.db2.gz CAMNNGDAKQUJSU-RBBKRZOGSA-N 1 1 417.513 3.027 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4nc(Cl)cc(Cc5ccccc5)n4)C[C@@H]3C2)cn1 ZINC001164770842 721173740 /nfs/dbraw/zinc/17/37/40/721173740.db2.gz OXCXNGWPAXWWBJ-PMACEKPBSA-N 1 1 422.964 3.413 20 0 HGADMO FC(F)(Oc1ccnc(Cl)c1)N1CC[N@H+]2C[C@@H](OCc3cccnc3)C[C@@H]2C1 ZINC001164879588 721182832 /nfs/dbraw/zinc/18/28/32/721182832.db2.gz UDIGHNNDKNNTOB-WBVHZDCISA-N 1 1 410.852 3.034 20 0 HGADMO Clc1cc(-c2ccncc2)nc(N2CC[N@H+]3C[C@H](OCc4cccnc4)C[C@H]3C2)n1 ZINC001164880736 721183292 /nfs/dbraw/zinc/18/32/92/721183292.db2.gz XJLHLSBQYMOXNE-RBUKOAKNSA-N 1 1 422.920 3.067 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4nc(Cl)nc5c(Cl)nccc54)C[C@H]3C2)cn1 ZINC001164762041 721189096 /nfs/dbraw/zinc/18/90/96/721189096.db2.gz CCTAQZYGCRCHOB-ZIAGYGMSSA-N 1 1 418.332 3.023 20 0 HGADMO Fc1ccc2c(c1)[nH]c1ncnc(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@@H]4C3)c21 ZINC001164870842 721192924 /nfs/dbraw/zinc/19/29/24/721192924.db2.gz WOSAMWLMNYOFQO-QZTJIDSGSA-N 1 1 418.476 3.125 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4cc(-c5cccc(Cl)c5)ncn4)C[C@H]3C2)cn1 ZINC001164773857 721210816 /nfs/dbraw/zinc/21/08/16/721210816.db2.gz XMCHNJGYTSENCQ-RTBURBONSA-N 1 1 408.937 3.489 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4cc5nc(Cl)cnc5cc4F)C[C@H]3C2)cn1 ZINC001164768519 721213607 /nfs/dbraw/zinc/21/36/07/721213607.db2.gz LFCDNGSEJVJQBN-LSDHHAIUSA-N 1 1 400.889 3.114 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4ncc(Cl)nc4-c4ccccc4)C[C@@H]3C2)cn1 ZINC001164772370 721216339 /nfs/dbraw/zinc/21/63/39/721216339.db2.gz TXSUEOUSTIEUHJ-MOPGFXCFSA-N 1 1 408.937 3.489 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4cc(SCc5ccccc5)ncn4)C[C@@H]3C2)cn1 ZINC001164769137 721223591 /nfs/dbraw/zinc/22/35/91/721223591.db2.gz LTHOJZYGUHIPQB-RTWAWAEBSA-N 1 1 420.586 3.461 20 0 HGADMO Cc1cc(N2C[C@@H]3CC[N@H+](Cc4cnn(C)c4)C[C@H]3C2)nc(-c2ccc(Cl)nc2)n1 ZINC001164763911 721230918 /nfs/dbraw/zinc/23/09/18/721230918.db2.gz OBBANONZPVRUPC-OALUTQOASA-N 1 1 423.952 3.192 20 0 HGADMO Cc1cnc(N2C[C@@H]3CC[N@H+](Cc4cnn(C)c4)C[C@H]3C2)nc1-c1ccccc1F ZINC001164762507 721238013 /nfs/dbraw/zinc/23/80/13/721238013.db2.gz LASHFJIZMPGZBA-OALUTQOASA-N 1 1 406.509 3.283 20 0 HGADMO CC(C)(c1ccnc(Cl)c1)[N@H+]1C[C@@H]2COC[C@@H](C(=O)NCc3ccco3)[C@H]2C1 ZINC001164760183 721259079 /nfs/dbraw/zinc/25/90/79/721259079.db2.gz CWRQMPUWSFSMJF-FHLIZLRMSA-N 1 1 403.910 3.074 20 0 HGADMO CCC[N@H+]1CCCC[C@@H]1c1ccc(N2C[C@@H]3[C@H](C2)OCCN3c2ccc(C)nn2)nc1 ZINC001164777552 721313562 /nfs/dbraw/zinc/31/35/62/721313562.db2.gz SRGWVCGODSYLFG-VSKRKVRLSA-N 1 1 422.577 3.211 20 0 HGADMO CSc1nc(C)cc(N2CCC[C@@]3(C2)COCC[N@H+](Cc2c(C)noc2C)C3)n1 ZINC001164776157 721332182 /nfs/dbraw/zinc/33/21/82/721332182.db2.gz CYCWLEYBYRPCLC-OAQYLSRUSA-N 1 1 417.579 3.231 20 0 HGADMO CSc1nc(C)cc(N2CCC[C@@]3(C2)COCC[N@@H+](Cc2c(C)noc2C)C3)n1 ZINC001164776157 721332183 /nfs/dbraw/zinc/33/21/83/721332183.db2.gz CYCWLEYBYRPCLC-OAQYLSRUSA-N 1 1 417.579 3.231 20 0 HGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@]2(CCCN(c3ccc(C(C)(C)C)nn3)C2)C1 ZINC001164782297 721366668 /nfs/dbraw/zinc/36/66/68/721366668.db2.gz MRUDYDDBPNNICD-HSZRJFAPSA-N 1 1 413.566 3.498 20 0 HGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@]2(CCCN(c3ccc(C(C)(C)C)nn3)C2)C1 ZINC001164782297 721366671 /nfs/dbraw/zinc/36/66/71/721366671.db2.gz MRUDYDDBPNNICD-HSZRJFAPSA-N 1 1 413.566 3.498 20 0 HGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@@]2(CCCN(c3ccc(Cl)c(N)n3)C2)C1 ZINC001164785387 721375879 /nfs/dbraw/zinc/37/58/79/721375879.db2.gz SCAKNWAVZIVHCB-FQEVSTJZSA-N 1 1 405.930 3.041 20 0 HGADMO CCc1cc(CC)nc(N2CCC[C@@]3(C2)COCC[N@H+](Cc2c(C)noc2C)C3)n1 ZINC001164785364 721376049 /nfs/dbraw/zinc/37/60/49/721376049.db2.gz ROXDMTWAFWLBIF-HSZRJFAPSA-N 1 1 413.566 3.325 20 0 HGADMO CCc1cc(CC)nc(N2CCC[C@@]3(C2)COCC[N@@H+](Cc2c(C)noc2C)C3)n1 ZINC001164785364 721376054 /nfs/dbraw/zinc/37/60/54/721376054.db2.gz ROXDMTWAFWLBIF-HSZRJFAPSA-N 1 1 413.566 3.325 20 0 HGADMO C[NH+]1CCN(C[C@@H]2CCC[C@]3(CCN(c4nccc5c(Cl)ccnc54)C3)O2)CC1 ZINC001164888452 721390318 /nfs/dbraw/zinc/39/03/18/721390318.db2.gz JJHSVDBEJZGZFS-HTAPYJJXSA-N 1 1 415.969 3.049 20 0 HGADMO C[NH+]1CCN(C[C@H]2CCC[C@]3(CCN(c4nccc5c(Cl)ccnc54)C3)O2)CC1 ZINC001164888479 721390367 /nfs/dbraw/zinc/39/03/67/721390367.db2.gz JJHSVDBEJZGZFS-VGOFRKELSA-N 1 1 415.969 3.049 20 0 HGADMO C[NH+]1CCN(C[C@H]2CCC[C@]3(CCN(c4ncnc5c(Cl)cccc54)C3)O2)CC1 ZINC001164884402 721393419 /nfs/dbraw/zinc/39/34/19/721393419.db2.gz APMPCVIWERWSOK-VGOFRKELSA-N 1 1 415.969 3.049 20 0 HGADMO C[NH+]1CCN(C[C@H]2CCC[C@@]3(CCN(c4ncnc5c(Cl)cccc54)C3)O2)CC1 ZINC001164884403 721393862 /nfs/dbraw/zinc/39/38/62/721393862.db2.gz APMPCVIWERWSOK-VGSWGCGISA-N 1 1 415.969 3.049 20 0 HGADMO C[NH+]1CCN(C[C@@H]2CCC[C@@]3(CCN(c4csc5ncnc(Cl)c45)C3)O2)CC1 ZINC001164892423 721402277 /nfs/dbraw/zinc/40/22/77/721402277.db2.gz YCEWSKSKECCIFH-YWZLYKJASA-N 1 1 421.998 3.110 20 0 HGADMO C[NH+]1CCN(C[C@@H]2CCC[C@@]3(CCN(c4cnc5ccc(Cl)cc5n4)C3)O2)CC1 ZINC001164885638 721405670 /nfs/dbraw/zinc/40/56/70/721405670.db2.gz GWSPDCUGJQTDJB-AVRDEDQJSA-N 1 1 415.969 3.049 20 0 HGADMO CCN(CC)C(=O)c1cc(Cl)nc(N2C[C@@H]3C[N@@H+](Cc4nccs4)C[C@@H]3C2)c1 ZINC001164781806 721413808 /nfs/dbraw/zinc/41/38/08/721413808.db2.gz FFVJCSHQHNXNIU-IYBDPMFKSA-N 1 1 419.982 3.242 20 0 HGADMO CCN(CC)C(=O)c1cc(Cl)nc(N2C[C@@H]3C[N@H+](Cc4nccs4)C[C@@H]3C2)c1 ZINC001164781806 721413810 /nfs/dbraw/zinc/41/38/10/721413810.db2.gz FFVJCSHQHNXNIU-IYBDPMFKSA-N 1 1 419.982 3.242 20 0 HGADMO C[NH+]1CCN(C[C@H]2CCC[C@@]3(CCN(c4ncc5cc(Cl)ccc5n4)C3)O2)CC1 ZINC001164887199 721416690 /nfs/dbraw/zinc/41/66/90/721416690.db2.gz LJQWWMRZAJWMEC-KNQAVFIVSA-N 1 1 415.969 3.049 20 0 HGADMO C[NH+]1CCN(C[C@@H]2CCC[C@]3(CCN(c4ncc5c(Cl)cccc5n4)C3)O2)CC1 ZINC001164888968 721417212 /nfs/dbraw/zinc/41/72/12/721417212.db2.gz PVXOBPDAQUMTGT-HTAPYJJXSA-N 1 1 415.969 3.049 20 0 HGADMO COc1ccc2ccc(N3CC[C@]4(C3)CCC[C@@H](CN3CC[NH+](C)CC3)O4)nc2c1 ZINC001164885161 721419668 /nfs/dbraw/zinc/41/96/68/721419668.db2.gz GCDMAMWPDPPZGX-URXFXBBRSA-N 1 1 410.562 3.009 20 0 HGADMO CSc1cc(Cl)cnc1N1CC[C@]2(C1)CCC[C@H](CN1CC[NH+](C)CC1)O2 ZINC001164898300 721430112 /nfs/dbraw/zinc/43/01/12/721430112.db2.gz VQLKUDZYNWPSNZ-XLIONFOSSA-N 1 1 411.015 3.222 20 0 HGADMO COc1ccc(OC)c(-c2ccc(N3C[C@@H]4C[N@@H+](Cc5nccs5)C[C@@H]4C3)nn2)c1 ZINC001164784684 721431457 /nfs/dbraw/zinc/43/14/57/721431457.db2.gz LPRWXVDSQZTLID-IYBDPMFKSA-N 1 1 423.542 3.186 20 0 HGADMO COc1ccc(OC)c(-c2ccc(N3C[C@@H]4C[N@H+](Cc5nccs5)C[C@@H]4C3)nn2)c1 ZINC001164784684 721431460 /nfs/dbraw/zinc/43/14/60/721431460.db2.gz LPRWXVDSQZTLID-IYBDPMFKSA-N 1 1 423.542 3.186 20 0 HGADMO Cc1nc(C2CC2)nc(Cl)c1N1CC[C@]2(C1)CCC[C@H](CN1CC[NH+](C)CC1)O2 ZINC001164895373 721438159 /nfs/dbraw/zinc/43/81/59/721438159.db2.gz OCJCIDIORRNUHZ-GCJKJVERSA-N 1 1 420.001 3.081 20 0 HGADMO C[NH+]1CCN(C[C@H]2CCC[C@]3(CCN(c4nccnc4Oc4ccccc4)C3)O2)CC1 ZINC001164889563 721443693 /nfs/dbraw/zinc/44/36/93/721443693.db2.gz BSJVUGLZTYRBFK-ZJSXRUAMSA-N 1 1 423.561 3.034 20 0 HGADMO Cc1c(Cl)nc(C(C)C)nc1N1CC[C@@]2(C1)CCC[C@@H](CN1CC[NH+](C)CC1)O2 ZINC001164895446 721446398 /nfs/dbraw/zinc/44/63/98/721446398.db2.gz PDQNQWWFSUPLBI-PGRDOPGGSA-N 1 1 422.017 3.327 20 0 HGADMO CC(C)c1c(Cl)ncnc1N1CC[C@@]2(C1)CCC[C@H](CN1CC[NH+](C)CC1)O2 ZINC001164892228 721446657 /nfs/dbraw/zinc/44/66/57/721446657.db2.gz HTVLTDHPWLMPNE-DYESRHJHSA-N 1 1 407.990 3.019 20 0 HGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1cc(N)cc(Cl)n1)CC2 ZINC001164787663 721457386 /nfs/dbraw/zinc/45/73/86/721457386.db2.gz PCCSWXRTUXTGRW-SFHVURJKSA-N 1 1 408.974 3.051 20 0 HGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1ccc3ncccc3n1)CC2 ZINC001164784652 721458502 /nfs/dbraw/zinc/45/85/02/721458502.db2.gz JGBGVMTZBPEDRK-HXUWFJFHSA-N 1 1 410.562 3.364 20 0 HGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1ncc(N)cc1Cl)CC2 ZINC001164784411 721460084 /nfs/dbraw/zinc/46/00/84/721460084.db2.gz HUUBQGVGGLOHEN-GOSISDBHSA-N 1 1 408.974 3.051 20 0 HGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1nccc3cnccc31)CC2 ZINC001164786838 721463040 /nfs/dbraw/zinc/46/30/40/721463040.db2.gz PTAWVICLXUDVMH-OAQYLSRUSA-N 1 1 410.562 3.364 20 0 HGADMO CC(C)C(=O)N1CC[C@H]2CN(c3ncnc4c3CC[N@H+](Cc3ccccc3)C4)CC[C@@H]21 ZINC001164895118 721463857 /nfs/dbraw/zinc/46/38/57/721463857.db2.gz ZLLPWMAGLVBHAH-REWPJTCUSA-N 1 1 419.573 3.118 20 0 HGADMO CC(C)C(=O)N1CC[C@H]2CN(c3ncnc4c3CC[N@@H+](Cc3ccccc3)C4)CC[C@@H]21 ZINC001164895118 721463859 /nfs/dbraw/zinc/46/38/59/721463859.db2.gz ZLLPWMAGLVBHAH-REWPJTCUSA-N 1 1 419.573 3.118 20 0 HGADMO COC(=O)c1cnc(N2CCC3(CC([N@@H+](C)Cc4ccncc4)C3)CC2)cc1OC ZINC001164793825 721491212 /nfs/dbraw/zinc/49/12/12/721491212.db2.gz XQIFRGRZHMKISV-UHFFFAOYSA-N 1 1 410.518 3.153 20 0 HGADMO CN(C)c1cc(Cl)nc(N2CCC3(CC([N@@H+](C)Cc4ccncc4)C3)CC2)n1 ZINC001164793033 721496183 /nfs/dbraw/zinc/49/61/83/721496183.db2.gz ZZRFFCBOMNFTJP-UHFFFAOYSA-N 1 1 400.958 3.472 20 0 HGADMO CC(C)c1nc(N(C)C)nc(N2CCC3(CC([N@@H+](C)Cc4ccncc4)C3)CC2)n1 ZINC001164792857 721497203 /nfs/dbraw/zinc/49/72/03/721497203.db2.gz UBPOYRUMKUDIGV-UHFFFAOYSA-N 1 1 409.582 3.337 20 0 HGADMO CCCNC(=O)c1cccnc1N1CCC2(CC([N@@H+](C)Cc3ccncc3)C2)CC1 ZINC001164795934 721500005 /nfs/dbraw/zinc/50/00/05/721500005.db2.gz NOSIILSQECOKJY-UHFFFAOYSA-N 1 1 407.562 3.497 20 0 HGADMO C[N@@H+](Cc1ccncc1)C1CC2(C1)CCN(c1cc(N3CCSCC3)ncn1)CC2 ZINC001164796809 721502334 /nfs/dbraw/zinc/50/23/34/721502334.db2.gz YWBLDWNYVMTOEJ-UHFFFAOYSA-N 1 1 424.618 3.306 20 0 HGADMO CCOC(=O)c1cc(Cl)nc(N2CC[N@H+]3C[C@H](Oc4cccc(F)c4)C[C@@H]3C2)c1 ZINC001164901056 721508578 /nfs/dbraw/zinc/50/85/78/721508578.db2.gz WFPFUHCKFXFWDS-SJLPKXTDSA-N 1 1 419.884 3.393 20 0 HGADMO CCOC(=O)/C=C\c1cccnc1N1CC[N@H+]2C[C@H](Oc3cccc(F)c3)C[C@H]2C1 ZINC001164902236 721513155 /nfs/dbraw/zinc/51/31/55/721513155.db2.gz ZZNUCMNUTZVNKX-VXAHRBNNSA-N 1 1 411.477 3.139 20 0 HGADMO COC(=O)c1cc(Cl)cnc1N1CC[N@H+]2C[C@H](Oc3cccc(F)c3)C[C@@H]2C1 ZINC001164897062 721513681 /nfs/dbraw/zinc/51/36/81/721513681.db2.gz DMORBQPMIUKFQP-NVXWUHKLSA-N 1 1 405.857 3.003 20 0 HGADMO COC(=O)c1cc(Cl)nc(N2CC[N@H+]3C[C@H](Oc4cccc(F)c4)C[C@@H]3C2)c1 ZINC001164900661 721514708 /nfs/dbraw/zinc/51/47/08/721514708.db2.gz SORNLRDCRBXZTC-NVXWUHKLSA-N 1 1 405.857 3.003 20 0 HGADMO Fc1cccc(O[C@H]2C[C@H]3CN(c4nc(Cl)nc5c4CCCC5)CC[N@H+]3C2)c1 ZINC001164901346 721520761 /nfs/dbraw/zinc/52/07/61/721520761.db2.gz WPOSTCZNXGKJGG-RDJZCZTQSA-N 1 1 402.901 3.490 20 0 HGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2nc(Cl)nc3[nH]cc(F)c32)[C@@H]2CCCO[C@H]21 ZINC001164795893 721525640 /nfs/dbraw/zinc/52/56/40/721525640.db2.gz UOIFHFUYBMSJJN-BFYDXBDKSA-N 1 1 416.888 3.014 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2nc(Cl)nc3[nH]cc(F)c32)[C@@H]2CCCO[C@H]21 ZINC001164795893 721525644 /nfs/dbraw/zinc/52/56/44/721525644.db2.gz UOIFHFUYBMSJJN-BFYDXBDKSA-N 1 1 416.888 3.014 20 0 HGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2nc(Cl)nc3[nH]cc(F)c32)[C@@H]2CCCO[C@H]12 ZINC001164795895 721525996 /nfs/dbraw/zinc/52/59/96/721525996.db2.gz UOIFHFUYBMSJJN-INMHGKMJSA-N 1 1 416.888 3.014 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2nc(Cl)nc3[nH]cc(F)c32)[C@@H]2CCCO[C@H]12 ZINC001164795895 721525998 /nfs/dbraw/zinc/52/59/98/721525998.db2.gz UOIFHFUYBMSJJN-INMHGKMJSA-N 1 1 416.888 3.014 20 0 HGADMO Fc1cccc(O[C@H]2C[C@H]3CN(c4nnc(Cl)c5c4CCCC5)CC[N@H+]3C2)c1 ZINC001164903489 721530429 /nfs/dbraw/zinc/53/04/29/721530429.db2.gz CZPYLHOLKLCNHH-RDJZCZTQSA-N 1 1 402.901 3.490 20 0 HGADMO CC(C)(C)NC(=O)c1ccc(N2CC[N@H+]3C[C@@H](Oc4cccc(F)c4)C[C@H]3C2)nc1 ZINC001164904721 721534667 /nfs/dbraw/zinc/53/46/67/721534667.db2.gz GBYGUXCSQMWERI-ICSRJNTNSA-N 1 1 412.509 3.091 20 0 HGADMO CCOC(=O)c1c(C)cc(N2CC[N@H+]3C[C@@H](Oc4cccc(F)c4)C[C@H]3C2)nc1C ZINC001164909743 721540560 /nfs/dbraw/zinc/54/05/60/721540560.db2.gz RSSLAYONYNGFFI-ICSRJNTNSA-N 1 1 413.493 3.356 20 0 HGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(C(F)(F)Oc2ccc(Cl)nc2)[C@H]2CCCO[C@@H]12 ZINC001164809542 721543071 /nfs/dbraw/zinc/54/30/71/721543071.db2.gz VIXWAWYCARLLMV-YQVWRLOYSA-N 1 1 424.879 3.423 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(C(F)(F)Oc2ccc(Cl)nc2)[C@H]2CCCO[C@@H]12 ZINC001164809542 721543073 /nfs/dbraw/zinc/54/30/73/721543073.db2.gz VIXWAWYCARLLMV-YQVWRLOYSA-N 1 1 424.879 3.423 20 0 HGADMO Fc1cccc(O[C@H]2C[C@H]3CN(c4nccc(-c5cccnc5F)n4)CC[N@H+]3C2)c1 ZINC001164911166 721545459 /nfs/dbraw/zinc/54/54/59/721545459.db2.gz VOIZYFCDMLNORM-WMZOPIPTSA-N 1 1 409.440 3.159 20 0 HGADMO Cc1cc(C(F)(F)N2CC[N@H+]3C[C@H](Oc4cccc(F)c4)C[C@@H]3C2)c(Cl)nn1 ZINC001164911394 721555007 /nfs/dbraw/zinc/55/50/07/721555007.db2.gz ZBTCGYFJZZCFHE-GDBMZVCRSA-N 1 1 412.843 3.464 20 0 HGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2nc(Cl)nc3ncsc32)[C@H]2CCCO[C@H]12 ZINC001164805424 721555689 /nfs/dbraw/zinc/55/56/89/721555689.db2.gz NTTNLCDDLDAXCX-ZNMIVQPWSA-N 1 1 416.938 3.003 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2nc(Cl)nc3ncsc32)[C@H]2CCCO[C@H]12 ZINC001164805424 721555694 /nfs/dbraw/zinc/55/56/94/721555694.db2.gz NTTNLCDDLDAXCX-ZNMIVQPWSA-N 1 1 416.938 3.003 20 0 HGADMO Cc1nc(-c2ccncc2)cc(N2CC[N@H+]3C[C@H](Oc4cccc(F)c4)C[C@@H]3C2)n1 ZINC001164909713 721558724 /nfs/dbraw/zinc/55/87/24/721558724.db2.gz UPMBTXSAPYDAQD-TZIWHRDSSA-N 1 1 405.477 3.328 20 0 HGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2ncnc3[nH]c4ccccc4c32)[C@H]2CCCO[C@H]12 ZINC001164800396 721560148 /nfs/dbraw/zinc/56/01/48/721560148.db2.gz FJYLHKCUUCKVCY-VWPQPMDRSA-N 1 1 414.513 3.374 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2ncnc3[nH]c4ccccc4c32)[C@H]2CCCO[C@H]12 ZINC001164800396 721560151 /nfs/dbraw/zinc/56/01/51/721560151.db2.gz FJYLHKCUUCKVCY-VWPQPMDRSA-N 1 1 414.513 3.374 20 0 HGADMO CCOC(=O)c1c(C)cc(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@H]32)nc1C ZINC001164805408 721562636 /nfs/dbraw/zinc/56/26/36/721562636.db2.gz NRVPBORBNQNGEZ-ZRCGQRJVSA-N 1 1 424.545 3.138 20 0 HGADMO COc1cc2c(cc1F)ncnc2N1C[C@H]([N@@H+](C)Cc2cccnc2)[C@H]2OCCC[C@@H]21 ZINC001164809862 721566649 /nfs/dbraw/zinc/56/66/49/721566649.db2.gz XPHDLIIFFGOUHV-ONTIZHBOSA-N 1 1 423.492 3.041 20 0 HGADMO CCCN(CCC)c1cc(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@H]3OCCC[C@@H]32)ncn1 ZINC001164802916 721567561 /nfs/dbraw/zinc/56/75/61/721567561.db2.gz ISLDEUIWUIXTSY-HFMPRLQTSA-N 1 1 424.593 3.366 20 0 HGADMO Cc1cc(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@H]3OCCC[C@H]32)nc(-c2ccncc2)n1 ZINC001164806229 721575513 /nfs/dbraw/zinc/57/55/13/721575513.db2.gz PJLNNGMAOSBEMX-GIWBLDEGSA-N 1 1 416.529 3.110 20 0 HGADMO CC[N@H+]1CCCC[C@H]1c1ccc(N2CCO[C@]3(CCCN(c4cnccn4)C3)C2)nc1 ZINC001164903410 721580854 /nfs/dbraw/zinc/58/08/54/721580854.db2.gz NENITASZZFGSGW-URXFXBBRSA-N 1 1 422.577 3.294 20 0 HGADMO COc1nc(Cl)cc(N2CCC(F)(F)[C@]3(CC[N@@H+](Cc4ccccn4)C3)C2)n1 ZINC001164907915 721584763 /nfs/dbraw/zinc/58/47/63/721584763.db2.gz WJUASIKSIKYLEO-SFHVURJKSA-N 1 1 409.868 3.271 20 0 HGADMO COc1cnc(SC)nc1N1CCC(F)(F)[C@]2(CC[N@@H+](Cc3ccccn3)C2)C1 ZINC001164908494 721585518 /nfs/dbraw/zinc/58/55/18/721585518.db2.gz ZNCNPGXNMGCCOL-IBGZPJMESA-N 1 1 421.517 3.340 20 0 HGADMO COC(=O)c1ccc(C)nc1N1CCC(F)(F)[C@@]2(CC[N@@H+](Cc3ccccn3)C2)C1 ZINC001164908415 721586891 /nfs/dbraw/zinc/58/68/91/721586891.db2.gz ZAGGPWDJXIPNRN-OAQYLSRUSA-N 1 1 416.472 3.309 20 0 HGADMO FC1(F)CCN(c2nc(Cl)nc3c2COC3)C[C@]12CC[N@@H+](Cc1ccccn1)C2 ZINC001164905547 721695140 /nfs/dbraw/zinc/69/51/40/721695140.db2.gz JUTMXFGTYCCQAA-LJQANCHMSA-N 1 1 421.879 3.293 20 0 HGADMO FC(F)Oc1cnc(N2CCC(F)(F)[C@]3(CC[N@@H+](Cc4ccccn4)C3)C2)nc1 ZINC001164907634 721712908 /nfs/dbraw/zinc/71/29/08/721712908.db2.gz SCFYORZCSYSDBJ-SFHVURJKSA-N 1 1 411.403 3.211 20 0 HGADMO CC(=O)Nc1c(C)ccnc1N1CCC(F)(F)[C@@]2(CC[N@@H+](Cc3ccccn3)C2)C1 ZINC001164904848 721720637 /nfs/dbraw/zinc/72/06/37/721720637.db2.gz DKHQLVHFUJFYFF-OAQYLSRUSA-N 1 1 415.488 3.481 20 0 HGADMO C[N@H+](Cc1ccco1)Cc1cncc2c1CCN(c1nc(Cl)nc3c1COC3)C2 ZINC001164910050 721750128 /nfs/dbraw/zinc/75/01/28/721750128.db2.gz ZMSLMAXFYLDPMT-UHFFFAOYSA-N 1 1 411.893 3.343 20 0 HGADMO C[N@@H+](Cc1ccco1)Cc1cncc2c1CCN(c1nc(Cl)nc3c1COC3)C2 ZINC001164910050 721750135 /nfs/dbraw/zinc/75/01/35/721750135.db2.gz ZMSLMAXFYLDPMT-UHFFFAOYSA-N 1 1 411.893 3.343 20 0 HGADMO CCOC(=O)c1cnc(N2CCc3c(C[N@H+](C)Cc4ccco4)cncc3C2)nc1C ZINC001164910763 721753511 /nfs/dbraw/zinc/75/35/11/721753511.db2.gz REDRSSGIHMWEMQ-UHFFFAOYSA-N 1 1 421.501 3.144 20 0 HGADMO CCOC(=O)c1cnc(N2CCc3c(C[N@@H+](C)Cc4ccco4)cncc3C2)nc1C ZINC001164910763 721753515 /nfs/dbraw/zinc/75/35/15/721753515.db2.gz REDRSSGIHMWEMQ-UHFFFAOYSA-N 1 1 421.501 3.144 20 0 HGADMO CCNC(=O)c1cccnc1N1CCc2c(C[N@H+](C)Cc3ccco3)cncc2C1 ZINC001164910734 721757376 /nfs/dbraw/zinc/75/73/76/721757376.db2.gz QWZHQBYYNURZKK-UHFFFAOYSA-N 1 1 405.502 3.014 20 0 HGADMO CCNC(=O)c1cccnc1N1CCc2c(C[N@@H+](C)Cc3ccco3)cncc2C1 ZINC001164910734 721757378 /nfs/dbraw/zinc/75/73/78/721757378.db2.gz QWZHQBYYNURZKK-UHFFFAOYSA-N 1 1 405.502 3.014 20 0 HGADMO C[N@H+](Cc1ccco1)Cc1cncc2c1CCN(c1cncc(N3CCCC3)n1)C2 ZINC001164909547 721757948 /nfs/dbraw/zinc/75/79/48/721757948.db2.gz HOVVFBYCVAXTQT-UHFFFAOYSA-N 1 1 404.518 3.260 20 0 HGADMO C[N@@H+](Cc1ccco1)Cc1cncc2c1CCN(c1cncc(N3CCCC3)n1)C2 ZINC001164909547 721757952 /nfs/dbraw/zinc/75/79/52/721757952.db2.gz HOVVFBYCVAXTQT-UHFFFAOYSA-N 1 1 404.518 3.260 20 0 HGADMO COc1cnc2c(c1)ncnc2N1CCc2c(C[N@H+](C)Cc3ccco3)cncc2C1 ZINC001164910139 721758844 /nfs/dbraw/zinc/75/88/44/721758844.db2.gz OJHINNXRSHVRFR-UHFFFAOYSA-N 1 1 416.485 3.216 20 0 HGADMO COc1cnc2c(c1)ncnc2N1CCc2c(C[N@@H+](C)Cc3ccco3)cncc2C1 ZINC001164910139 721758846 /nfs/dbraw/zinc/75/88/46/721758846.db2.gz OJHINNXRSHVRFR-UHFFFAOYSA-N 1 1 416.485 3.216 20 0 HGADMO CCCNC(=O)c1cccnc1N1CCc2c(C[N@H+](C)Cc3ccco3)cncc2C1 ZINC001164910745 721760579 /nfs/dbraw/zinc/76/05/79/721760579.db2.gz KPONSJOICFTUEZ-UHFFFAOYSA-N 1 1 419.529 3.404 20 0 HGADMO CCCNC(=O)c1cccnc1N1CCc2c(C[N@@H+](C)Cc3ccco3)cncc2C1 ZINC001164910745 721760582 /nfs/dbraw/zinc/76/05/82/721760582.db2.gz KPONSJOICFTUEZ-UHFFFAOYSA-N 1 1 419.529 3.404 20 0 HGADMO c1ccc(C[N@H+]2CCc3nc(N4C[C@H](OCC5CC5)[C@@H]5COC[C@@H]54)ccc3C2)cc1 ZINC001165016477 721761482 /nfs/dbraw/zinc/76/14/82/721761482.db2.gz WVPQAZWBLZHWRH-NHTMILBNSA-N 1 1 405.542 3.270 20 0 HGADMO c1ccc(C[N@H+]2CCc3nc(N4C[C@H](OCC5CC5)[C@H]5COC[C@H]54)ccc3C2)cc1 ZINC001165016479 721761671 /nfs/dbraw/zinc/76/16/71/721761671.db2.gz WVPQAZWBLZHWRH-QTJGBDASSA-N 1 1 405.542 3.270 20 0 HGADMO COC(=O)c1cnc(Cl)nc1N1C[C@@H]2CCC[C@@H]([N@@H+](C)Cc3ccccn3)[C@@H]2C1 ZINC001165021348 721801212 /nfs/dbraw/zinc/80/12/12/721801212.db2.gz GKZKFUJGXLZJGX-BMGDILEWSA-N 1 1 415.925 3.049 20 0 HGADMO Cn1c(=O)ccc2ccc(N3C[C@H]4[C@@H](C3)CCC[C@H]4[N@@H+](C)Cc3ccccn3)nc21 ZINC001165021620 721813115 /nfs/dbraw/zinc/81/31/15/721813115.db2.gz FHKIIPGWRASELY-HLAWJBBLSA-N 1 1 403.530 3.065 20 0 HGADMO CN(C)c1cc(Cl)nc(N2C[C@@H]3CCC[C@H]([N@@H+](C)Cc4ccccn4)[C@H]3C2)n1 ZINC001165026863 721814411 /nfs/dbraw/zinc/81/44/11/721814411.db2.gz RUMHQRYCZMWCHB-SZMVWBNQSA-N 1 1 400.958 3.328 20 0 HGADMO CCOc1ccc(C(=O)OC)c(N2C[C@@H]3CCC[C@@H]([N@@H+](C)Cc4ccccn4)[C@H]3C2)n1 ZINC001165026420 721815690 /nfs/dbraw/zinc/81/56/90/721815690.db2.gz PZSITEOITBUDHG-DZFGPLHGSA-N 1 1 424.545 3.399 20 0 HGADMO CCCNC(=O)c1ccc(N2C[C@@H]3CCC[C@H]([N@@H+](C)Cc4ccccn4)[C@H]3C2)nc1 ZINC001165030509 721824583 /nfs/dbraw/zinc/82/45/83/721824583.db2.gz ZNMKCWXXAHNPJH-BVSLBCMMSA-N 1 1 407.562 3.353 20 0 HGADMO COC(=O)c1nc(Cl)cc(N2C[C@@H]3CCC[C@@H]([N@@H+](C)Cc4ccccn4)[C@H]3C2)n1 ZINC001165030220 721827589 /nfs/dbraw/zinc/82/75/89/721827589.db2.gz ZBGWZNQREUUBBB-BHYGNILZSA-N 1 1 415.925 3.049 20 0 HGADMO CCS(=O)(=O)c1ccnc(N2C[C@@H]3CCC[C@H]([N@@H+](C)Cc4ccccn4)[C@@H]3C2)c1 ZINC001165026103 721832106 /nfs/dbraw/zinc/83/21/06/721832106.db2.gz OEQHBUSWZLXTJG-WMQCIHAUSA-N 1 1 414.575 3.007 20 0 HGADMO CN(C)CC[N@H+]1CC[C@H]2[C@@H]1CCN2c1ncnc2cc(OCc3ccccc3)ccc21 ZINC001164934400 721887986 /nfs/dbraw/zinc/88/79/86/721887986.db2.gz RILKHGWLICZWEB-ZEQRLZLVSA-N 1 1 417.557 3.423 20 0 HGADMO C[NH+](C)CCN1CC[C@H]2[C@@H]1CCN2c1ncnc2cc(OCc3ccccc3)ccc21 ZINC001164934400 721887987 /nfs/dbraw/zinc/88/79/87/721887987.db2.gz RILKHGWLICZWEB-ZEQRLZLVSA-N 1 1 417.557 3.423 20 0 HGADMO Cc1cccc(Oc2nc(Cl)ncc2N2CC[C@H]3[C@H]2CC[N@H+]3CCN(C)C)c1 ZINC001164929618 721888276 /nfs/dbraw/zinc/88/82/76/721888276.db2.gz BXCVIGRQAAGXFF-ZWKOTPCHSA-N 1 1 401.942 3.445 20 0 HGADMO Cc1cccc(Oc2nc(Cl)ncc2N2CC[C@H]3[C@H]2CC[N@@H+]3CCN(C)C)c1 ZINC001164929618 721888277 /nfs/dbraw/zinc/88/82/77/721888277.db2.gz BXCVIGRQAAGXFF-ZWKOTPCHSA-N 1 1 401.942 3.445 20 0 HGADMO COc1cccc(Oc2nc(Cl)ncc2N2CC[C@H]3[C@H]2CC[N@@H+]3CCN(C)C)c1 ZINC001164932573 721888826 /nfs/dbraw/zinc/88/88/26/721888826.db2.gz JEXDYKRJIVQUIY-ZWKOTPCHSA-N 1 1 417.941 3.146 20 0 HGADMO COc1cccc(Oc2nc(Cl)ncc2N2CC[C@H]3[C@H]2CC[N@H+]3CCN(C)C)c1 ZINC001164932573 721888827 /nfs/dbraw/zinc/88/88/27/721888827.db2.gz JEXDYKRJIVQUIY-ZWKOTPCHSA-N 1 1 417.941 3.146 20 0 HGADMO COc1nc(Cl)cc(N2CCC3(CC2)C[N@@H+](Cc2ccc(C)cc2)CCO3)n1 ZINC001164940085 721921225 /nfs/dbraw/zinc/92/12/25/721921225.db2.gz YVDNSZAPSLAVNY-UHFFFAOYSA-N 1 1 402.926 3.318 20 0 HGADMO COc1cccc(Oc2nc(Cl)ncc2N2CC[NH+](C[C@H]3CCCO3)CC2)c1 ZINC001165042428 721925104 /nfs/dbraw/zinc/92/51/04/721925104.db2.gz DTBWQVYNWBATCM-QGZVFWFLSA-N 1 1 404.898 3.232 20 0 HGADMO Cc1ccc(C[N@H+]2CCOC3(CCN(c4c(Cl)nccc4C(N)=O)CC3)C2)cc1 ZINC001164942279 721933376 /nfs/dbraw/zinc/93/33/76/721933376.db2.gz LCKYGNYPXMGNAT-UHFFFAOYSA-N 1 1 414.937 3.014 20 0 HGADMO Cc1ccc(C[N@H+]2CCOC3(CCN([C@H](F)Oc4ccc(Cl)nn4)CC3)C2)cc1 ZINC001164944702 721933636 /nfs/dbraw/zinc/93/36/36/721933636.db2.gz UCAXRVYLYSZRDT-FQEVSTJZSA-N 1 1 420.916 3.437 20 0 HGADMO C[C@@H]1CCCN(C(=O)c2ccc(N3CC[NH+](CCOc4ccccc4)CC3)nc2)C1 ZINC001165045446 721959566 /nfs/dbraw/zinc/95/95/66/721959566.db2.gz UKVXSYPUUAMTQB-HXUWFJFHSA-N 1 1 408.546 3.155 20 0 HGADMO CCN(CCC(N)=O)c1nc(C[NH+]2CCC(C)CC2)nc2sc3c(c21)CCC3 ZINC001165048431 721984131 /nfs/dbraw/zinc/98/41/31/721984131.db2.gz XPAFEKIOTQTRJP-UHFFFAOYSA-N 1 1 401.580 3.114 20 0 HGADMO CC1CC[NH+](Cc2nc3sc4c(c3c(N3CCNC(=O)C3(C)C)n2)CCC4)CC1 ZINC001165050876 721994933 /nfs/dbraw/zinc/99/49/33/721994933.db2.gz CBBZIZXHACYYEL-UHFFFAOYSA-N 1 1 413.591 3.127 20 0 HGADMO CC[NH+](CC)C1CCN(c2ncccc2S(=O)(=O)Nc2cccc(F)c2)CC1 ZINC001165054699 722006810 /nfs/dbraw/zinc/00/68/10/722006810.db2.gz YQBKAAJNFZCLON-UHFFFAOYSA-N 1 1 406.527 3.332 20 0 HGADMO CCOC(=O)c1cnc(C2CC2)nc1N1CCC2(CC[N@@H+](Cc3cccnc3)C2)CC1 ZINC001164951815 722017871 /nfs/dbraw/zinc/01/78/71/722017871.db2.gz FIMYCWLMWJCXJR-UHFFFAOYSA-N 1 1 421.545 3.418 20 0 HGADMO CCOC(=O)c1cnc(CC)nc1N1CCC2(CC[N@@H+](Cc3cccnc3)C2)CC1 ZINC001164962643 722023854 /nfs/dbraw/zinc/02/38/54/722023854.db2.gz QKOSVJFHRFWEBV-UHFFFAOYSA-N 1 1 409.534 3.103 20 0 HGADMO Clc1nc2cnccc2c(N2CCC3(CC2)COCC[N@@H+](Cc2ccncc2)C3)n1 ZINC001164964104 722054905 /nfs/dbraw/zinc/05/49/05/722054905.db2.gz RIILKFYVRDCJAA-UHFFFAOYSA-N 1 1 424.936 3.192 20 0 HGADMO COc1cc(Cl)ncc1N1CCC2(CC1)COCC[N@@H+](Cc1ccncc1)C2 ZINC001164962341 722054930 /nfs/dbraw/zinc/05/49/30/722054930.db2.gz DDPNZUPSFYNUAK-UHFFFAOYSA-N 1 1 402.926 3.258 20 0 HGADMO FC(F)(c1cnnc(Cl)c1)N1CCC2(CC1)COCC[N@@H+](Cc1ccncc1)C2 ZINC001164964520 722056260 /nfs/dbraw/zinc/05/62/60/722056260.db2.gz VIYQZCUYPDMYCU-UHFFFAOYSA-N 1 1 423.895 3.189 20 0 HGADMO CCc1c(Cl)ncnc1N1CCC2(CC1)COCC[N@@H+](Cc1ccncc1)C2 ZINC001164961661 722060488 /nfs/dbraw/zinc/06/04/88/722060488.db2.gz NSCFMDGLGXVJQK-UHFFFAOYSA-N 1 1 401.942 3.206 20 0 HGADMO C[C@H]1CCc2nnc(N3CCC4(CC3)COCC[N@@H+](Cc3ccncc3)C4)cc2C1 ZINC001164963413 722061202 /nfs/dbraw/zinc/06/12/02/722061202.db2.gz YXRNNFUXPHZSIG-IBGZPJMESA-N 1 1 407.562 3.115 20 0 HGADMO Cc1cc2cccnc2c(N2CCC3(CC2)COCC[N@@H+](Cc2ccncc2)C3)n1 ZINC001164961688 722061472 /nfs/dbraw/zinc/06/14/72/722061472.db2.gz OFUNVGOHHNRKRC-UHFFFAOYSA-N 1 1 403.530 3.452 20 0 HGADMO c1csc(-c2noc(-c3ccnc(N4C[C@@H]5C[N@@H+](CC6CC6)C[C@H](C4)O5)c3)n2)c1 ZINC001164968111 722076498 /nfs/dbraw/zinc/07/64/98/722076498.db2.gz QYDYUDXYRQQMAX-CALCHBBNSA-N 1 1 409.515 3.160 20 0 HGADMO COc1ccccc1Oc1nc(Cl)ncc1N1C[C@@H]2C[N@H+](CC3CC3)C[C@H](C1)O2 ZINC001164968256 722077806 /nfs/dbraw/zinc/07/78/06/722077806.db2.gz XXBUCZDORKRXNN-IYBDPMFKSA-N 1 1 416.909 3.230 20 0 HGADMO c1ccc(Oc2cc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)ncn2)cc1 ZINC001164979344 722105702 /nfs/dbraw/zinc/10/57/02/722105702.db2.gz ICNDKDLLEBSEER-IFMALSPDSA-N 1 1 417.513 3.391 20 0 HGADMO c1ccc(Oc2cc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)ncn2)cc1 ZINC001164979348 722105854 /nfs/dbraw/zinc/10/58/54/722105854.db2.gz ICNDKDLLEBSEER-IRLDBZIGSA-N 1 1 417.513 3.391 20 0 HGADMO Clc1nnc(N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)c2sccc21 ZINC001164979318 722106998 /nfs/dbraw/zinc/10/69/98/722106998.db2.gz IAEUIFVZASTYSY-WBVHZDCISA-N 1 1 415.950 3.467 20 0 HGADMO Clc1nc2ccccc2nc1N1CC[C@H]2C[N@@H+](Cc3cccnc3)CCO[C@@H]2C1 ZINC001164972567 722110471 /nfs/dbraw/zinc/11/04/71/722110471.db2.gz GBGDLZYDYDLCRI-FXAWDEMLSA-N 1 1 409.921 3.406 20 0 HGADMO Clc1nc2ccccc2nc1N1CC[C@H]2C[N@@H+](Cc3cccnc3)CCO[C@H]2C1 ZINC001164972571 722110826 /nfs/dbraw/zinc/11/08/26/722110826.db2.gz GBGDLZYDYDLCRI-PXNSSMCTSA-N 1 1 409.921 3.406 20 0 HGADMO Fc1ccc(-c2ccnc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)n2)cc1 ZINC001164971886 722113844 /nfs/dbraw/zinc/11/38/44/722113844.db2.gz DAWSLIUCNQDMNH-NFBKMPQASA-N 1 1 419.504 3.405 20 0 HGADMO Clc1cccc2nc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)ncc12 ZINC001164975109 722123252 /nfs/dbraw/zinc/12/32/52/722123252.db2.gz JLCPAMYMXYSYAU-UTKZUKDTSA-N 1 1 409.921 3.406 20 0 HGADMO CC(C)(C)c1nc2[nH]ccc2c(N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)n1 ZINC001164975199 722135932 /nfs/dbraw/zinc/13/59/32/722135932.db2.gz FQVPZPGWTKNJKV-ICSRJNTNSA-N 1 1 420.561 3.378 20 0 HGADMO c1cncc(C[N@H+]2CCO[C@H]3CN(c4ccc(-c5ccncc5)cn4)CC[C@H]3C2)c1 ZINC001164985472 722138344 /nfs/dbraw/zinc/13/83/44/722138344.db2.gz ZPGZUAMJQJUGRO-GOTSBHOMSA-N 1 1 401.514 3.266 20 0 HGADMO Cc1nc(C2CC2)nc(Cl)c1N1CC[C@@H]2C[N@@H+](Cc3cccnc3)CCO[C@H]2C1 ZINC001164973129 722144469 /nfs/dbraw/zinc/14/44/69/722144469.db2.gz BAPRDOZEDRUVFW-MOPGFXCFSA-N 1 1 413.953 3.438 20 0 HGADMO Fc1ccc(-c2ccc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)nn2)cc1 ZINC001164976121 722145835 /nfs/dbraw/zinc/14/58/35/722145835.db2.gz HGYTXDWOHLMPFG-NZQKXSOJSA-N 1 1 419.504 3.405 20 0 HGADMO COc1ccc2nc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)c(C)nc2c1 ZINC001164976072 722146244 /nfs/dbraw/zinc/14/62/44/722146244.db2.gz GYARHEFXVSRBGM-XXBNENTESA-N 1 1 419.529 3.069 20 0 HGADMO COc1c(C)cnc(C[NH+]2CCC(OC)(c3nc(C4CCOCC4)no3)CC2)c1C ZINC000513833653 559217476 /nfs/dbraw/zinc/21/74/76/559217476.db2.gz GXKPFXQLVIAVRM-UHFFFAOYSA-N 1 1 416.522 3.122 20 0 HGADMO COc1c(C)c[nH+]c(CN2CCC(OC)(c3nc(C4CCOCC4)no3)CC2)c1C ZINC000513833653 559217478 /nfs/dbraw/zinc/21/74/78/559217478.db2.gz GXKPFXQLVIAVRM-UHFFFAOYSA-N 1 1 416.522 3.122 20 0 HGADMO Cc1cc(C)c2c(n1)sc(C(=O)NCCC[NH+]1CCN(C)CC1)c2-n1cccc1 ZINC000020465939 568610373 /nfs/dbraw/zinc/61/03/73/568610373.db2.gz FGRNMYXLHLYMHL-UHFFFAOYSA-N 1 1 411.575 3.071 20 0 HGADMO COC1(c2nc(CC(F)(F)F)no2)CC[NH+](Cc2cnc3ccc(C)cn23)CC1 ZINC000571706232 568657573 /nfs/dbraw/zinc/65/75/73/568657573.db2.gz XMAROAQSDWCMDZ-UHFFFAOYSA-N 1 1 409.412 3.268 20 0 HGADMO CCOC(=O)c1nnc(Cl)cc1N1CCC[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21 ZINC001164625810 719073732 /nfs/dbraw/zinc/07/37/32/719073732.db2.gz NHLSFVOGJMWHTC-WMZOPIPTSA-N 1 1 400.910 3.408 20 0 HGADMO CON(C)C(=O)c1cc(Cl)nc(N2CCC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)c1 ZINC001164620427 719080633 /nfs/dbraw/zinc/08/06/33/719080633.db2.gz DXPATNRNIPTXCG-MJGOQNOKSA-N 1 1 414.937 3.469 20 0 HGADMO O=c1ccccn1Cc1ccc(N2CCC[C@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)nc1 ZINC001164632562 719101284 /nfs/dbraw/zinc/10/12/84/719101284.db2.gz ZRSWAQPOPNBMRV-GOTSBHOMSA-N 1 1 400.526 3.392 20 0 HGADMO COC(=O)c1ccc2cc(N3CCc4c(C[NH+](C)C)nn(C(C)C)c4C3)ncc2c1 ZINC001164652876 719314438 /nfs/dbraw/zinc/31/44/38/719314438.db2.gz SGUKVEWXCJDANG-UHFFFAOYSA-N 1 1 407.518 3.423 20 0 HGADMO COC(=O)c1cc2ccccc2c(N2CCc3c(C[NH+](C)C)nn(C(C)C)c3C2)n1 ZINC001164653579 719315544 /nfs/dbraw/zinc/31/55/44/719315544.db2.gz WSRQAWULGNGDDZ-UHFFFAOYSA-N 1 1 407.518 3.423 20 0 HGADMO COC(=O)[C@]1(C)C[C@H]([NH+]2CCOCC2)CCN1c1nc(Cl)cc2cc(F)ccc21 ZINC001164705777 719837725 /nfs/dbraw/zinc/83/77/25/719837725.db2.gz VOKYWGZPQHIUHD-IERDGZPVSA-N 1 1 421.900 3.260 20 0 HGADMO COC(=O)[C@@]1(C)C[C@H]([NH+]2CCOCC2)CCN1c1nccc2ccc(Cl)cc21 ZINC001164705844 719849467 /nfs/dbraw/zinc/84/94/67/719849467.db2.gz WDHGSHUOIFSAHC-DYESRHJHSA-N 1 1 403.910 3.121 20 0 HGADMO COC(=O)[C@@]1(C)C[C@@H]([NH+]2CCOCC2)CCN1c1cc(Cl)nc2c(C)csc21 ZINC001164701584 719862446 /nfs/dbraw/zinc/86/24/46/719862446.db2.gz LFUYFFDOVHTCBX-VBKZILBWSA-N 1 1 423.966 3.491 20 0 HGADMO COC(=O)c1cc(F)c(C)nc1N1CCC2(CC1)C[N@@H+](Cc1cccs1)CCO2 ZINC001164697605 719892578 /nfs/dbraw/zinc/89/25/78/719892578.db2.gz LWGSEPYPNOKQND-UHFFFAOYSA-N 1 1 419.522 3.249 20 0 HGADMO CCOC(=O)c1cc(N2CCC3(CC2)C[N@@H+](Cc2cccs2)CCO3)ncc1C ZINC001164696214 719893258 /nfs/dbraw/zinc/89/32/58/719893258.db2.gz CGFDHPADMHAZFO-UHFFFAOYSA-N 1 1 415.559 3.500 20 0 HGADMO CCOC(=O)c1c(C)ccnc1N1CCC2(CC1)C[N@@H+](Cc1cccs1)CCO2 ZINC001164698410 719896207 /nfs/dbraw/zinc/89/62/07/719896207.db2.gz SKHHUMLRPDFXGL-UHFFFAOYSA-N 1 1 415.559 3.500 20 0 HGADMO CCOC(=O)c1cc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COC)ncc1Cl ZINC001164814247 720077341 /nfs/dbraw/zinc/07/73/41/720077341.db2.gz WIUBOTWRSROELX-IIBYNOLFSA-N 1 1 407.942 3.096 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1nc(Cl)nc3c1COC3(C)C)C2 ZINC001164814862 720094849 /nfs/dbraw/zinc/09/48/49/720094849.db2.gz XMSSMMOYBUVHNX-QVKFZJNVSA-N 1 1 406.958 3.080 20 0 HGADMO COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1c(Cl)nncc1OC)CC2 ZINC001164718080 720116118 /nfs/dbraw/zinc/11/61/18/720116118.db2.gz RLELJDPBQCNVDP-QGZVFWFLSA-N 1 1 417.941 3.041 20 0 HGADMO COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1ncnc3[nH]c(C)c(C)c31)CC2 ZINC001164718050 720120386 /nfs/dbraw/zinc/12/03/86/720120386.db2.gz RBGOQGLGDCQQRS-FQEVSTJZSA-N 1 1 420.561 3.477 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(C(F)(F)c1cnc(Cl)cc1N)C2 ZINC001164811562 720121943 /nfs/dbraw/zinc/12/19/43/720121943.db2.gz MLZBNHPZGAMDTQ-KDOFPFPSSA-N 1 1 400.901 3.047 20 0 HGADMO COC[C@H]1C[N@H+](CC2CC2)C[C@@]12CCN(c1nccc3cc(OC)c(OC)cc31)C2 ZINC001164807067 720123610 /nfs/dbraw/zinc/12/36/10/720123610.db2.gz BHCUYVAMZVLHNF-NTKDMRAZSA-N 1 1 411.546 3.437 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1nccc3cc(OC)c(OC)cc31)C2 ZINC001164807067 720123616 /nfs/dbraw/zinc/12/36/16/720123616.db2.gz BHCUYVAMZVLHNF-NTKDMRAZSA-N 1 1 411.546 3.437 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1cc(Cl)nc3ccc(OC)nc31)C2 ZINC001164814967 720123751 /nfs/dbraw/zinc/12/37/51/720123751.db2.gz UTUKHQPWVPPNDL-OPAMFIHVSA-N 1 1 416.953 3.477 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(C(F)(F)COc1cccc(Cl)n1)C2 ZINC001164815860 720137212 /nfs/dbraw/zinc/13/72/12/720137212.db2.gz WLNGXAPZHSPWFK-VQIMIIECSA-N 1 1 415.912 3.387 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1cnc(OCc3ccccc3)cn1)C2 ZINC001164816717 720149280 /nfs/dbraw/zinc/14/92/80/720149280.db2.gz MGJIFPAVCBPGHB-URXFXBBRSA-N 1 1 408.546 3.240 20 0 HGADMO COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1nccnc1OC1CCC1)CC2 ZINC001164711713 720151942 /nfs/dbraw/zinc/15/19/42/720151942.db2.gz IGZUUXKVMOUEDS-HXUWFJFHSA-N 1 1 423.561 3.310 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(C(F)(F)c1cc(Cl)nc(=S)[nH]1)C2 ZINC001164818130 720152017 /nfs/dbraw/zinc/15/20/17/720152017.db2.gz RVGKBGYROHHJPD-CXAGYDPISA-N 1 1 418.941 3.148 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1nc3ccccc3nc1N1CCCC1)C2 ZINC001164817431 720160941 /nfs/dbraw/zinc/16/09/41/720160941.db2.gz PIOMHQPAUZOWKR-NLFFAJNJSA-N 1 1 421.589 3.415 20 0 HGADMO CC(C)[N@@H+](C)Cc1cc(=O)n2c(n1)CN(c1cc(Oc3ccccc3)ncn1)CCC2 ZINC001164812846 720214024 /nfs/dbraw/zinc/21/40/24/720214024.db2.gz MNJGKLVOFAWDKQ-UHFFFAOYSA-N 1 1 420.517 3.076 20 0 HGADMO CCc1c(Cl)nnc(N2CCCn3c(=O)cc(C[N@@H+](C)C(C)C)nc3C2)c1CC ZINC001164814099 720224325 /nfs/dbraw/zinc/22/43/25/720224325.db2.gz TVIVADQXBMCKHA-UHFFFAOYSA-N 1 1 418.973 3.062 20 0 HGADMO COC(=O)c1ccc2c(c1)nc(Cl)nc2N1CC[C@@H]2[C@H]1CC[N@H+]2Cc1cccnc1 ZINC001164727073 720386264 /nfs/dbraw/zinc/38/62/64/720386264.db2.gz QFEAVNREQVDLBY-RTBURBONSA-N 1 1 423.904 3.318 20 0 HGADMO CCOC(=O)c1nc(Cl)nc(Cl)c1N1CC[C@H]2[C@@H]1CC[N@@H+]2Cc1cccnc1 ZINC001164729057 720396627 /nfs/dbraw/zinc/39/66/27/720396627.db2.gz UWPIDCINDBWIQH-KBPBESRZSA-N 1 1 422.316 3.208 20 0 HGADMO CCOC(=O)c1nc(Cl)nc(Cl)c1N1CC[C@H]2[C@@H]1CC[N@H+]2Cc1cccnc1 ZINC001164729057 720396635 /nfs/dbraw/zinc/39/66/35/720396635.db2.gz UWPIDCINDBWIQH-KBPBESRZSA-N 1 1 422.316 3.208 20 0 HGADMO CC(C)(c1ccnc(Cl)c1)[N@@H+]1CC[C@@H]2OCC[C@]2(C(=O)Nc2cccnc2)C1 ZINC001164729888 720504297 /nfs/dbraw/zinc/50/42/97/720504297.db2.gz KGRMCMGTUINVDI-UWJYYQICSA-N 1 1 400.910 3.485 20 0 HGADMO CC(C)(c1ccnc(Cl)c1)[N@H+]1CC[C@@H]2OCC[C@]2(C(=O)Nc2cccnc2)C1 ZINC001164729888 720504302 /nfs/dbraw/zinc/50/43/02/720504302.db2.gz KGRMCMGTUINVDI-UWJYYQICSA-N 1 1 400.910 3.485 20 0 HGADMO CCOC(=O)/C=C\c1cccnc1N1CC[C@@H]2[C@H](C[C@@H](Cn3cccn3)[N@H+]2C(C)C)C1 ZINC001164832351 720512111 /nfs/dbraw/zinc/51/21/11/720512111.db2.gz ACAZYTDGOPHQRA-SFGMSGFVSA-N 1 1 423.561 3.232 20 0 HGADMO CC(C)[N@@H+]1[C@@H]2CCN(c3nc(Cl)nc4c3CCC4)C[C@@H]2C[C@H]1Cn1cccn1 ZINC001164840789 720515685 /nfs/dbraw/zinc/51/56/85/720515685.db2.gz XNIQFOCJFAQDEV-TXPKVOOTSA-N 1 1 400.958 3.193 20 0 HGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@@H]2CN(c3nnc(Cl)c4ccncc43)CC[C@@H]21 ZINC001164841575 720516599 /nfs/dbraw/zinc/51/65/99/720516599.db2.gz YZEMEADUTLKVMX-GJYPPUQNSA-N 1 1 411.941 3.253 20 0 HGADMO COC(=O)c1cc(Cl)cc(N2CC[C@@H]3[C@H](C[C@H](Cn4cccn4)[N@H+]3C(C)C)C2)n1 ZINC001164834018 720519963 /nfs/dbraw/zinc/51/99/63/720519963.db2.gz FDYGIGISHSOWSQ-SZVBFZGTSA-N 1 1 417.941 3.096 20 0 HGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@H]2CN(c3nc4ncccc4nc3Cl)CC[C@@H]21 ZINC001164843067 720542726 /nfs/dbraw/zinc/54/27/26/720542726.db2.gz ZWDCCNHNKQQDFU-BQFCYCMXSA-N 1 1 411.941 3.253 20 0 HGADMO COc1nc(Cl)nc(C)c1N1CC[C@@H]2[C@H](C[C@@H](Cn3cccn3)[N@H+]2C(C)C)C1 ZINC001164841468 720545610 /nfs/dbraw/zinc/54/56/10/720545610.db2.gz WAMKGHAHTPPYQX-IXDOHACOSA-N 1 1 404.946 3.021 20 0 HGADMO CC(C)[N@@H+]1[C@@H]2CCN(c3ccnc(-c4cccnc4)n3)C[C@@H]2C[C@H]1Cn1cccn1 ZINC001164835440 720556990 /nfs/dbraw/zinc/55/69/90/720556990.db2.gz HJHFTHLXUSOCIG-PCCBWWKXSA-N 1 1 403.534 3.113 20 0 HGADMO CC(C)[N@@H+]1[C@@H]2CCN(c3nnc(Cl)c4ccoc43)C[C@H]2C[C@H]1Cn1cccn1 ZINC001164839114 720571438 /nfs/dbraw/zinc/57/14/38/720571438.db2.gz POJYBZMFKMSLNM-HLLBOEOZSA-N 1 1 400.914 3.451 20 0 HGADMO CCOCc1cnc(Cl)nc1N1CC[C@@H]2[C@H](C[C@H](Cn3cccn3)[N@H+]2C(C)C)C1 ZINC001164840282 720587213 /nfs/dbraw/zinc/58/72/13/720587213.db2.gz PWRKLWBFFYKWFY-BHIYHBOVSA-N 1 1 418.973 3.241 20 0 HGADMO CC(C)[N@@H+]1[C@@H]2CCN(C(F)(F)c3nccnc3Cl)C[C@H]2C[C@H]1Cn1cccn1 ZINC001164835290 720589057 /nfs/dbraw/zinc/58/90/57/720589057.db2.gz AYVIBSNYLCAUSY-OWCLPIDISA-N 1 1 410.900 3.249 20 0 HGADMO CSc1cnc(Cl)c(N2CC[C@@H]3[C@H](C[C@H](Cn4cccn4)[N@H+]3C(C)C)C2)n1 ZINC001164842219 720590756 /nfs/dbraw/zinc/59/07/56/720590756.db2.gz UQLISTGOSGLSKW-BZUAXINKSA-N 1 1 406.987 3.426 20 0 HGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@@H]2CN(C(F)(F)c3cnc(Cl)c(N)c3)CC[C@@H]21 ZINC001164837804 720592138 /nfs/dbraw/zinc/59/21/38/720592138.db2.gz JQGJYMVGULTTNH-HFTRVMKXSA-N 1 1 424.927 3.436 20 0 HGADMO CC(C)[N@@H+]1[C@@H]2CCN(C(F)(F)c3cnc(Cl)c(N)c3)C[C@@H]2C[C@H]1Cn1cccn1 ZINC001164837806 720594222 /nfs/dbraw/zinc/59/42/22/720594222.db2.gz JQGJYMVGULTTNH-QILLFSRXSA-N 1 1 424.927 3.436 20 0 HGADMO C=Cc1nc(Cl)nc(N2CC[C@@H]3[C@H](C[C@@H](Cn4cccn4)[N@H+]3C(C)C)C2)c1OC ZINC001164841189 720595728 /nfs/dbraw/zinc/59/57/28/720595728.db2.gz RRFXBGUNBFFPPG-SOLBZPMBSA-N 1 1 416.957 3.356 20 0 HGADMO COc1nnc(N2CC[C@@H]3[C@@H](C[C@@H](Cn4cccn4)[N@H+]3C(C)C)C2)c2ccccc21 ZINC001164839222 720601266 /nfs/dbraw/zinc/60/12/66/720601266.db2.gz MLGZURKGPKKVQF-BBTUJRGHSA-N 1 1 406.534 3.213 20 0 HGADMO CC(C)[N@H+]1[C@@H](Cn2cccn2)C[C@H]2CN(c3ccc(N4CCC(C)CC4)nn3)CC[C@H]21 ZINC001164840078 720608189 /nfs/dbraw/zinc/60/81/89/720608189.db2.gz OWSHSJWKXXCATJ-BHDDXSALSA-N 1 1 423.609 3.287 20 0 HGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@H]2CN(c3ncnc(-c4cccc(F)c4)n3)CC[C@@H]21 ZINC001164841356 720615600 /nfs/dbraw/zinc/61/56/00/720615600.db2.gz RZFXVDWHUVEQBY-JBACZVJFSA-N 1 1 421.524 3.252 20 0 HGADMO c1ccc(-c2nc3ccccc3c(N3CC[N@@H+]4C[C@@H](Oc5cncnc5)C[C@H]4C3)n2)cc1 ZINC001164737562 720677263 /nfs/dbraw/zinc/67/72/63/720677263.db2.gz GECIPGOTGKGKCR-PMACEKPBSA-N 1 1 424.508 3.429 20 0 HGADMO COC(=O)c1ccc(N2CCC3(C[C@@H]([N@@H+](C)Cc4ccccc4)CO3)CC2)nc1C ZINC001164841218 720684786 /nfs/dbraw/zinc/68/47/86/720684786.db2.gz IIMMNYLNIJXXOY-HXUWFJFHSA-N 1 1 409.530 3.437 20 0 HGADMO COC(=O)Cc1cccc(N2CCC3(C[C@H]([N@@H+](C)Cc4ccccc4)CO3)CC2)n1 ZINC001164839692 720687014 /nfs/dbraw/zinc/68/70/14/720687014.db2.gz BIHUFMVWZLSVQP-NRFANRHFSA-N 1 1 409.530 3.057 20 0 HGADMO COc1cc(N2CCC3(C[C@@H]([N@@H+](C)Cc4ccccc4)CO3)CC2)nc(SC)n1 ZINC001164843364 720690246 /nfs/dbraw/zinc/69/02/46/720690246.db2.gz OQHNHJDNBCETDH-GOSISDBHSA-N 1 1 414.575 3.467 20 0 HGADMO COc1cc(N2CCC3(C[C@H]([N@@H+](C)Cc4ccccc4)CO3)CC2)nc(SC)n1 ZINC001164843365 720690686 /nfs/dbraw/zinc/69/06/86/720690686.db2.gz OQHNHJDNBCETDH-SFHVURJKSA-N 1 1 414.575 3.467 20 0 HGADMO CCOC(=O)Cc1ccc(N2CCC3(C[C@H]([N@@H+](C)Cc4ccccc4)CO3)CC2)nc1 ZINC001164843745 720692031 /nfs/dbraw/zinc/69/20/31/720692031.db2.gz QPEAKXSOMANMCV-QFIPXVFZSA-N 1 1 423.557 3.447 20 0 HGADMO C[N@@H+](Cc1ccccc1)[C@@H]1COC2(C1)CCN(c1[nH+][n-]c(Cl)c3ncnc1-3)CC2 ZINC001164844929 720699876 /nfs/dbraw/zinc/69/98/76/720699876.db2.gz WNDYVQKQUKPXPJ-INIZCTEOSA-N 1 1 412.925 3.266 20 0 HGADMO Clc1nnc(N2CC[C@@H]3[C@H](C[C@H](Cn4cncn4)[N@H+]3CC3CC3)C2)c2ccccc12 ZINC001164740756 720815228 /nfs/dbraw/zinc/81/52/28/720815228.db2.gz AIXVYZSOQRPTJW-MBOZVWFJSA-N 1 1 423.952 3.254 20 0 HGADMO COc1cccc2ccc(N3CC[C@@H]4[C@@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)nc21 ZINC001164745097 720819070 /nfs/dbraw/zinc/81/90/70/720819070.db2.gz WFDIWMILOGYTAT-PCCBWWKXSA-N 1 1 418.545 3.214 20 0 HGADMO Cc1nc2ccc(F)cc2c(N2CC[C@@H]3[C@@H](C[C@H](Cn4cncn4)[N@H+]3CC3CC3)C2)n1 ZINC001164739607 720820088 /nfs/dbraw/zinc/82/00/88/720820088.db2.gz HZAKBKIRGKBFIF-LRXVAGHRSA-N 1 1 421.524 3.048 20 0 HGADMO COc1ccc2nc(N3CC[C@@H]4[C@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)ccc2c1 ZINC001164743297 720822019 /nfs/dbraw/zinc/82/20/19/720822019.db2.gz RYCHOCSVWXXLHA-ZRCGQRJVSA-N 1 1 418.545 3.214 20 0 HGADMO Clc1ccc(Cl)c(N2CC[C@@H]3[C@@H](C[C@H](Cn4cncn4)[N@H+]3CC3CC3)C2)n1 ZINC001164745125 720822879 /nfs/dbraw/zinc/82/28/79/720822879.db2.gz WKSIARVKJTYAQI-ZMSDIMECSA-N 1 1 407.349 3.359 20 0 HGADMO Clc1ccc2nc(N3CC[C@@H]4[C@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)cnc2c1 ZINC001164740697 720823504 /nfs/dbraw/zinc/82/35/04/720823504.db2.gz KRUFUBVFLXKJAA-PLMTUMEDSA-N 1 1 423.952 3.254 20 0 HGADMO Clc1cc(N2CC[C@@H]3[C@H](C[C@H](Cn4cncn4)[N@H+]3CC3CC3)C2)c2cccnc2n1 ZINC001164737724 720824964 /nfs/dbraw/zinc/82/49/64/720824964.db2.gz CGXNJWBZJHUPRB-ZHALLVOQSA-N 1 1 423.952 3.254 20 0 HGADMO COC[C@]12CCCO[C@H]1CCN(c1ncnc3c1CC[N@H+](Cc1ccccc1)C3)C2 ZINC001164851043 720825876 /nfs/dbraw/zinc/82/58/76/720825876.db2.gz WJADUFLBWFOKCT-LADGPHEKSA-N 1 1 408.546 3.057 20 0 HGADMO COC[C@]12CCCO[C@H]1CCN(c1ncnc3c1CC[N@@H+](Cc1ccccc1)C3)C2 ZINC001164851043 720825877 /nfs/dbraw/zinc/82/58/77/720825877.db2.gz WJADUFLBWFOKCT-LADGPHEKSA-N 1 1 408.546 3.057 20 0 HGADMO Clc1ccnc(Cl)c1N1CC[C@@H]2[C@H](C[C@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164745088 720826174 /nfs/dbraw/zinc/82/61/74/720826174.db2.gz WDOAWEQZFHQVEQ-BFYDXBDKSA-N 1 1 407.349 3.359 20 0 HGADMO F[C@H](c1ccnc(Cl)c1)N1CC[C@@H]2[C@H](C[C@@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164744634 720827821 /nfs/dbraw/zinc/82/78/21/720827821.db2.gz VPYSRWBOKQBMCC-RMJJICAUSA-N 1 1 404.921 3.170 20 0 HGADMO Fc1cnc(N2CC[C@@H]3[C@@H](C[C@H](Cn4cncn4)[N@H+]3CC3CC3)C2)c2ccccc12 ZINC001164738469 720830522 /nfs/dbraw/zinc/83/05/22/720830522.db2.gz FXDIEVDQHJQGQQ-NJNPRVFISA-N 1 1 406.509 3.345 20 0 HGADMO COCC[N@H+]1CCO[C@@H]2CN(c3nc(Cl)nc4ccc(Cl)cc43)CC[C@H]2C1 ZINC001164847925 720832261 /nfs/dbraw/zinc/83/22/61/720832261.db2.gz KYKAGDUIVXLSIR-SUMWQHHRSA-N 1 1 411.333 3.110 20 0 HGADMO Clc1cccc2nc(N3CC[C@@H]4[C@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)ncc12 ZINC001164743584 720832576 /nfs/dbraw/zinc/83/25/76/720832576.db2.gz JJZMOQFAIJGHLF-CBGDNZLLSA-N 1 1 423.952 3.254 20 0 HGADMO Clc1ccnc2cnc(N3CC[C@@H]4[C@@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)cc12 ZINC001164745880 720836235 /nfs/dbraw/zinc/83/62/35/720836235.db2.gz OBUJDQDTPHFAOG-CSODHUTKSA-N 1 1 423.952 3.254 20 0 HGADMO COCC[N@H+]1CCO[C@@H]2CN(C(F)(F)c3cc(Cl)ncc3Cl)CC[C@@H]2C1 ZINC001164855170 720836326 /nfs/dbraw/zinc/83/63/26/720836326.db2.gz SVCHRITVJOKSDO-IUODEOHRSA-N 1 1 410.292 3.107 20 0 HGADMO CC(C)COc1cccc(N2CC[C@@H]3[C@H](C[C@H](Cn4cncn4)[N@H+]3CC3CC3)C2)n1 ZINC001164748914 720841966 /nfs/dbraw/zinc/84/19/66/720841966.db2.gz VCZCTHRGDJUCDR-NJDAHSKKSA-N 1 1 410.566 3.087 20 0 HGADMO Cc1cc(N2CC[C@@H]3[C@H](C[C@H](Cn4cncn4)[N@H+]3CC3CC3)C2)nc(-c2ccco2)n1 ZINC001164751206 720851775 /nfs/dbraw/zinc/85/17/75/720851775.db2.gz QRLMAOUVEKKAED-VAMGGRTRSA-N 1 1 419.533 3.016 20 0 HGADMO COCC[N@H+]1CCO[C@@H]2CN(c3nc(Cl)nc4cc(Cl)ccc43)CC[C@@H]2C1 ZINC001164859602 720854029 /nfs/dbraw/zinc/85/40/29/720854029.db2.gz USUBELJHYOPBNQ-CXAGYDPISA-N 1 1 411.333 3.110 20 0 HGADMO c1ncn(C[C@@H]2C[C@H]3CN(c4ccc(COC5CCC5)cn4)CC[C@H]3[N@@H+]2CC2CC2)n1 ZINC001164748670 720855502 /nfs/dbraw/zinc/85/55/02/720855502.db2.gz LMUDNEVVBMQBAH-QNWVGRARSA-N 1 1 422.577 3.122 20 0 HGADMO CC(C)(c1ccnc(Cl)c1)N1CC[C@@H]2[C@@H](C[C@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164752849 720861019 /nfs/dbraw/zinc/86/10/19/720861019.db2.gz UTVZFICNOKFJQO-DFQSSKMNSA-N 1 1 414.985 3.437 20 0 HGADMO c1cc2ncc(N3CC[C@@]4(C3)C[N@H+](CC3CC3)C[C@@H]4COCc3cccnc3)nc2[nH]1 ZINC001164754882 720869942 /nfs/dbraw/zinc/86/99/42/720869942.db2.gz UILQXEOIOCGGIR-YKSBVNFPSA-N 1 1 418.545 3.108 20 0 HGADMO COCC[N@H+]1CCO[C@@H]2CN(C(F)(F)c3cc(SC)cnc3Cl)CC[C@@H]2C1 ZINC001164861380 720871474 /nfs/dbraw/zinc/87/14/74/720871474.db2.gz XTYSYISYVKRTIZ-CZUORRHYSA-N 1 1 421.941 3.175 20 0 HGADMO Cc1cnc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COCc2cccnc2)c(C)n1 ZINC001164754336 720872045 /nfs/dbraw/zinc/87/20/45/720872045.db2.gz RHJXZHVSEXJUQY-ISKFKSNPSA-N 1 1 407.562 3.244 20 0 HGADMO COCC[N@H+]1CCO[C@H]2CN(c3cc(C(C)(C)C)nc(C(C)(C)C)n3)CC[C@@H]2C1 ZINC001164863089 720873711 /nfs/dbraw/zinc/87/37/11/720873711.db2.gz SNJXKOPMMXYZBQ-MSOLQXFVSA-N 1 1 404.599 3.245 20 0 HGADMO COc1cccc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COCc2cccnc2)n1 ZINC001164753496 720878023 /nfs/dbraw/zinc/87/80/23/720878023.db2.gz PQVZCULIIHRDSL-URXFXBBRSA-N 1 1 408.546 3.240 20 0 HGADMO COCC[N@H+]1CCO[C@@H]2CN(c3c(C)nc(-c4ccccc4)nc3Cl)CC[C@@H]2C1 ZINC001164859921 720879451 /nfs/dbraw/zinc/87/94/51/720879451.db2.gz NFASTLMSIBSHLU-RTBURBONSA-N 1 1 416.953 3.279 20 0 HGADMO Cc1cc(C)c(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COCc2cccnc2)nn1 ZINC001164757864 720882241 /nfs/dbraw/zinc/88/22/41/720882241.db2.gz VXUZAPCYIIWCGR-LADGPHEKSA-N 1 1 407.562 3.244 20 0 HGADMO Cc1ncnc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COCc2cccnc2)c1C ZINC001164755726 720884194 /nfs/dbraw/zinc/88/41/94/720884194.db2.gz NFCDOYZNSFLEGY-VWNXMTODSA-N 1 1 407.562 3.244 20 0 HGADMO COCC[N@H+]1CCO[C@H]2CN(C(F)(F)C3(c4ccc(Cl)nc4)CC3)CC[C@H]2C1 ZINC001164853892 720890967 /nfs/dbraw/zinc/89/09/67/720890967.db2.gz DORVCCKVFIABPX-RDJZCZTQSA-N 1 1 415.912 3.029 20 0 HGADMO COC(=O)c1ccc2cnc(N3CCn4c(C[N@@H+](C)C(C)C)cnc4[C@@H]3C)nc2c1 ZINC001164853960 720931238 /nfs/dbraw/zinc/93/12/38/720931238.db2.gz CWIMQEURJLKUIR-HNNXBMFYSA-N 1 1 408.506 3.034 20 0 HGADMO CCOC(=O)c1cnc(N2CCn3c(C[N@@H+](C)C(C)C)cnc3[C@@H]2C)cc1OCC ZINC001164858681 720957578 /nfs/dbraw/zinc/95/75/78/720957578.db2.gz JYWFTVHHXCPZAR-INIZCTEOSA-N 1 1 415.538 3.275 20 0 HGADMO COc1cc(OC)c2ncnc(N3CCn4c(C[N@@H+](C)C(C)C)cnc4[C@H]3C)c2c1 ZINC001164863971 721020742 /nfs/dbraw/zinc/02/07/42/721020742.db2.gz WCIKDOQWRVDCPX-OAHLLOKOSA-N 1 1 410.522 3.265 20 0 HGADMO FC(F)(c1ccnc(Cl)c1Cl)N1CCc2[nH+]cc(Cn3cccn3)n2CC1 ZINC001164864277 721031654 /nfs/dbraw/zinc/03/16/54/721031654.db2.gz YIRICQSNUXSCNE-UHFFFAOYSA-N 1 1 413.259 3.437 20 0 HGADMO Fc1ccc(C(F)(F)N2CC[N@H+]3C[C@@H](OCc4cccnc4)C[C@@H]3C2)nc1Cl ZINC001164868744 721057271 /nfs/dbraw/zinc/05/72/71/721057271.db2.gz QFSQQRSXMNYEQG-CABCVRRESA-N 1 1 412.843 3.294 20 0 HGADMO Fc1cccc2nc(Cl)nc(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@@H]4C3)c12 ZINC001164866860 721072133 /nfs/dbraw/zinc/07/21/33/721072133.db2.gz GJLYGNGPUBMWPE-HZPDHXFCSA-N 1 1 413.884 3.297 20 0 HGADMO Clc1nc2c(c(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@@H]4C3)n1)CCCCC2 ZINC001164866966 721082251 /nfs/dbraw/zinc/08/22/51/721082251.db2.gz VRXLBUUMFSVPSS-MSOLQXFVSA-N 1 1 413.953 3.274 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(C(F)(F)c4nc(Cl)cc(Cl)n4)C[C@@H]3C2)cn1 ZINC001164772564 721084302 /nfs/dbraw/zinc/08/43/02/721084302.db2.gz VCNLQXKXBDQCTE-STQMWFEESA-N 1 1 417.291 3.020 20 0 HGADMO Cc1ccc(C(F)(F)N2CC[N@H+]3C[C@@H](OCc4cccnc4)C[C@H]3C2)nc1Cl ZINC001164864865 721095678 /nfs/dbraw/zinc/09/56/78/721095678.db2.gz GYMICPDKXIIZHU-IRXDYDNUSA-N 1 1 408.880 3.463 20 0 HGADMO c1cn(C2CCCC2)c2ncnc(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@H]4C3)c12 ZINC001164866337 721097428 /nfs/dbraw/zinc/09/74/28/721097428.db2.gz SGPIRBJAQUSIMN-SFTDATJTSA-N 1 1 418.545 3.421 20 0 HGADMO CSc1nc2ccccc2c(N2CC[N@H+]3C[C@@H](OCc4cccnc4)C[C@H]3C2)n1 ZINC001164867332 721097648 /nfs/dbraw/zinc/09/76/48/721097648.db2.gz XXWBRTXRZYZZIP-ROUUACIJSA-N 1 1 407.543 3.226 20 0 HGADMO FC(F)(COc1cccc(Cl)n1)N1CC[N@H+]2C[C@@H](OCc3cccnc3)C[C@@H]2C1 ZINC001164864893 721108762 /nfs/dbraw/zinc/10/87/62/721108762.db2.gz HFCUWDMNAFKGLL-SJORKVTESA-N 1 1 424.879 3.077 20 0 HGADMO COc1cccc(-c2ccnc(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@@H]4C3)n2)c1 ZINC001164867347 721114997 /nfs/dbraw/zinc/11/49/97/721114997.db2.gz YDWJBMQVUDFGES-IRLDBZIGSA-N 1 1 417.513 3.027 20 0 HGADMO COc1ccc(-c2ccc(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@@H]4C3)nn2)cc1 ZINC001164870247 721140143 /nfs/dbraw/zinc/14/01/43/721140143.db2.gz CAMNNGDAKQUJSU-IRLDBZIGSA-N 1 1 417.513 3.027 20 0 HGADMO Fc1ccccc1-c1ccc(N2CC[N@H+]3C[C@@H](OCc4cccnc4)C[C@H]3C2)nn1 ZINC001164877634 721163604 /nfs/dbraw/zinc/16/36/04/721163604.db2.gz PJPGKZHWGYNQBH-OALUTQOASA-N 1 1 405.477 3.157 20 0 HGADMO CCOC(=O)c1cc2ccccc2nc1N1C[C@H]2CC[N@@H+](Cc3cnn(C)c3)C[C@@H]2C1 ZINC001164773905 721165092 /nfs/dbraw/zinc/16/50/92/721165092.db2.gz YFZLVEIGZGDTEG-WOJBJXKFSA-N 1 1 419.529 3.103 20 0 HGADMO CC(C)c1noc(-c2ccnc(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@@H]4C3)c2)n1 ZINC001164871082 721166549 /nfs/dbraw/zinc/16/65/49/721166549.db2.gz DINJZMUNUCNYPM-UXHICEINSA-N 1 1 420.517 3.130 20 0 HGADMO Cc1cc(-c2cccc(F)c2)nnc1N1CC[N@H+]2C[C@@H](OCc3cccnc3)C[C@@H]2C1 ZINC001164871664 721183466 /nfs/dbraw/zinc/18/34/66/721183466.db2.gz GDYUQSYLMTYNPP-YADHBBJMSA-N 1 1 419.504 3.466 20 0 HGADMO Cc1cnc(N2CC[N@H+]3C[C@@H](OCc4cccnc4)C[C@@H]3C2)nc1-c1ccccc1F ZINC001164875429 721185330 /nfs/dbraw/zinc/18/53/30/721185330.db2.gz LPLVJUBERYDGGC-UXHICEINSA-N 1 1 419.504 3.466 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4ccnc(CSc5ccccc5)n4)C[C@@H]3C2)cn1 ZINC001164769860 721238090 /nfs/dbraw/zinc/23/80/90/721238090.db2.gz ZWFPFABCCCHRLV-PMACEKPBSA-N 1 1 420.586 3.461 20 0 HGADMO COc1ccc(Cl)nc1N1CCC[C@]2(C1)COCC[N@H+](Cc1c(C)noc1C)C2 ZINC001164779520 721353081 /nfs/dbraw/zinc/35/30/81/721353081.db2.gz UOFFYOUHUYCTCX-NRFANRHFSA-N 1 1 420.941 3.467 20 0 HGADMO COc1ccc(Cl)nc1N1CCC[C@]2(C1)COCC[N@@H+](Cc1c(C)noc1C)C2 ZINC001164779520 721353087 /nfs/dbraw/zinc/35/30/87/721353087.db2.gz UOFFYOUHUYCTCX-NRFANRHFSA-N 1 1 420.941 3.467 20 0 HGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@]2(CCCN(c3ncc(F)c4cc[nH]c43)C2)C1 ZINC001164781397 721361558 /nfs/dbraw/zinc/36/15/58/721361558.db2.gz IXJOZSOVCHUIIP-JOCHJYFZSA-N 1 1 413.497 3.426 20 0 HGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@]2(CCCN(c3ccc(-c4ccco4)nn3)C2)C1 ZINC001164782943 721369636 /nfs/dbraw/zinc/36/96/36/721369636.db2.gz NYOOTLWTDSJQPH-HSZRJFAPSA-N 1 1 423.517 3.460 20 0 HGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@]2(CCCN(c3ccc(-c4ccco4)nn3)C2)C1 ZINC001164782943 721369639 /nfs/dbraw/zinc/36/96/39/721369639.db2.gz NYOOTLWTDSJQPH-HSZRJFAPSA-N 1 1 423.517 3.460 20 0 HGADMO COc1ccc2nc(N3CC[C@]4(C3)CCC[C@H](CN3CC[NH+](C)CC3)O4)ccc2c1 ZINC001164890961 721401291 /nfs/dbraw/zinc/40/12/91/721401291.db2.gz UUGYKAGAZRSWAH-QPPBQGQZSA-N 1 1 410.562 3.009 20 0 HGADMO COc1ccc2nc(N3CC[C@@]4(C3)CCC[C@@H](CN3CC[NH+](C)CC3)O4)ccc2c1 ZINC001164890966 721401358 /nfs/dbraw/zinc/40/13/58/721401358.db2.gz UUGYKAGAZRSWAH-XUZZJYLKSA-N 1 1 410.562 3.009 20 0 HGADMO CCc1c(Cl)nnc(N2CC[C@]3(C2)CCC[C@H](CN2CC[NH+](C)CC2)O3)c1CC ZINC001164884081 721413719 /nfs/dbraw/zinc/41/37/19/721413719.db2.gz DAGHYZMTRIIDNT-VGSWGCGISA-N 1 1 422.017 3.020 20 0 HGADMO C[NH+]1CCN(C[C@H]2CCC[C@@]3(CCN(c4cc5ccc(Cl)nc5cn4)C3)O2)CC1 ZINC001164886199 721415410 /nfs/dbraw/zinc/41/54/10/721415410.db2.gz ICYZEMWGZOKHPM-GCJKJVERSA-N 1 1 415.969 3.049 20 0 HGADMO CCOC(=O)c1cc2ccccc2nc1N1C[C@@H]2C[NH+](Cc3nccs3)C[C@H]2C1 ZINC001164781761 721417871 /nfs/dbraw/zinc/41/78/71/721417871.db2.gz DTLIVUBIKIDINA-IRXDYDNUSA-N 1 1 408.527 3.436 20 0 HGADMO C[NH+]1CCN(C[C@@H]2CCC[C@@]3(CCN(c4cccc(OC(C)(C)C)n4)C3)O2)CC1 ZINC001164891457 721419053 /nfs/dbraw/zinc/41/90/53/721419053.db2.gz WHUJHLYROGXRRE-CVDCTZTESA-N 1 1 402.583 3.024 20 0 HGADMO C[NH+]1CCN(C[C@H]2CCC[C@]3(CCN(c4ccc5c(Cl)ccnc5n4)C3)O2)CC1 ZINC001164889522 721419943 /nfs/dbraw/zinc/41/99/43/721419943.db2.gz RJEZUUNNRWPRSH-VGOFRKELSA-N 1 1 415.969 3.049 20 0 HGADMO CSc1ccnc(Cl)c1N1CC[C@]2(C1)CCC[C@@H](CN1CC[NH+](C)CC1)O2 ZINC001164890592 721421478 /nfs/dbraw/zinc/42/14/78/721421478.db2.gz TZNGPQZEXVOWHW-JXFKEZNVSA-N 1 1 411.015 3.222 20 0 HGADMO C[NH+]1CCN(C[C@@H]2CCC[C@@]3(CCN(c4nc(Cl)cc(C(C)(C)C)n4)C3)O2)CC1 ZINC001164891439 721428483 /nfs/dbraw/zinc/42/84/83/721428483.db2.gz GOFXMQANDFLIIK-JTSKRJEESA-N 1 1 422.017 3.193 20 0 HGADMO FC(F)(c1nc2ccc(Cl)nc2[nH]1)N1C[C@@H]2C[N@@H+](Cc3nccs3)C[C@@H]2C1 ZINC001164786601 721429509 /nfs/dbraw/zinc/42/95/09/721429509.db2.gz PAAVCKYLNLUQMS-PHIMTYICSA-N 1 1 410.881 3.181 20 0 HGADMO FC(F)(c1nc2ccc(Cl)nc2[nH]1)N1C[C@@H]2C[N@H+](Cc3nccs3)C[C@@H]2C1 ZINC001164786601 721429512 /nfs/dbraw/zinc/42/95/12/721429512.db2.gz PAAVCKYLNLUQMS-PHIMTYICSA-N 1 1 410.881 3.181 20 0 HGADMO Cc1ccc(-c2ccc(N3CC[C@]4(C3)CCC[C@H](CN3CC[NH+](C)CC3)O4)nn2)cc1 ZINC001164896574 721432269 /nfs/dbraw/zinc/43/22/69/721432269.db2.gz RNKAYAPDLXELSK-RDGATRHJSA-N 1 1 421.589 3.217 20 0 HGADMO c1csc(C[N@H+]2C[C@H]3CN(c4nc(-c5ccncc5)nc5c4CCC5)C[C@H]3C2)n1 ZINC001164783652 721432522 /nfs/dbraw/zinc/43/25/22/721432522.db2.gz JDNFRQIFVALWNW-CALCHBBNSA-N 1 1 404.543 3.052 20 0 HGADMO c1csc(C[N@@H+]2C[C@H]3CN(c4nc(-c5ccncc5)nc5c4CCC5)C[C@H]3C2)n1 ZINC001164783652 721432525 /nfs/dbraw/zinc/43/25/25/721432525.db2.gz JDNFRQIFVALWNW-CALCHBBNSA-N 1 1 404.543 3.052 20 0 HGADMO Cc1cc(N2C[C@@H]3C[N@@H+](Cc4nccs4)C[C@@H]3C2)nc(NC(=O)c2ccccc2)n1 ZINC001164791123 721433267 /nfs/dbraw/zinc/43/32/67/721433267.db2.gz ZSKNLLMVRXIXPJ-HDICACEKSA-N 1 1 420.542 3.062 20 0 HGADMO Cc1cc(N2C[C@@H]3C[N@H+](Cc4nccs4)C[C@@H]3C2)nc(NC(=O)c2ccccc2)n1 ZINC001164791123 721433268 /nfs/dbraw/zinc/43/32/68/721433268.db2.gz ZSKNLLMVRXIXPJ-HDICACEKSA-N 1 1 420.542 3.062 20 0 HGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1nc(Cl)nc(C)c1C)CC2 ZINC001164789384 721448610 /nfs/dbraw/zinc/44/86/10/721448610.db2.gz VGQUETLFUDHKBP-IBGZPJMESA-N 1 1 423.001 3.481 20 0 HGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1nc(C)cc(Cl)n1)CC2 ZINC001164783278 721450706 /nfs/dbraw/zinc/45/07/06/721450706.db2.gz BDRMMOSWJXPZDU-SFHVURJKSA-N 1 1 408.974 3.172 20 0 HGADMO CCc1ncnc(Cl)c1N1CCC2(C[C@H](COCC3CC3)[N@@H+](CCOC)C2)CC1 ZINC001164787697 721452608 /nfs/dbraw/zinc/45/26/08/721452608.db2.gz PLWFOGVVGGRRPB-GOSISDBHSA-N 1 1 423.001 3.426 20 0 HGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1cnc(Cl)cc1OC)CC2 ZINC001164786007 721455657 /nfs/dbraw/zinc/45/56/57/721455657.db2.gz LXACVJWPHYLLLK-GOSISDBHSA-N 1 1 423.985 3.478 20 0 HGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1c(C)nc(C)nc1Cl)CC2 ZINC001164783568 721457740 /nfs/dbraw/zinc/45/77/40/721457740.db2.gz DMKGTIOVYDPKMG-IBGZPJMESA-N 1 1 423.001 3.481 20 0 HGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1nccc3scnc31)CC2 ZINC001164785504 721461009 /nfs/dbraw/zinc/46/10/09/721461009.db2.gz LTJBKEMTMVBDIG-GOSISDBHSA-N 1 1 416.591 3.425 20 0 HGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1ncc(C)cc1OC)CC2 ZINC001164782831 721463973 /nfs/dbraw/zinc/46/39/73/721463973.db2.gz CSWUFNCYGGDTSD-FQEVSTJZSA-N 1 1 403.567 3.133 20 0 HGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1ccc(Cl)c(N)n1)CC2 ZINC001164788760 721472776 /nfs/dbraw/zinc/47/27/76/721472776.db2.gz JSGBDKLNZDAOOS-QGZVFWFLSA-N 1 1 408.974 3.051 20 0 HGADMO COC(=O)c1cnc(Cl)cc1N1CC[N@H+]2C[C@@H](Oc3cccc(F)c3)C[C@H]2C1 ZINC001164900261 721511093 /nfs/dbraw/zinc/51/10/93/721511093.db2.gz PGBGVPIUZUOMIM-HOCLYGCPSA-N 1 1 405.857 3.003 20 0 HGADMO COc1cc2ncc(N3CC[N@H+]4C[C@H](Oc5cccc(F)c5)C[C@@H]4C3)nc2cc1OC ZINC001164905202 721531177 /nfs/dbraw/zinc/53/11/77/721531177.db2.gz GNPSHJCHAWJTJF-SJLPKXTDSA-N 1 1 424.476 3.128 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2cc(C(=O)OC(C)(C)C)ccn2)[C@H]2CCCO[C@@H]12 ZINC001164807759 721534782 /nfs/dbraw/zinc/53/47/82/721534782.db2.gz RCPTUJDRURRIGY-TUNNFDKTSA-N 1 1 424.545 3.300 20 0 HGADMO CCOC(=O)c1cnc(N2CC[N@H+]3C[C@H](Oc4cccc(F)c4)C[C@H]3C2)c(Cl)c1 ZINC001164907163 721536354 /nfs/dbraw/zinc/53/63/54/721536354.db2.gz MJHKSDGYAFPVNA-FUHWJXTLSA-N 1 1 419.884 3.393 20 0 HGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2ccc(-c3ccccc3)nn2)[C@@H]2CCCO[C@@H]12 ZINC001164805552 721536700 /nfs/dbraw/zinc/53/67/00/721536700.db2.gz MHFCOCOUYDGTGS-CQOQZXRMSA-N 1 1 401.514 3.407 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2ccc(-c3ccccc3)nn2)[C@@H]2CCCO[C@@H]12 ZINC001164805552 721536702 /nfs/dbraw/zinc/53/67/02/721536702.db2.gz MHFCOCOUYDGTGS-CQOQZXRMSA-N 1 1 401.514 3.407 20 0 HGADMO COc1ccc2nc(N3CC[N@H+]4C[C@H](Oc5cccc(F)c5)C[C@H]4C3)nc(C)c2c1 ZINC001164912009 721540994 /nfs/dbraw/zinc/54/09/94/721540994.db2.gz YDDVAFXYBDTDCT-FXAWDEMLSA-N 1 1 408.477 3.428 20 0 HGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2nc(Cl)nc3c2SCC3)[C@@H]2CCCO[C@@H]12 ZINC001164807246 721546145 /nfs/dbraw/zinc/54/61/45/721546145.db2.gz QVYNOSFFBRVFOA-BRWVUGGUSA-N 1 1 417.966 3.041 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2nc(Cl)nc3c2SCC3)[C@@H]2CCCO[C@@H]12 ZINC001164807246 721546147 /nfs/dbraw/zinc/54/61/47/721546147.db2.gz QVYNOSFFBRVFOA-BRWVUGGUSA-N 1 1 417.966 3.041 20 0 HGADMO CC(C)(C)NC(=O)c1ccnc(N2CC[N@H+]3C[C@H](Oc4cccc(F)c4)C[C@H]3C2)c1 ZINC001164903472 721546332 /nfs/dbraw/zinc/54/63/32/721546332.db2.gz CWXFKZIINIJVAT-AZUAARDMSA-N 1 1 412.509 3.091 20 0 HGADMO CCOCc1cnc(Cl)nc1N1CC[N@H+]2C[C@H](Oc3cccc(F)c3)C[C@@H]2C1 ZINC001164909836 721549505 /nfs/dbraw/zinc/54/95/05/721549505.db2.gz SBNRSBCRPUFTNZ-SJLPKXTDSA-N 1 1 406.889 3.148 20 0 HGADMO CSc1nc(Cl)ncc1N1C[C@H]([N@H+](C)Cc2cccnc2)[C@H]2OCCC[C@@H]21 ZINC001164807357 721553991 /nfs/dbraw/zinc/55/39/91/721553991.db2.gz STJMXGPOSOEYGH-XIRDDKMYSA-N 1 1 405.955 3.115 20 0 HGADMO CSc1nc(Cl)ncc1N1C[C@H]([N@@H+](C)Cc2cccnc2)[C@H]2OCCC[C@@H]21 ZINC001164807357 721553993 /nfs/dbraw/zinc/55/39/93/721553993.db2.gz STJMXGPOSOEYGH-XIRDDKMYSA-N 1 1 405.955 3.115 20 0 HGADMO CSc1nc(Cl)ncc1N1C[C@H]([N@H+](C)Cc2cccnc2)[C@@H]2OCCC[C@@H]21 ZINC001164807348 721554525 /nfs/dbraw/zinc/55/45/25/721554525.db2.gz STJMXGPOSOEYGH-BHYGNILZSA-N 1 1 405.955 3.115 20 0 HGADMO CSc1nc(Cl)ncc1N1C[C@H]([N@@H+](C)Cc2cccnc2)[C@@H]2OCCC[C@@H]21 ZINC001164807348 721554528 /nfs/dbraw/zinc/55/45/28/721554528.db2.gz STJMXGPOSOEYGH-BHYGNILZSA-N 1 1 405.955 3.115 20 0 HGADMO COc1ccc2nc(N3CC[N@H+]4C[C@H](Oc5cccc(F)c5)C[C@H]4C3)c(C)nc2c1 ZINC001164910342 721558475 /nfs/dbraw/zinc/55/84/75/721558475.db2.gz WJHBFNMACODGLV-FXAWDEMLSA-N 1 1 408.477 3.428 20 0 HGADMO Fc1cccc(O[C@@H]2C[C@@H]3CN(c4nc5c(nc4Cl)CCCC5)CC[N@H+]3C2)c1 ZINC001164910237 721566024 /nfs/dbraw/zinc/56/60/24/721566024.db2.gz WBZZRNNGKPMKIH-NVXWUHKLSA-N 1 1 402.901 3.490 20 0 HGADMO CSc1cc(N2CC[N@H+]3C[C@@H](Oc4cccc(F)c4)C[C@H]3C2)nc(SC)n1 ZINC001164907227 721566264 /nfs/dbraw/zinc/56/62/64/721566264.db2.gz MWLAYWIKSNVDQC-HOCLYGCPSA-N 1 1 406.552 3.401 20 0 HGADMO CCCN(CCC)c1cncc(N2C[C@H]([N@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@@H]32)n1 ZINC001164806234 721568017 /nfs/dbraw/zinc/56/80/17/721568017.db2.gz PKPYOTPDJOEUJL-AWRGLXIESA-N 1 1 424.593 3.366 20 0 HGADMO CCCN(CCC)c1cncc(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@@H]32)n1 ZINC001164806234 721568020 /nfs/dbraw/zinc/56/80/20/721568020.db2.gz PKPYOTPDJOEUJL-AWRGLXIESA-N 1 1 424.593 3.366 20 0 HGADMO CSc1cnc(Cl)c(N2C[C@H]([N@H+](C)Cc3cccnc3)[C@H]3OCCC[C@H]32)n1 ZINC001164806782 721573159 /nfs/dbraw/zinc/57/31/59/721573159.db2.gz RRPLVJBKOKXPNB-VYDXJSESSA-N 1 1 405.955 3.115 20 0 HGADMO CSc1cnc(Cl)c(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@H]3OCCC[C@H]32)n1 ZINC001164806782 721573160 /nfs/dbraw/zinc/57/31/60/721573160.db2.gz RRPLVJBKOKXPNB-VYDXJSESSA-N 1 1 405.955 3.115 20 0 HGADMO C=Cc1nc(Cl)nc(N2C[C@H]([N@H+](C)Cc3cccnc3)[C@H]3OCCC[C@@H]32)c1OC ZINC001164806671 721574266 /nfs/dbraw/zinc/57/42/66/721574266.db2.gz QQJWBHPOQHCKTF-LNLFQRSKSA-N 1 1 415.925 3.045 20 0 HGADMO C=Cc1nc(Cl)nc(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@H]3OCCC[C@@H]32)c1OC ZINC001164806671 721574267 /nfs/dbraw/zinc/57/42/67/721574267.db2.gz QQJWBHPOQHCKTF-LNLFQRSKSA-N 1 1 415.925 3.045 20 0 HGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2cc(-c3ccccc3)ncn2)[C@H]2CCCO[C@H]12 ZINC001164804035 721575201 /nfs/dbraw/zinc/57/52/01/721575201.db2.gz KYOVOODODCASEG-ZDXQCDESSA-N 1 1 401.514 3.407 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2cc(-c3ccccc3)ncn2)[C@H]2CCCO[C@H]12 ZINC001164804035 721575206 /nfs/dbraw/zinc/57/52/06/721575206.db2.gz KYOVOODODCASEG-ZDXQCDESSA-N 1 1 401.514 3.407 20 0 HGADMO Cc1cc(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@H]32)nc(-c2ccco2)n1 ZINC001164810809 721583704 /nfs/dbraw/zinc/58/37/04/721583704.db2.gz WFPJQSUCLXTHOI-XQBPLPMBSA-N 1 1 405.502 3.308 20 0 HGADMO Clc1ccc(C[NH+]2CCCC2)c(N2CCn3cnc(COCC4CC4)c3C2)n1 ZINC001164802197 721599785 /nfs/dbraw/zinc/59/97/85/721599785.db2.gz RNHHGNXDNLHWGF-UHFFFAOYSA-N 1 1 401.942 3.474 20 0 HGADMO C[N@H+](Cc1ccco1)Cc1cncc2c1CCN(c1ccc(Cl)c(C(N)=O)n1)C2 ZINC001164907834 721746493 /nfs/dbraw/zinc/74/64/93/721746493.db2.gz BMZGUAQVMDGQGR-UHFFFAOYSA-N 1 1 411.893 3.017 20 0 HGADMO C[N@@H+](Cc1ccco1)Cc1cncc2c1CCN(c1ccc(Cl)c(C(N)=O)n1)C2 ZINC001164907834 721746503 /nfs/dbraw/zinc/74/65/03/721746503.db2.gz BMZGUAQVMDGQGR-UHFFFAOYSA-N 1 1 411.893 3.017 20 0 HGADMO COC(=O)c1cc(N2CCc3c(C[N@H+](C)Cc4ccco4)cncc3C2)ncc1F ZINC001164909963 721750770 /nfs/dbraw/zinc/75/07/70/721750770.db2.gz VEJFNHNVXVEAOV-UHFFFAOYSA-N 1 1 410.449 3.190 20 0 HGADMO COC(=O)c1cc(N2CCc3c(C[N@@H+](C)Cc4ccco4)cncc3C2)ncc1F ZINC001164909963 721750775 /nfs/dbraw/zinc/75/07/75/721750775.db2.gz VEJFNHNVXVEAOV-UHFFFAOYSA-N 1 1 410.449 3.190 20 0 HGADMO CCCNC(=O)c1ccc(N2CCc3c(C[N@H+](C)Cc4ccco4)cncc3C2)nc1 ZINC001164911137 721761746 /nfs/dbraw/zinc/76/17/46/721761746.db2.gz MUNVEWDXNRJJLR-UHFFFAOYSA-N 1 1 419.529 3.404 20 0 HGADMO CCCNC(=O)c1ccc(N2CCc3c(C[N@@H+](C)Cc4ccco4)cncc3C2)nc1 ZINC001164911137 721761754 /nfs/dbraw/zinc/76/17/54/721761754.db2.gz MUNVEWDXNRJJLR-UHFFFAOYSA-N 1 1 419.529 3.404 20 0 HGADMO Clc1cc(N2CCO[C@@]3(C2)COCC[N@H+](Cc2cccnc2)C3)c2ccccc2n1 ZINC001164910623 721767124 /nfs/dbraw/zinc/76/71/24/721767124.db2.gz JLWYMAYUOUGNRH-QHCPKHFHSA-N 1 1 424.932 3.391 20 0 HGADMO Clc1cc(N2CCO[C@@]3(C2)COCC[N@@H+](Cc2cccnc2)C3)c2ccccc2n1 ZINC001164910623 721767130 /nfs/dbraw/zinc/76/71/30/721767130.db2.gz JLWYMAYUOUGNRH-QHCPKHFHSA-N 1 1 424.932 3.391 20 0 HGADMO Clc1ccc2c(ccnc2N2CCO[C@@]3(C2)COCC[N@H+](Cc2cccnc2)C3)c1 ZINC001164910459 721777774 /nfs/dbraw/zinc/77/77/74/721777774.db2.gz BTYPLQYYEPNRGL-QHCPKHFHSA-N 1 1 424.932 3.391 20 0 HGADMO Clc1ccc2c(ccnc2N2CCO[C@@]3(C2)COCC[N@@H+](Cc2cccnc2)C3)c1 ZINC001164910459 721777776 /nfs/dbraw/zinc/77/77/76/721777776.db2.gz BTYPLQYYEPNRGL-QHCPKHFHSA-N 1 1 424.932 3.391 20 0 HGADMO Cc1cc(Cl)nc(N2C[C@@H]3CCC[C@H]([N@@H+](C)Cc4ccccn4)[C@@H]3C2)c1C(N)=O ZINC001165024692 721801746 /nfs/dbraw/zinc/80/17/46/721801746.db2.gz MRIGYDCUUOKQAZ-JQHSSLGASA-N 1 1 413.953 3.274 20 0 HGADMO C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@H]2CN(c3nc(Cl)c(F)cc3C(N)=O)C[C@H]21 ZINC001165018699 721806493 /nfs/dbraw/zinc/80/64/93/721806493.db2.gz BYBKQXWCAYJMSV-FDQGKXFDSA-N 1 1 417.916 3.105 20 0 HGADMO COC(=O)c1c[nH]c2nc(N3C[C@@H]4CCC[C@H]([N@@H+](C)Cc5ccccn5)[C@@H]4C3)ccc12 ZINC001165024707 721807304 /nfs/dbraw/zinc/80/73/04/721807304.db2.gz MRKCSQADHSSDJS-DQLDELGASA-N 1 1 419.529 3.481 20 0 HGADMO COCc1cc(N2C[C@@H]3CCC[C@H]([N@@H+](C)Cc4ccccn4)[C@H]3C2)nc(SC)n1 ZINC001165026883 721811222 /nfs/dbraw/zinc/81/12/22/721811222.db2.gz SAPWQBJMRKXYIV-VDGAXYAQSA-N 1 1 413.591 3.477 20 0 HGADMO C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@@H]2CN(c3[nH]c4cc(=O)[nH]c-4cc3Cl)C[C@@H]21 ZINC001165022721 721813989 /nfs/dbraw/zinc/81/39/89/721813989.db2.gz GWBKJKNKYLBXIH-PTSWNOGYSA-N 1 1 411.937 3.362 20 0 HGADMO CCOC(=O)c1cnc(N2C[C@@H]3CCC[C@H]([N@@H+](C)Cc4ccccn4)[C@@H]3C2)c(OC)c1 ZINC001165024234 721817107 /nfs/dbraw/zinc/81/71/07/721817107.db2.gz KAAQAKQEIUTMLT-WMQCIHAUSA-N 1 1 424.545 3.399 20 0 HGADMO C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@@H]2CN(c3ncnc4c3ncn4C3CC3)C[C@@H]21 ZINC001165024436 721825010 /nfs/dbraw/zinc/82/50/10/721825010.db2.gz JVRSQVFZMPNRPB-LSTHTHJFSA-N 1 1 403.534 3.293 20 0 HGADMO COC(=O)c1nc(Cl)cc(N2C[C@@H]3CCC[C@@H]([N@@H+](C)Cc4ccccn4)[C@@H]3C2)n1 ZINC001165030222 721827549 /nfs/dbraw/zinc/82/75/49/721827549.db2.gz ZBGWZNQREUUBBB-USXIJHARSA-N 1 1 415.925 3.049 20 0 HGADMO C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@@H]2CN([C@@H](F)Oc3cncc(Cl)n3)C[C@H]21 ZINC001165027882 721829395 /nfs/dbraw/zinc/82/93/95/721829395.db2.gz USGXEVOUQMMWOB-WVSUBDOOSA-N 1 1 405.905 3.389 20 0 HGADMO C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@@H]2CN([C@@H](F)Oc3ccc(Cl)nn3)C[C@H]21 ZINC001165030218 721831665 /nfs/dbraw/zinc/83/16/65/721831665.db2.gz ZASCNMSITKAOJP-WVSUBDOOSA-N 1 1 405.905 3.389 20 0 HGADMO C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@@H]2CN([C@H](F)Oc3ccc(Cl)nn3)C[C@@H]21 ZINC001165030216 721831733 /nfs/dbraw/zinc/83/17/33/721831733.db2.gz ZASCNMSITKAOJP-ASKNOMKYSA-N 1 1 405.905 3.389 20 0 HGADMO CN(C)CC[N@H+]1CC[C@@H]2[C@@H]1CCN2c1nnc(Cc2ccccc2)c2ccccc21 ZINC001164929397 721877185 /nfs/dbraw/zinc/87/71/85/721877185.db2.gz BGASTMWZDYQDSI-BJKOFHAPSA-N 1 1 401.558 3.435 20 0 HGADMO C[NH+](C)CCN1CC[C@@H]2[C@@H]1CCN2c1nnc(Cc2ccccc2)c2ccccc21 ZINC001164929397 721877186 /nfs/dbraw/zinc/87/71/86/721877186.db2.gz BGASTMWZDYQDSI-BJKOFHAPSA-N 1 1 401.558 3.435 20 0 HGADMO CCOC(=O)c1ccnc(N2CCC3(CC2)C[N@@H+](Cc2ccc(C)cc2)CCO3)c1 ZINC001164939219 721921105 /nfs/dbraw/zinc/92/11/05/721921105.db2.gz SVKPYRZFMPPKBX-UHFFFAOYSA-N 1 1 409.530 3.438 20 0 HGADMO Cc1ccc(C[N@H+]2CCOC3(CCN(c4[nH+][n-]c(Cl)c5ncnc4-5)CC3)C2)cc1 ZINC001164939160 721927741 /nfs/dbraw/zinc/92/77/41/721927741.db2.gz JOJOYUUFVKXYSA-UHFFFAOYSA-N 1 1 412.925 3.186 20 0 HGADMO COc1cnc2c(c1)ncnc2N1CCC2(CC1)C[N@@H+](Cc1ccc(C)cc1)CCO2 ZINC001164938697 721929782 /nfs/dbraw/zinc/92/97/82/721929782.db2.gz DUSXYJIMODBLIU-UHFFFAOYSA-N 1 1 419.529 3.213 20 0 HGADMO CCn1cnc2c1ncnc2N1CCC2(CC1)C[N@@H+](Cc1ccc(C)cc1)CCO2 ZINC001164938594 721931067 /nfs/dbraw/zinc/93/10/67/721931067.db2.gz AAYSIXCBZDHZCY-UHFFFAOYSA-N 1 1 406.534 3.026 20 0 HGADMO CCOC(=O)Cc1ccnc(N2CCC3(CC2)C[N@@H+](Cc2ccc(C)cc2)CCO3)c1 ZINC001164945381 721933747 /nfs/dbraw/zinc/93/37/47/721933747.db2.gz WCFLALNYQJCPJD-UHFFFAOYSA-N 1 1 423.557 3.367 20 0 HGADMO CSc1cc(Cl)ncc1N1CCC2(CC1)C(=O)NCC[N@H+]2Cc1ccccc1 ZINC001164943631 721972886 /nfs/dbraw/zinc/97/28/86/721972886.db2.gz AMZMGCQYIKRZSR-UHFFFAOYSA-N 1 1 416.978 3.428 20 0 HGADMO CSc1cc(Cl)ncc1N1CCC2(CC1)C(=O)NCC[N@@H+]2Cc1ccccc1 ZINC001164943631 721972887 /nfs/dbraw/zinc/97/28/87/721972887.db2.gz AMZMGCQYIKRZSR-UHFFFAOYSA-N 1 1 416.978 3.428 20 0 HGADMO CC[NH+](CC)Cc1nc2sc(C)c(C)c2c(N2C[C@H]3COC[C@@]3(COC)C2)n1 ZINC001164952352 721994789 /nfs/dbraw/zinc/99/47/89/721994789.db2.gz OQQWPVNMVCXDJW-KKSFZXQISA-N 1 1 404.580 3.249 20 0 HGADMO Clc1cccc(COc2cncc(N3CC[NH+](CCc4ccccn4)CC3)n2)c1 ZINC001165056144 722019724 /nfs/dbraw/zinc/01/97/24/722019724.db2.gz XFDMHCBGKVREFL-UHFFFAOYSA-N 1 1 409.921 3.469 20 0 HGADMO COC(=O)/C=C\c1cc(C)cnc1N1CCC2(CC[N@@H+](Cc3cccnc3)C2)CC1 ZINC001164955834 722020682 /nfs/dbraw/zinc/02/06/82/722020682.db2.gz OJVZHOWOHCRHBE-WAYWQWQTSA-N 1 1 406.530 3.464 20 0 HGADMO O=C(NC1CCCC1)c1ccc(N2CCC3(CC[N@@H+](Cc4cccnc4)C3)CC2)nn1 ZINC001164960632 722023731 /nfs/dbraw/zinc/02/37/31/722023731.db2.gz LUNDNIANYDGUTJ-UHFFFAOYSA-N 1 1 420.561 3.037 20 0 HGADMO CCOC(=O)c1cc(C)cc(N2CCC3(CC2)COCC[N@@H+](Cc2ccncc2)C3)n1 ZINC001164961952 722053405 /nfs/dbraw/zinc/05/34/05/722053405.db2.gz ZRNIMPZEWKPJJK-UHFFFAOYSA-N 1 1 424.545 3.081 20 0 HGADMO FC(F)(c1nccnc1Cl)N1CCC2(CC1)COCC[N@@H+](Cc1ccncc1)C2 ZINC001164962304 722058911 /nfs/dbraw/zinc/05/89/11/722058911.db2.gz QPBHFBLTZMAPDQ-UHFFFAOYSA-N 1 1 423.895 3.189 20 0 HGADMO COc1ccnc(Cl)c1N1CCC2(CC1)COCC[N@@H+](Cc1ccncc1)C2 ZINC001164960041 722061484 /nfs/dbraw/zinc/06/14/84/722061484.db2.gz FKRHBXUCUOQKIF-UHFFFAOYSA-N 1 1 402.926 3.258 20 0 HGADMO O=C(c1cscn1)N1CC[C@@H]2[C@@H]1CCN2c1nc(Cl)ccc1C[NH+]1CCCC1 ZINC001164964524 722064764 /nfs/dbraw/zinc/06/47/64/722064764.db2.gz HEWDDTAYNGJUMG-SJORKVTESA-N 1 1 417.966 3.281 20 0 HGADMO Cc1c(C)n(Cc2ccccc2)c2ncnc(N3C[C@@H]4C[N@H+](CC5CC5)C[C@H](C3)O4)c12 ZINC001164966661 722075090 /nfs/dbraw/zinc/07/50/90/722075090.db2.gz FPICEKNVENTQNZ-SZPZYZBQSA-N 1 1 417.557 3.396 20 0 HGADMO Clc1nnc(N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)c2ccccc12 ZINC001164984135 722103997 /nfs/dbraw/zinc/10/39/97/722103997.db2.gz RUDFFNDYBAKUKF-FXAWDEMLSA-N 1 1 409.921 3.406 20 0 HGADMO CC(C)(C)OC(=O)c1ccnc(N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)c1 ZINC001164986631 722104436 /nfs/dbraw/zinc/10/44/36/722104436.db2.gz ZQRFUTZOTRQEHF-NHCUHLMSSA-N 1 1 424.545 3.159 20 0 HGADMO Clc1ccnc2c1ccnc2N1CC[C@H]2C[N@@H+](Cc3cccnc3)CCO[C@@H]2C1 ZINC001164975477 722104628 /nfs/dbraw/zinc/10/46/28/722104628.db2.gz BZHNETSATLJWKM-FXAWDEMLSA-N 1 1 409.921 3.406 20 0 HGADMO COc1ccc2c(ccnc2N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)c1 ZINC001164979915 722107069 /nfs/dbraw/zinc/10/70/69/722107069.db2.gz IIQFCPSQKZJBAM-NZQKXSOJSA-N 1 1 404.514 3.366 20 0 HGADMO Clc1nnc(N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)c2sccc21 ZINC001164979309 722107153 /nfs/dbraw/zinc/10/71/53/722107153.db2.gz IAEUIFVZASTYSY-DOTOQJQBSA-N 1 1 415.950 3.467 20 0 HGADMO Clc1cc2ccnc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)c2cn1 ZINC001164982175 722109867 /nfs/dbraw/zinc/10/98/67/722109867.db2.gz WCYNLUCMQOMAMA-AZUAARDMSA-N 1 1 409.921 3.406 20 0 HGADMO Clc1ccc2c(c1)ncnc2N1CC[C@H]2C[N@@H+](Cc3cccnc3)CCO[C@@H]2C1 ZINC001164982136 722110141 /nfs/dbraw/zinc/11/01/41/722110141.db2.gz WCEXXTCXCGMNLJ-LAUBAEHRSA-N 1 1 409.921 3.406 20 0 HGADMO CCOc1ccc2ncnc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)c2c1 ZINC001164971432 722122601 /nfs/dbraw/zinc/12/26/01/722122601.db2.gz CKWSGGHOIYFLSD-XXBNENTESA-N 1 1 419.529 3.151 20 0 HGADMO CCOc1ccc2ncnc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)c2c1 ZINC001164971425 722122650 /nfs/dbraw/zinc/12/26/50/722122650.db2.gz CKWSGGHOIYFLSD-AUSIDOKSSA-N 1 1 419.529 3.151 20 0 HGADMO Clc1ccc2cnc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)nc2c1 ZINC001164981016 722125963 /nfs/dbraw/zinc/12/59/63/722125963.db2.gz RXZJGVYTNBTKFP-WIYYLYMNSA-N 1 1 409.921 3.406 20 0 HGADMO Cc1cc(C(F)(F)N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)c(Cl)nn1 ZINC001164979701 722143054 /nfs/dbraw/zinc/14/30/54/722143054.db2.gz LTJUJBGYAWGQLX-WMZOPIPTSA-N 1 1 423.895 3.106 20 0 HGADMO c1cc(-c2ccc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)nn2)cs1 ZINC001164976197 722151826 /nfs/dbraw/zinc/15/18/26/722151826.db2.gz UWJGXGLYAVDELH-RXVVDRJESA-N 1 1 407.543 3.327 20 0 HGADMO c1cncc(C[N@H+]2CCO[C@H]3CN(c4cncc(OCC5CCCC5)n4)CC[C@@H]3C2)c1 ZINC001164971080 722154895 /nfs/dbraw/zinc/15/48/95/722154895.db2.gz ALJRQKOBIMEPRI-YADHBBJMSA-N 1 1 423.561 3.168 20 0 HGADMO CCCc1cc(N2CC[C@@H]3[C@H](CC2)OCCN3Cc2csc(C)n2)nc(C)[nH+]1 ZINC001164988485 722184036 /nfs/dbraw/zinc/18/40/36/722184036.db2.gz JRPJFZCAQUEYNO-UXHICEINSA-N 1 1 401.580 3.372 20 0 HGADMO COC(=O)c1cc2c(N3CCC[C@]4(CC[N@H+]4Cc4cccc(F)c4)C3)[nH]cnc-2n1 ZINC001164995316 722194246 /nfs/dbraw/zinc/19/42/46/722194246.db2.gz UILNSYUONKEKNT-QFIPXVFZSA-N 1 1 409.465 3.080 20 0 HGADMO COC(=O)c1cc2c(ncnc2N2CCC[C@]3(CC[N@@H+]3Cc3cccc(F)c3)C2)[nH]1 ZINC001164995316 722194247 /nfs/dbraw/zinc/19/42/47/722194247.db2.gz UILNSYUONKEKNT-QFIPXVFZSA-N 1 1 409.465 3.080 20 0 HGADMO COC(=O)c1cc2c(ncnc2N2CCC[C@]3(CC[N@H+]3Cc3cccc(F)c3)C2)[nH]1 ZINC001164995316 722194248 /nfs/dbraw/zinc/19/42/48/722194248.db2.gz UILNSYUONKEKNT-QFIPXVFZSA-N 1 1 409.465 3.080 20 0 HGADMO OC[C@@H](Cc1ccc(F)cc1)[NH2+]Cc1c(Br)cncc1Br ZINC000571488413 1126097896 /nfs/dbraw/zinc/09/78/96/1126097896.db2.gz NHUNNTAVFIEXNU-GFCCVEGCSA-N 1 1 418.104 3.439 20 0 HGADMO C[C@@](CO)(Cc1ccc(Br)cc1)[NH2+]Cc1n[nH]cc1Br ZINC001206855621 1126159651 /nfs/dbraw/zinc/15/96/51/1126159651.db2.gz IGXIZJTYHYGLOA-AWEZNQCLSA-N 1 1 403.118 3.018 20 0 HGADMO COc1ccc(C[C@](C)(CO)[NH2+]Cc2nc(Cc3ccccc3C)no2)cc1OC ZINC001308118086 1126163800 /nfs/dbraw/zinc/16/38/00/1126163800.db2.gz QNPINDUXFPDMKB-HSZRJFAPSA-N 1 1 411.502 3.069 20 0 HGADMO CC(C)(C)OC(=O)NC(C)(C)c1noc(C[NH2+][C@](C)(CO)Cc2ccc(F)cc2)n1 ZINC001308117868 1126163537 /nfs/dbraw/zinc/16/35/37/1126163537.db2.gz NVRBRDPAQCJQNI-NRFANRHFSA-N 1 1 422.501 3.052 20 0 HGADMO COc1ccccc1C[C@](C)(CO)[NH2+]Cc1nc(-c2cc(F)c(F)c(F)c2)no1 ZINC001560102324 1126208107 /nfs/dbraw/zinc/20/81/07/1126208107.db2.gz LAFFMISWJNSEHH-HXUWFJFHSA-N 1 1 407.392 3.246 20 0 HGADMO C[C@](CO)(Cc1ccc(Cl)cc1)[NH2+]Cc1nc(-c2ccc3c(c2)OCO3)no1 ZINC001560183523 1126209261 /nfs/dbraw/zinc/20/92/61/1126209261.db2.gz RBYQQEQMRAASLK-HXUWFJFHSA-N 1 1 401.850 3.202 20 0 HGADMO CCOC(=O)c1cc(Cl)nnc1N1CCC[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]21 ZINC001164629649 719067547 /nfs/dbraw/zinc/06/75/47/719067547.db2.gz YKQPSIOHIPGYGL-FUHWJXTLSA-N 1 1 400.910 3.408 20 0 HGADMO CCOC(=O)Cc1c(Cl)ncnc1N1CCC[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]21 ZINC001164623603 719079481 /nfs/dbraw/zinc/07/94/81/719079481.db2.gz JWPLDNVHRDBNBA-PKOBYXMFSA-N 1 1 414.937 3.336 20 0 HGADMO CCOC(=O)c1nc2ccn(C)c2c(N2CCC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)n1 ZINC001164632408 719091870 /nfs/dbraw/zinc/09/18/70/719091870.db2.gz ZITVRGGHCKFFAV-UYAOXDASSA-N 1 1 419.529 3.246 20 0 HGADMO COC(=O)c1cccc2nc(N3CCc4c(C[NH+](C)C)nn(C(C)C)c4C3)ccc21 ZINC001164652048 719316350 /nfs/dbraw/zinc/31/63/50/719316350.db2.gz MKEAGOCTWIXYIJ-UHFFFAOYSA-N 1 1 407.518 3.423 20 0 HGADMO CNC(=O)C[N@H+]1CCCC12CCN(C(F)(F)c1cc(Cl)cnc1Cl)CC2 ZINC001164681779 719703964 /nfs/dbraw/zinc/70/39/64/719703964.db2.gz AQAMOKCOKNGMAF-UHFFFAOYSA-N 1 1 407.292 3.114 20 0 HGADMO CNC(=O)C[N@H+]1CCCC12CCN(C(F)(F)c1cnc(Cl)c(C3CC3)c1)CC2 ZINC001164693771 719757536 /nfs/dbraw/zinc/75/75/36/719757536.db2.gz ZPIRAMDECFPMJV-UHFFFAOYSA-N 1 1 412.912 3.338 20 0 HGADMO Cc1nc(C[N@@H+]2CCCC23CCN(c2ccc4ccc(=O)n(C)c4n2)CC3)cs1 ZINC001164694102 719809040 /nfs/dbraw/zinc/80/90/40/719809040.db2.gz UYRMHRAMSBAYNW-UHFFFAOYSA-N 1 1 409.559 3.333 20 0 HGADMO CNC(=O)c1nc(N2CCC3(CCC[N@H+]3Cc3csc(C)n3)CC2)ccc1Cl ZINC001164692623 719810209 /nfs/dbraw/zinc/81/02/09/719810209.db2.gz LVIHSXWEEBBFAS-UHFFFAOYSA-N 1 1 419.982 3.495 20 0 HGADMO COC(=O)[C@@]1(C)C[C@H]([NH+]2CCOCC2)CCN1c1ncnc2sc(C(C)C)cc21 ZINC001164707034 719838409 /nfs/dbraw/zinc/83/84/09/719838409.db2.gz YXCYYGQGOVUGOL-QVKFZJNVSA-N 1 1 418.563 3.047 20 0 HGADMO COC(=O)[C@]1(C)C[C@@H]([NH+]2CCOCC2)CCN1c1nccc2cc(Cl)ccc21 ZINC001164697227 719849309 /nfs/dbraw/zinc/84/93/09/719849309.db2.gz BTRYXECWVAIPST-UWJYYQICSA-N 1 1 403.910 3.121 20 0 HGADMO COC(=O)[C@@]1(C)C[C@H]([NH+]2CCOCC2)CCN1c1cc(Cl)nc2sccc21 ZINC001164706732 719849354 /nfs/dbraw/zinc/84/93/54/719849354.db2.gz YJNXXPRBVAYPFQ-BFUOFWGJSA-N 1 1 409.939 3.182 20 0 HGADMO COC(=O)[C@]1(C)C[C@H]([NH+]2CCOCC2)CCN1c1nccc2cccc(Cl)c21 ZINC001164700173 719856468 /nfs/dbraw/zinc/85/64/68/719856468.db2.gz HAZLPADUYGDIRG-IERDGZPVSA-N 1 1 403.910 3.121 20 0 HGADMO COC(=O)[C@@]1(C)C[C@H]([NH+]2CCOCC2)CCN1c1nc(Cl)cc2ccc(C)cc21 ZINC001164700575 719861496 /nfs/dbraw/zinc/86/14/96/719861496.db2.gz ICTJGUOMJOCDEU-VGOFRKELSA-N 1 1 417.937 3.429 20 0 HGADMO COC(=O)[C@]1(C)C[C@H]([NH+]2CCOCC2)CCN1c1cc(Cl)nc2c(F)cccc12 ZINC001164705372 719878179 /nfs/dbraw/zinc/87/81/79/719878179.db2.gz YKLSPHPAILEOTE-SZNDQCEHSA-N 1 1 421.900 3.260 20 0 HGADMO Cc1nc2nc(Cl)nc(N3CCC4(CC3)C[N@@H+](Cc3cccs3)CCO4)c2[nH]1 ZINC001164695746 719889865 /nfs/dbraw/zinc/88/98/65/719889865.db2.gz UOMCRROMBWBAJW-UHFFFAOYSA-N 1 1 418.954 3.248 20 0 HGADMO Clc1nc(Cl)nc(N2CCC3(CC2)C[N@H+](Cc2cccs2)CCO3)n1 ZINC001164695661 719889948 /nfs/dbraw/zinc/88/99/48/719889948.db2.gz POCXBTPCPVMZAR-UHFFFAOYSA-N 1 1 400.335 3.111 20 0 HGADMO Clc1nc(Cl)nc(N2CCC3(CC2)C[N@@H+](Cc2cccs2)CCO3)n1 ZINC001164695661 719889949 /nfs/dbraw/zinc/88/99/49/719889949.db2.gz POCXBTPCPVMZAR-UHFFFAOYSA-N 1 1 400.335 3.111 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(C(F)(F)c1cc(Cl)nc(C)n1)C2 ZINC001164808526 720085762 /nfs/dbraw/zinc/08/57/62/720085762.db2.gz HWDMRYAKEDOSMB-CRAIPNDOSA-N 1 1 400.901 3.168 20 0 HGADMO COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1nc(C)cc(Cl)n1)CC2 ZINC001164712692 720095534 /nfs/dbraw/zinc/09/55/34/720095534.db2.gz YCWGOMZSWSISJJ-GOSISDBHSA-N 1 1 401.942 3.341 20 0 HGADMO COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1cc(Cl)nc(OC)n1)CC2 ZINC001164710001 720096613 /nfs/dbraw/zinc/09/66/13/720096613.db2.gz DYUGFBAKEBSAHT-KRWDZBQOSA-N 1 1 417.941 3.041 20 0 HGADMO CCOC(=O)c1c(C)cc(Cl)nc1N1CC[C@@]2(C1)C[N@@H+](CC1CC1)C[C@H]2COC ZINC001164813578 720098093 /nfs/dbraw/zinc/09/80/93/720098093.db2.gz TXELZFTYAJFBAW-JTSKRJEESA-N 1 1 421.969 3.405 20 0 HGADMO CCOC(=O)c1c(C)cc(Cl)nc1N1CC[C@@]2(C1)C[N@@H+](CC1CC1)C[C@@H]2COC ZINC001164813580 720098429 /nfs/dbraw/zinc/09/84/29/720098429.db2.gz TXELZFTYAJFBAW-VGSWGCGISA-N 1 1 421.969 3.405 20 0 HGADMO COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1ncc(Cl)c(C)n1)CC2 ZINC001164710025 720103914 /nfs/dbraw/zinc/10/39/14/720103914.db2.gz FRWGWFCDIIWGDB-GOSISDBHSA-N 1 1 401.942 3.341 20 0 HGADMO COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1nc(C)cnc1Cl)CC2 ZINC001164716996 720122399 /nfs/dbraw/zinc/12/23/99/720122399.db2.gz NBWKDXGPOXNWHH-GOSISDBHSA-N 1 1 401.942 3.341 20 0 HGADMO CCOC(=O)c1cnc(Cl)c(C)c1N1CC[C@]2(C1)C[N@@H+](CC1CC1)C[C@H]2COC ZINC001164810585 720126481 /nfs/dbraw/zinc/12/64/81/720126481.db2.gz KGPPEDNHULYZOL-HTAPYJJXSA-N 1 1 421.969 3.405 20 0 HGADMO CCOC(=O)c1cnc(Cl)c(C)c1N1CC[C@]2(C1)C[N@@H+](CC1CC1)C[C@@H]2COC ZINC001164810589 720128149 /nfs/dbraw/zinc/12/81/49/720128149.db2.gz KGPPEDNHULYZOL-VGOFRKELSA-N 1 1 421.969 3.405 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(C(F)(F)c1cc(N)cc(Cl)n1)C2 ZINC001164816232 720129597 /nfs/dbraw/zinc/12/95/97/720129597.db2.gz YOLYTZNMKNFIEW-RDTXWAMCSA-N 1 1 400.901 3.047 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1cnc(OCc3ccccc3)cn1)C2 ZINC001164816719 720149667 /nfs/dbraw/zinc/14/96/67/720149667.db2.gz MGJIFPAVCBPGHB-XUZZJYLKSA-N 1 1 408.546 3.240 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1nc(-c3ccncc3)nc(C)c1C)C2 ZINC001164816242 720183973 /nfs/dbraw/zinc/18/39/73/720183973.db2.gz KJHHZIMPOWJVLX-URXFXBBRSA-N 1 1 407.562 3.340 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(C(F)(F)Oc1ccnc(Cl)c1)C2 ZINC001164812749 720196807 /nfs/dbraw/zinc/19/68/07/720196807.db2.gz MBMBCMQRBAEAFR-MAUKXSAKSA-N 1 1 401.885 3.344 20 0 HGADMO CC(C)[N@@H+](C)Cc1cc(=O)n2c(n1)CN(c1cc3ccc(Cl)nc3cn1)CCC2 ZINC001164813478 720225027 /nfs/dbraw/zinc/22/50/27/720225027.db2.gz MPPFKDZTXYVNJM-UHFFFAOYSA-N 1 1 412.925 3.090 20 0 HGADMO C[NH+]1CCC(CN2C(=O)CC[C@H]3[C@H]2CCN3C(C)(C)c2ccnc(Cl)c2)CC1 ZINC001164830859 720354982 /nfs/dbraw/zinc/35/49/82/720354982.db2.gz XNTGKCDVZGEKDM-MOPGFXCFSA-N 1 1 404.986 3.377 20 0 HGADMO CCOC(=O)c1cc2cccnc2nc1N1CC[C@H]2[C@@H]1CC[N@H+]2Cc1cccnc1 ZINC001164725398 720379730 /nfs/dbraw/zinc/37/97/30/720379730.db2.gz NFOLIKPSHNJBMZ-PMACEKPBSA-N 1 1 403.486 3.055 20 0 HGADMO Cc1nc(CO[C@@H]2CN(c3ccc(C[N@H+](C)C4CC4)cn3)[C@H]3CCCO[C@@H]23)cs1 ZINC001164825790 720391806 /nfs/dbraw/zinc/39/18/06/720391806.db2.gz VIGJJECOEFKKEN-TUNNFDKTSA-N 1 1 414.575 3.394 20 0 HGADMO COc1ccc(-c2ccc(N3CC[C@@H]4[C@@H]3CC[N@H+]4Cc3cccnc3)nn2)c(OC)c1 ZINC001164735368 720457870 /nfs/dbraw/zinc/45/78/70/720457870.db2.gz WQXFFJDUPXAMDD-YADHBBJMSA-N 1 1 417.513 3.409 20 0 HGADMO COc1ccc(OC)c(-c2ccc(N3CC[C@@H]4[C@H]3CC[N@H+]4Cc3cccnc3)nn2)c1 ZINC001164735042 720458552 /nfs/dbraw/zinc/45/85/52/720458552.db2.gz VEMXZXBXEVZYMF-FGZHOGPDSA-N 1 1 417.513 3.409 20 0 HGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@H]2CN(C(F)(F)c3ccnc(Cl)n3)CC[C@@H]21 ZINC001164839383 720504699 /nfs/dbraw/zinc/50/46/99/720504699.db2.gz TUHGOMUZRBWWQR-JYJNAYRXSA-N 1 1 410.900 3.249 20 0 HGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@@H]2CN(C(F)(F)c3cc(Cl)ncn3)CC[C@@H]21 ZINC001164838481 720506057 /nfs/dbraw/zinc/50/60/57/720506057.db2.gz RMAXFOWPEOCFRD-PMPSAXMXSA-N 1 1 410.900 3.249 20 0 HGADMO COc1nc2ccccc2nc1N1CC[C@@H]2[C@H](C[C@H](Cn3cccn3)[N@H+]2C(C)C)C1 ZINC001164838522 720522008 /nfs/dbraw/zinc/52/20/08/720522008.db2.gz RNUFFZYDPSVOAM-DBXWQHBBSA-N 1 1 406.534 3.213 20 0 HGADMO COc1c(Cl)nc(C)nc1N1CC[C@@H]2[C@H](C[C@H](Cn3cccn3)[N@H+]2C(C)C)C1 ZINC001164839310 720543878 /nfs/dbraw/zinc/54/38/78/720543878.db2.gz QFXNLTAMKXAXDJ-BRWVUGGUSA-N 1 1 404.946 3.021 20 0 HGADMO COc1ccc2c(c1)ncnc2N1CC[C@@H]2[C@H](C[C@@H](Cn3cccn3)[N@H+]2C(C)C)C1 ZINC001164834948 720545217 /nfs/dbraw/zinc/54/52/17/720545217.db2.gz GBBVRBIWDZQQKT-KGVIQGDOSA-N 1 1 406.534 3.213 20 0 HGADMO Clc1ccc2nc(Cl)nc(N3CC[N@H+]4C[C@H](Oc5cncnc5)C[C@@H]4C3)c2c1 ZINC001164745078 720606823 /nfs/dbraw/zinc/60/68/23/720606823.db2.gz UHGKALSVHGOEKF-ZIAGYGMSSA-N 1 1 417.300 3.069 20 0 HGADMO FC(F)(c1ccc(Cl)nc1Cl)N1CC[N@@H+]2C[C@@H](Oc3cncnc3)C[C@@H]2C1 ZINC001164744264 720618943 /nfs/dbraw/zinc/61/89/43/720618943.db2.gz QXJAFYQDTRUSQT-NEPJUHHUSA-N 1 1 416.259 3.065 20 0 HGADMO FC(F)(c1ccc(Cl)nc1Cl)N1CC[N@H+]2C[C@@H](Oc3cncnc3)C[C@@H]2C1 ZINC001164744264 720618955 /nfs/dbraw/zinc/61/89/55/720618955.db2.gz QXJAFYQDTRUSQT-NEPJUHHUSA-N 1 1 416.259 3.065 20 0 HGADMO Cc1nc(-c2ccncc2)cc(N2CC[C@@H]3[C@@H](C[C@H](Cn4cccn4)[N@@H+]3C(C)C)C2)n1 ZINC001164838159 720621820 /nfs/dbraw/zinc/62/18/20/720621820.db2.gz KCSMWCVSPKIPAN-QZNHQXDQSA-N 1 1 417.561 3.421 20 0 HGADMO FC(F)(c1ccnc(Cl)c1Cl)N1CC[N@@H+]2C[C@H](Oc3cncnc3)C[C@H]2C1 ZINC001164740313 720629720 /nfs/dbraw/zinc/62/97/20/720629720.db2.gz IMROQZFXLIMGRN-NWDGAFQWSA-N 1 1 416.259 3.065 20 0 HGADMO FC(F)(c1ccnc(Cl)c1Cl)N1CC[N@H+]2C[C@H](Oc3cncnc3)C[C@H]2C1 ZINC001164740313 720629734 /nfs/dbraw/zinc/62/97/34/720629734.db2.gz IMROQZFXLIMGRN-NWDGAFQWSA-N 1 1 416.259 3.065 20 0 HGADMO CSc1cc(N2CC[C@@H]3[C@H](C[C@H](Cn4cccn4)[N@H+]3C(C)C)C2)nc(SC)n1 ZINC001164839785 720644393 /nfs/dbraw/zinc/64/43/93/720644393.db2.gz KGUTXFWBLKKFLA-BRWVUGGUSA-N 1 1 418.636 3.495 20 0 HGADMO C[N@@H+](Cc1ccccc1)[C@H]1COC2(C1)CCN(c1cc(C(N)=O)cc(Cl)n1)CC2 ZINC001164838184 720663417 /nfs/dbraw/zinc/66/34/17/720663417.db2.gz GDBQVUQFXGZCHB-GOSISDBHSA-N 1 1 414.937 3.094 20 0 HGADMO C[N@@H+](Cc1ccccc1)[C@H]1COC2(C1)CCN(c1nc(Cl)nc(Cl)n1)CC2 ZINC001164844457 720676380 /nfs/dbraw/zinc/67/63/80/720676380.db2.gz SDHBJNNQQRDUDB-OAHLLOKOSA-N 1 1 408.333 3.438 20 0 HGADMO Cc1cn(-c2ccc(N3CCC4(C[C@@H]([N@@H+](C)Cc5ccccc5)CO4)CC3)nn2)cn1 ZINC001164839358 720702540 /nfs/dbraw/zinc/70/25/40/720702540.db2.gz LKOKGFTWRQBLBQ-OAQYLSRUSA-N 1 1 418.545 3.231 20 0 HGADMO Clc1cnc(Cl)c(N2CC[N@@H+]3C[C@H](Oc4cncnc4)C[C@@H]3C2)c1Cl ZINC001164736829 720705583 /nfs/dbraw/zinc/70/55/83/720705583.db2.gz BKZRKMSQUFPIIC-GHMZBOCLSA-N 1 1 400.697 3.174 20 0 HGADMO Clc1cnc(Cl)c(N2CC[N@H+]3C[C@H](Oc4cncnc4)C[C@@H]3C2)c1Cl ZINC001164736829 720705589 /nfs/dbraw/zinc/70/55/89/720705589.db2.gz BKZRKMSQUFPIIC-GHMZBOCLSA-N 1 1 400.697 3.174 20 0 HGADMO CCCNC(=O)c1cccnc1N1CCC2(C[C@H]([N@@H+](C)Cc3ccccc3)CO2)CC1 ZINC001164837685 720712110 /nfs/dbraw/zinc/71/21/10/720712110.db2.gz GNCMWWMAZQXDJG-NRFANRHFSA-N 1 1 422.573 3.481 20 0 HGADMO CC(C)(C)c1cc(N2CC[N@H+]3C[C@H](Oc4cncnc4)C[C@@H]3C2)nc(C(C)(C)C)n1 ZINC001164737239 720755610 /nfs/dbraw/zinc/75/56/10/720755610.db2.gz BGXXWHTZJITIKF-IAGOWNOFSA-N 1 1 410.566 3.204 20 0 HGADMO Cc1nc2sc3c(c2c(N2CC[N@H+]4C[C@H](Oc5cncnc5)C[C@@H]4C2)n1)CCCC3 ZINC001164738500 720756076 /nfs/dbraw/zinc/75/60/76/720756076.db2.gz FVDMPTPZSDMJMA-HZPDHXFCSA-N 1 1 422.558 3.010 20 0 HGADMO Clc1cnc(N2CC[C@@H]3[C@@H](C[C@H](Cn4cncn4)[N@H+]3CC3CC3)C2)c(Cl)c1 ZINC001164748310 720810921 /nfs/dbraw/zinc/81/09/21/720810921.db2.gz QQGGKTVPXXGHHL-YXJHDRRASA-N 1 1 407.349 3.359 20 0 HGADMO Clc1ccc2ncnc(N3CC[C@@H]4[C@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)c2c1 ZINC001164743983 720817004 /nfs/dbraw/zinc/81/70/04/720817004.db2.gz SWDYZDOPVLPRBB-PLMTUMEDSA-N 1 1 423.952 3.254 20 0 HGADMO CC(C)(c1ccnc(Cl)c1)[N@H+]1C[C@@H]2COC[C@]2(C(=O)NCCc2ccccc2)C1 ZINC001164853652 720817569 /nfs/dbraw/zinc/81/75/69/720817569.db2.gz RJVPNNQDSITKAF-AUSIDOKSSA-N 1 1 413.949 3.277 20 0 HGADMO CC(C)(c1ccnc(Cl)c1)[N@H+]1C[C@H]2COC[C@]2(C(=O)NCCc2ccccc2)C1 ZINC001164853654 720817726 /nfs/dbraw/zinc/81/77/26/720817726.db2.gz RJVPNNQDSITKAF-WMZHIEFXSA-N 1 1 413.949 3.277 20 0 HGADMO Clc1cc2[nH]ccc2c(N2CC[C@@H]3[C@H](C[C@H](Cn4cncn4)[N@H+]3CC3CC3)C2)n1 ZINC001164737411 720817921 /nfs/dbraw/zinc/81/79/21/720817921.db2.gz AYGZGFSVJBAAMF-GPMSIDNRSA-N 1 1 411.941 3.187 20 0 HGADMO Fc1ccc2nc(N3CC[C@@H]4[C@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)ccc2c1 ZINC001164744449 720824374 /nfs/dbraw/zinc/82/43/74/720824374.db2.gz UGFTVTGNNCDOOT-SYYKKAFVSA-N 1 1 406.509 3.345 20 0 HGADMO Clc1cc(N2CC[C@@H]3[C@H](C[C@@H](Cn4cncn4)[N@H+]3CC3CC3)C2)c2cccnc2n1 ZINC001164737725 720825260 /nfs/dbraw/zinc/82/52/60/720825260.db2.gz CGXNJWBZJHUPRB-ZIFCJYIRSA-N 1 1 423.952 3.254 20 0 HGADMO Clc1cnc2nc(N3CC[C@@H]4[C@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)ccc2c1 ZINC001164740310 720825806 /nfs/dbraw/zinc/82/58/06/720825806.db2.gz KDHLVHYENXDDPA-MISYRCLQSA-N 1 1 423.952 3.254 20 0 HGADMO CC(C)(C)Oc1cccc(N2CC[C@@H]3[C@@H](C[C@H](Cn4cncn4)[N@H+]3CC3CC3)C2)n1 ZINC001164740471 720834218 /nfs/dbraw/zinc/83/42/18/720834218.db2.gz BWRUSSPGIVIRKE-XUVXKRRUSA-N 1 1 410.566 3.230 20 0 HGADMO COc1ccc2ccnc(N3CC[C@@H]4[C@@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)c2c1 ZINC001164741152 720841253 /nfs/dbraw/zinc/84/12/53/720841253.db2.gz DLMMKNISAILCOA-MIZPHKNDSA-N 1 1 418.545 3.214 20 0 HGADMO CC(C)COc1cccc(N2CC[C@@H]3[C@@H](C[C@H](Cn4cncn4)[N@H+]3CC3CC3)C2)n1 ZINC001164748922 720841799 /nfs/dbraw/zinc/84/17/99/720841799.db2.gz VCZCTHRGDJUCDR-PWRODBHTSA-N 1 1 410.566 3.087 20 0 HGADMO COCC[N@H+]1CCO[C@H]2CN(c3nc(-c4ccccc4)nc4ccccc43)CC[C@@H]2C1 ZINC001164853212 720849767 /nfs/dbraw/zinc/84/97/67/720849767.db2.gz NBONUUIWPCIXLP-OFNKIYASSA-N 1 1 418.541 3.470 20 0 HGADMO Fc1ccc2cc(N3CC[C@@H]4[C@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)ncc2c1 ZINC001164749570 720850295 /nfs/dbraw/zinc/85/02/95/720850295.db2.gz WELZPMATJQDJFZ-CEMLEFRQSA-N 1 1 406.509 3.345 20 0 HGADMO c1ncn(C[C@H]2C[C@H]3CN(c4nccc5c6c([nH]c54)CCC6)CC[C@H]3[N@H+]2CC2CC2)n1 ZINC001164753870 720857861 /nfs/dbraw/zinc/85/78/61/720857861.db2.gz YUWJZZIGOPYDQE-NJNPRVFISA-N 1 1 417.561 3.023 20 0 HGADMO COCC[N@H+]1CCO[C@@H]2CN(c3nc4cc(C)c(C)cc4nc3Cl)CC[C@H]2C1 ZINC001164853519 720864099 /nfs/dbraw/zinc/86/40/99/720864099.db2.gz GVVPICRSWYSWTF-QFBILLFUSA-N 1 1 404.942 3.074 20 0 HGADMO COCC[N@H+]1CCO[C@@H]2CN(c3cc(Cl)nc(-c4ccc(F)cc4)n3)CC[C@@H]2C1 ZINC001164860540 720880814 /nfs/dbraw/zinc/88/08/14/720880814.db2.gz OURLDEMNHZIMBW-SJLPKXTDSA-N 1 1 420.916 3.110 20 0 HGADMO COCC[N@H+]1CCO[C@H]2CN(c3cc(-c4ccc(Cl)nn4)ccc3F)CC[C@@H]2C1 ZINC001164859962 720881255 /nfs/dbraw/zinc/88/12/55/720881255.db2.gz NKKCNBDPBXPBAU-UZLBHIALSA-N 1 1 420.916 3.110 20 0 HGADMO CCc1cc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COCc2cccnc2)nc(C)n1 ZINC001164755920 720897540 /nfs/dbraw/zinc/89/75/40/720897540.db2.gz NFSIOQBUNMEOHB-RCZVLFRGSA-N 1 1 421.589 3.498 20 0 HGADMO CCc1nc(C)cc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COCc2cccnc2)n1 ZINC001164752212 720912333 /nfs/dbraw/zinc/91/23/33/720912333.db2.gz NOBWZPMLPCDHDA-WIOPSUGQSA-N 1 1 421.589 3.498 20 0 HGADMO COc1nc(-c2ccccc2)nc(N2CCn3c(C[N@@H+](C)C(C)C)cnc3[C@@H]2C)n1 ZINC001164861630 720975375 /nfs/dbraw/zinc/97/53/75/720975375.db2.gz QBDCPTTZGFMEIS-INIZCTEOSA-N 1 1 407.522 3.165 20 0 HGADMO CCOC(=O)c1cnc2cc(N3CCn4c(C[N@H+](C)C(C)C)cnc4[C@H]3C)[nH]cc1-2 ZINC001164856360 720997247 /nfs/dbraw/zinc/99/72/47/720997247.db2.gz BWFHWKBSEBWUMP-OAHLLOKOSA-N 1 1 410.522 3.358 20 0 HGADMO CCOC(=O)c1cnc2cc(N3CCn4c(C[N@@H+](C)C(C)C)cnc4[C@H]3C)[nH]cc1-2 ZINC001164856360 720997253 /nfs/dbraw/zinc/99/72/53/720997253.db2.gz BWFHWKBSEBWUMP-OAHLLOKOSA-N 1 1 410.522 3.358 20 0 HGADMO CCOC(=O)c1c[nH]c2cc(N3CCn4c(CN(C)C(C)C)cnc4[C@H]3C)[nH+]cc21 ZINC001164856360 720997257 /nfs/dbraw/zinc/99/72/57/720997257.db2.gz BWFHWKBSEBWUMP-OAHLLOKOSA-N 1 1 410.522 3.358 20 0 HGADMO FC(F)(c1cc(Cl)nc2c1CCC2)N1CCc2[nH+]cc(Cn3cccn3)n2CC1 ZINC001164861371 721034680 /nfs/dbraw/zinc/03/46/80/721034680.db2.gz HENSGRUKHOVOCP-UHFFFAOYSA-N 1 1 418.879 3.273 20 0 HGADMO FC(F)(Oc1ccc(Cl)nc1)N1CC[N@H+]2C[C@H](OCc3cccnc3)C[C@H]2C1 ZINC001164865863 721070094 /nfs/dbraw/zinc/07/00/94/721070094.db2.gz AUDRZTGCGYQQFK-DOTOQJQBSA-N 1 1 410.852 3.034 20 0 HGADMO COc1ccc(C(F)(F)N2CC[N@H+]3C[C@H](OCc4cccnc4)C[C@H]3C2)c(Cl)n1 ZINC001164865405 721084155 /nfs/dbraw/zinc/08/41/55/721084155.db2.gz LBUVSBOMRHZPIB-JKSUJKDBSA-N 1 1 424.879 3.163 20 0 HGADMO Fc1ccc(Cl)nc1C(F)(F)N1CC[N@H+]2C[C@H](OCc3cccnc3)C[C@@H]2C1 ZINC001164864057 721084710 /nfs/dbraw/zinc/08/47/10/721084710.db2.gz DSUHZOQAMQHPLQ-HUUCEWRRSA-N 1 1 412.843 3.294 20 0 HGADMO CCc1c(Cl)nnc(N2CC[N@H+]3C[C@@H](OCc4cccnc4)C[C@@H]3C2)c1CC ZINC001164865765 721092395 /nfs/dbraw/zinc/09/23/95/721092395.db2.gz PHDKRSVTTQTSCM-SJORKVTESA-N 1 1 401.942 3.130 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(C(F)(F)c4nc(Cl)ncc4Cl)C[C@@H]3C2)cn1 ZINC001164765630 721096582 /nfs/dbraw/zinc/09/65/82/721096582.db2.gz JEZLCKWXRHWKAS-STQMWFEESA-N 1 1 417.291 3.020 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4cc(-c5ccnc(Cl)c5)ccn4)C[C@H]3C2)cn1 ZINC001164770465 721096638 /nfs/dbraw/zinc/09/66/38/721096638.db2.gz QMALDHGQJDWABB-WOJBJXKFSA-N 1 1 408.937 3.489 20 0 HGADMO CSc1nc2ccccc2c(N2CC[N@H+]3C[C@H](OCc4cccnc4)C[C@H]3C2)n1 ZINC001164867333 721097153 /nfs/dbraw/zinc/09/71/53/721097153.db2.gz XXWBRTXRZYZZIP-ZWKOTPCHSA-N 1 1 407.543 3.226 20 0 HGADMO COc1ccc(C(F)(F)N2CC[N@H+]3C[C@@H](OCc4cccnc4)C[C@@H]3C2)nc1Cl ZINC001164863690 721099845 /nfs/dbraw/zinc/09/98/45/721099845.db2.gz CZIOHTXYJYXUQL-CVEARBPZSA-N 1 1 424.879 3.163 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4nc5cc(F)c(F)cc5nc4Cl)C[C@@H]3C2)cn1 ZINC001164769016 721114309 /nfs/dbraw/zinc/11/43/09/721114309.db2.gz OUCFRDLULAWAEN-KBPBESRZSA-N 1 1 418.879 3.253 20 0 HGADMO Cc1cccc2nc(Cl)nc(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@H]4C3)c12 ZINC001164866633 721118930 /nfs/dbraw/zinc/11/89/30/721118930.db2.gz UHQLXNZVJXZOKX-ZWKOTPCHSA-N 1 1 409.921 3.466 20 0 HGADMO Cc1ccc(-c2ccc(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@@H]4C3)nn2)cc1 ZINC001164880443 721138688 /nfs/dbraw/zinc/13/86/88/721138688.db2.gz WRVPPKWPIFZYTK-FGZHOGPDSA-N 1 1 401.514 3.327 20 0 HGADMO c1cncc(CO[C@@H]2C[C@H]3CN(c4ncnc5sc6c(c54)CCC6)CC[N@H+]3C2)c1 ZINC001164876436 721140632 /nfs/dbraw/zinc/14/06/32/721140632.db2.gz MLDVJRXKMUXIGJ-DLBZAZTESA-N 1 1 407.543 3.055 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4ncnc5c4ccn5C4CCCC4)C[C@@H]3C2)cn1 ZINC001164771343 721143349 /nfs/dbraw/zinc/14/33/49/721143349.db2.gz SGJFEEGYZVNDSB-OALUTQOASA-N 1 1 405.550 3.238 20 0 HGADMO Fc1cc2ncc(Cl)nc2cc1N1CC[N@H+]2C[C@@H](OCc3cccnc3)C[C@H]2C1 ZINC001164877062 721158815 /nfs/dbraw/zinc/15/88/15/721158815.db2.gz OQTCUZQDXLRMBP-HOTGVXAUSA-N 1 1 413.884 3.297 20 0 HGADMO CCc1nc(Cl)c(N2CC[N@@H+]3C[C@H](OCc4cccnc4)C[C@H]3C2)c(Cl)n1 ZINC001164871568 721159682 /nfs/dbraw/zinc/15/96/82/721159682.db2.gz FLJULTQRZVKRRL-LSDHHAIUSA-N 1 1 408.333 3.221 20 0 HGADMO CCc1nc(Cl)c(N2CC[N@H+]3C[C@H](OCc4cccnc4)C[C@H]3C2)c(Cl)n1 ZINC001164871568 721159691 /nfs/dbraw/zinc/15/96/91/721159691.db2.gz FLJULTQRZVKRRL-LSDHHAIUSA-N 1 1 408.333 3.221 20 0 HGADMO Fc1ccc2c(Cl)nnc(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@H]4C3)c2c1 ZINC001164878984 721169459 /nfs/dbraw/zinc/16/94/59/721169459.db2.gz RDHUHKQGKVBLLR-IRXDYDNUSA-N 1 1 413.884 3.297 20 0 HGADMO Cc1c(Cl)nc(C(C)C)nc1N1CC[N@H+]2C[C@H](OCc3cccnc3)C[C@H]2C1 ZINC001164871552 721180604 /nfs/dbraw/zinc/18/06/04/721180604.db2.gz FGOJKLLZSYCADL-ZWKOTPCHSA-N 1 1 401.942 3.437 20 0 HGADMO c1cc2c(nc(C3CCC3)nc2N2CC[N@H+]3C[C@H](OCc4cccnc4)C[C@H]3C2)[nH]1 ZINC001164866779 721196725 /nfs/dbraw/zinc/19/67/25/721196725.db2.gz CWLAKOYSROGSCH-RBUKOAKNSA-N 1 1 404.518 3.100 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4ncc(Cl)nc4-c4ccccc4)C[C@H]3C2)cn1 ZINC001164772373 721215932 /nfs/dbraw/zinc/21/59/32/721215932.db2.gz TXSUEOUSTIEUHJ-RTBURBONSA-N 1 1 408.937 3.489 20 0 HGADMO Cc1cc(OCc2ccccc2)nc(N2C[C@@H]3CC[N@H+](Cc4cnn(C)c4)C[C@@H]3C2)n1 ZINC001164767243 721228964 /nfs/dbraw/zinc/22/89/64/721228964.db2.gz WMDITDSAIXENFQ-FCHUYYIVSA-N 1 1 418.545 3.056 20 0 HGADMO Cc1cc(N2C[C@H]3CC[N@H+](Cc4cnn(C)c4)C[C@@H]3C2)nc(-c2ccc(Cl)nc2)n1 ZINC001164763913 721231024 /nfs/dbraw/zinc/23/10/24/721231024.db2.gz OBBANONZPVRUPC-RTBURBONSA-N 1 1 423.952 3.192 20 0 HGADMO Cc1cnc(N2C[C@H]3CC[N@H+](Cc4cnn(C)c4)C[C@@H]3C2)nc1-c1ccccc1F ZINC001164762516 721239105 /nfs/dbraw/zinc/23/91/05/721239105.db2.gz LASHFJIZMPGZBA-RTBURBONSA-N 1 1 406.509 3.283 20 0 HGADMO C[C@H]1c2ncc(COCC3CC3)n2CCN1c1cc(OC2CC[NH+](C)CC2)ccn1 ZINC001164872004 721243562 /nfs/dbraw/zinc/24/35/62/721243562.db2.gz JMWLOSIOFVSTIE-KRWDZBQOSA-N 1 1 411.550 3.259 20 0 HGADMO C[C@@H]1c2ncc(COCC3CC3)n2CCN1c1cc(OC2CC[NH+](C)CC2)ccn1 ZINC001164872006 721244049 /nfs/dbraw/zinc/24/40/49/721244049.db2.gz JMWLOSIOFVSTIE-QGZVFWFLSA-N 1 1 411.550 3.259 20 0 HGADMO Clc1nc2c(ncn2[C@H]2CCCCO2)c(N2CC3(C2)CC[N@@H+](CC2CC2)C3)n1 ZINC001164772041 721288084 /nfs/dbraw/zinc/28/80/84/721288084.db2.gz CVHAOUPIWZRGIZ-OAHLLOKOSA-N 1 1 402.930 3.101 20 0 HGADMO COC(OC)c1ccc(NC(=O)C(C)(C)C)c(N2CC3(C2)CC[N@@H+](CC2CC2)C3)n1 ZINC001164770298 721294213 /nfs/dbraw/zinc/29/42/13/721294213.db2.gz QUPCXPSLAQKJPD-UHFFFAOYSA-N 1 1 416.566 3.280 20 0 HGADMO C[NH+]1CCC(Oc2ccnc(N3CCC4(CC3)C(=O)NC[C@H]4c3ccccc3)c2)CC1 ZINC001164877980 721319104 /nfs/dbraw/zinc/31/91/04/721319104.db2.gz MAINITQLTXZNDR-QFIPXVFZSA-N 1 1 420.557 3.055 20 0 HGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@]2(CCCN(c3cnc4ccccc4n3)C2)C1 ZINC001164777593 721335907 /nfs/dbraw/zinc/33/59/07/721335907.db2.gz OJAYOISPADNWTM-HSZRJFAPSA-N 1 1 407.518 3.354 20 0 HGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@]2(CCCN(c3cnc4ccccc4n3)C2)C1 ZINC001164777593 721335912 /nfs/dbraw/zinc/33/59/12/721335912.db2.gz OJAYOISPADNWTM-HSZRJFAPSA-N 1 1 407.518 3.354 20 0 HGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@@]2(CCCN(c3ccc4cccnc4n3)C2)C1 ZINC001164777312 721347282 /nfs/dbraw/zinc/34/72/82/721347282.db2.gz FZBALCFTVFQVIU-QHCPKHFHSA-N 1 1 407.518 3.354 20 0 HGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@]2(CCCN(c3nccc(C(F)F)n3)C2)C1 ZINC001164780033 721363307 /nfs/dbraw/zinc/36/33/07/721363307.db2.gz CMCOBPGPISHIKB-HXUWFJFHSA-N 1 1 407.465 3.138 20 0 HGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@]2(CCCN(c3nccc(C(F)F)n3)C2)C1 ZINC001164780033 721363310 /nfs/dbraw/zinc/36/33/10/721363310.db2.gz CMCOBPGPISHIKB-HXUWFJFHSA-N 1 1 407.465 3.138 20 0 HGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2C[C@H]3OCC(=O)N(c4cccc(F)c4)[C@H]3C2)nc1 ZINC001164883224 721367208 /nfs/dbraw/zinc/36/72/08/721367208.db2.gz OINAEMDOLVWHND-BHIFYINESA-N 1 1 424.520 3.388 20 0 HGADMO CCOc1cccnc1N1CCC[C@@]2(C1)COCC[N@H+](Cc1c(C)noc1C)C2 ZINC001164780257 721372551 /nfs/dbraw/zinc/37/25/51/721372551.db2.gz DVXQEMMCJZDCFA-JOCHJYFZSA-N 1 1 400.523 3.204 20 0 HGADMO CCOc1cccnc1N1CCC[C@@]2(C1)COCC[N@@H+](Cc1c(C)noc1C)C2 ZINC001164780257 721372556 /nfs/dbraw/zinc/37/25/56/721372556.db2.gz DVXQEMMCJZDCFA-JOCHJYFZSA-N 1 1 400.523 3.204 20 0 HGADMO Cc1sc2ncnc(N3CC[C@]4(C3)CCC[C@H](CN3CC[NH+](C)CC3)O4)c2c1C ZINC001164887431 721388909 /nfs/dbraw/zinc/38/89/09/721388909.db2.gz ICIFTOZNAAXXGS-GCJKJVERSA-N 1 1 415.607 3.074 20 0 HGADMO C[NH+]1CCN(C[C@H]2CCC[C@@]3(CCN(c4nccc(Oc5ccccc5)n4)C3)O2)CC1 ZINC001164884308 721396377 /nfs/dbraw/zinc/39/63/77/721396377.db2.gz AAKPIFLSEWYCTQ-QPPBQGQZSA-N 1 1 423.561 3.034 20 0 HGADMO CSc1cc(Cl)ncc1N1CC[C@@]2(C1)CCC[C@@H](CN1CC[NH+](C)CC1)O2 ZINC001164885230 721403763 /nfs/dbraw/zinc/40/37/63/721403763.db2.gz GIUCPGWHHDAIRZ-OXJNMPFZSA-N 1 1 411.015 3.222 20 0 HGADMO C[NH+]1CCN(C[C@H]2CCC[C@]3(CCN(c4cc(Cl)nc5ncccc45)C3)O2)CC1 ZINC001164883640 721406026 /nfs/dbraw/zinc/40/60/26/721406026.db2.gz BOVPFPHBAYSCDK-VGOFRKELSA-N 1 1 415.969 3.049 20 0 HGADMO COc1cccc2nc(Cl)nc(N3C[C@@H]4C[N@@H+](Cc5nccs5)C[C@@H]4C3)c21 ZINC001164780572 721413164 /nfs/dbraw/zinc/41/31/64/721413164.db2.gz BFPBGLVIKWYIRQ-BETUJISGSA-N 1 1 401.923 3.317 20 0 HGADMO COc1cccc2nc(Cl)nc(N3C[C@@H]4C[N@H+](Cc5nccs5)C[C@@H]4C3)c21 ZINC001164780572 721413168 /nfs/dbraw/zinc/41/31/68/721413168.db2.gz BFPBGLVIKWYIRQ-BETUJISGSA-N 1 1 401.923 3.317 20 0 HGADMO CC(C)(C)c1noc(-c2ccnc(N3C[C@@H]4C[N@@H+](Cc5nccs5)C[C@@H]4C3)c2)n1 ZINC001164785591 721422235 /nfs/dbraw/zinc/42/22/35/721422235.db2.gz NKVXEZYOQSAWOB-IYBDPMFKSA-N 1 1 410.547 3.454 20 0 HGADMO CC(C)(C)c1noc(-c2ccnc(N3C[C@@H]4C[N@H+](Cc5nccs5)C[C@@H]4C3)c2)n1 ZINC001164785591 721422237 /nfs/dbraw/zinc/42/22/37/721422237.db2.gz NKVXEZYOQSAWOB-IYBDPMFKSA-N 1 1 410.547 3.454 20 0 HGADMO FC(F)(Cc1nc(Cl)cc(Cl)n1)N1C[C@H]2C[NH+](Cc3nccs3)C[C@@H]2C1 ZINC001164787324 721422426 /nfs/dbraw/zinc/42/24/26/721422426.db2.gz QFKCNYIQNPPSCQ-GHMZBOCLSA-N 1 1 420.316 3.439 20 0 HGADMO c1csc(C[N@H+]2C[C@H]3CN(c4nc5ccccc5nc4N4CCCC4)C[C@H]3C2)n1 ZINC001164782064 721424223 /nfs/dbraw/zinc/42/42/23/721424223.db2.gz FPABSWXUWDBJSL-CALCHBBNSA-N 1 1 406.559 3.255 20 0 HGADMO c1csc(C[N@@H+]2C[C@H]3CN(c4nc5ccccc5nc4N4CCCC4)C[C@H]3C2)n1 ZINC001164782064 721424226 /nfs/dbraw/zinc/42/42/26/721424226.db2.gz FPABSWXUWDBJSL-CALCHBBNSA-N 1 1 406.559 3.255 20 0 HGADMO c1csc(C[NH+]2C[C@@H]3CN(c4nc5ccccc5nc4N4CCCC4)C[C@H]3C2)n1 ZINC001164782066 721424450 /nfs/dbraw/zinc/42/44/50/721424450.db2.gz FPABSWXUWDBJSL-IAGOWNOFSA-N 1 1 406.559 3.255 20 0 HGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1cc(Cl)nc(C)n1)CC2 ZINC001164789421 721447941 /nfs/dbraw/zinc/44/79/41/721447941.db2.gz VVXQSLXYCXTTSY-SFHVURJKSA-N 1 1 408.974 3.172 20 0 HGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1ncc(Cl)c(C)n1)CC2 ZINC001164790352 721454112 /nfs/dbraw/zinc/45/41/12/721454112.db2.gz YNSHWDRJAXHRLF-GOSISDBHSA-N 1 1 408.974 3.172 20 0 HGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1nc(C)ccc1OC)CC2 ZINC001164783300 721458943 /nfs/dbraw/zinc/45/89/43/721458943.db2.gz DEOQNHBLVCHATH-FQEVSTJZSA-N 1 1 403.567 3.133 20 0 HGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1ncnc3cc(C)[nH]c31)CC2 ZINC001164784638 721461969 /nfs/dbraw/zinc/46/19/69/721461969.db2.gz JBIXTNKDGBTAIV-IBGZPJMESA-N 1 1 413.566 3.000 20 0 HGADMO CCCc1cc(N2CCC3(C[C@@H](COCC4CC4)[N@@H+](CCOC)C3)CC2)nc(C)n1 ZINC001164784142 721463127 /nfs/dbraw/zinc/46/31/27/721463127.db2.gz GZOBZNMCCMLCQO-QFIPXVFZSA-N 1 1 416.610 3.471 20 0 HGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1ccc(Cl)c(OC)n1)CC2 ZINC001164784421 721464168 /nfs/dbraw/zinc/46/41/68/721464168.db2.gz HVFXKNQWZILRMG-SFHVURJKSA-N 1 1 423.985 3.478 20 0 HGADMO C[C@@H]1CC(=O)Nc2ncnc(N3CCC4(CC([N@@H+](C)Cc5ccncc5)C4)CC3)c21 ZINC001164792207 721495976 /nfs/dbraw/zinc/49/59/76/721495976.db2.gz KGYMAPLBAKDIND-MRXNPFEDSA-N 1 1 406.534 3.198 20 0 HGADMO COC(=O)c1ccc(Cl)nc1N1CC[N@H+]2C[C@@H](Oc3cccc(F)c3)C[C@@H]2C1 ZINC001164901712 721510207 /nfs/dbraw/zinc/51/02/07/721510207.db2.gz YDTBOJGHHCMLOC-ZBFHGGJFSA-N 1 1 405.857 3.003 20 0 HGADMO COC(=O)c1ccc(Cl)nc1N1CC[N@H+]2C[C@H](Oc3cccc(F)c3)C[C@@H]2C1 ZINC001164901708 721510441 /nfs/dbraw/zinc/51/04/41/721510441.db2.gz YDTBOJGHHCMLOC-GDBMZVCRSA-N 1 1 405.857 3.003 20 0 HGADMO COc1cc2ncnc(N3CC[N@H+]4C[C@H](Oc5cccc(F)c5)C[C@H]4C3)c2cc1OC ZINC001164900991 721519292 /nfs/dbraw/zinc/51/92/92/721519292.db2.gz VLUKZVTXLUJMKL-FUHWJXTLSA-N 1 1 424.476 3.128 20 0 HGADMO COC(=O)c1nc(N2CC[N@H+]3C[C@@H](Oc4cccc(F)c4)C[C@@H]3C2)ccc1Cl ZINC001164906364 721531580 /nfs/dbraw/zinc/53/15/80/721531580.db2.gz KDDJYQZDBFGJLH-ZBFHGGJFSA-N 1 1 405.857 3.003 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2cc(C(=O)OC(C)(C)C)ccn2)[C@@H]2CCCO[C@H]12 ZINC001164807758 721535195 /nfs/dbraw/zinc/53/51/95/721535195.db2.gz RCPTUJDRURRIGY-SJBKTWHCSA-N 1 1 424.545 3.300 20 0 HGADMO Fc1cccc(O[C@H]2C[C@H]3CN(c4nc(Cl)nc5ncsc54)CC[N@H+]3C2)c1 ZINC001164908607 721536135 /nfs/dbraw/zinc/53/61/35/721536135.db2.gz PUODREVGXFWMMC-JSGCOSHPSA-N 1 1 405.886 3.221 20 0 HGADMO Nc1cc(Cl)nc(C(F)(F)N2CC[N@H+]3C[C@H](Oc4cccc(F)c4)C[C@H]3C2)c1 ZINC001164906390 721539853 /nfs/dbraw/zinc/53/98/53/721539853.db2.gz KJKXONDGZZDMOP-GOEBONIOSA-N 1 1 412.843 3.343 20 0 HGADMO CCOC(=O)c1c(C)cc(N2CC[N@H+]3C[C@H](Oc4cccc(F)c4)C[C@H]3C2)nc1C ZINC001164909739 721540500 /nfs/dbraw/zinc/54/05/00/721540500.db2.gz RSSLAYONYNGFFI-AZUAARDMSA-N 1 1 413.493 3.356 20 0 HGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(C(F)(F)Oc2ccc(Cl)nc2)[C@@H]2CCCO[C@H]12 ZINC001164809539 721542566 /nfs/dbraw/zinc/54/25/66/721542566.db2.gz VIXWAWYCARLLMV-LMMKCTJWSA-N 1 1 424.879 3.423 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(C(F)(F)Oc2ccc(Cl)nc2)[C@@H]2CCCO[C@H]12 ZINC001164809539 721542568 /nfs/dbraw/zinc/54/25/68/721542568.db2.gz VIXWAWYCARLLMV-LMMKCTJWSA-N 1 1 424.879 3.423 20 0 HGADMO CC1CCN(c2ccc(N3CC[N@H+]4C[C@H](Oc5cccc(F)c5)C[C@H]4C3)nn2)CC1 ZINC001164911662 721554919 /nfs/dbraw/zinc/55/49/19/721554919.db2.gz ZKJCFWBXWLRIKU-PZJWPPBQSA-N 1 1 411.525 3.194 20 0 HGADMO Fc1cccc(O[C@H]2C[C@@H]3CN(c4ncnc(-c5cccc(F)c5)n4)CC[N@H+]3C2)c1 ZINC001164903524 721557289 /nfs/dbraw/zinc/55/72/89/721557289.db2.gz BZMQVKNGENSJJA-QUCCMNQESA-N 1 1 409.440 3.159 20 0 HGADMO COC(=O)c1cc(Cl)c(N2CC[N@H+]3C[C@@H](Oc4cccc(F)c4)C[C@H]3C2)nc1C ZINC001164907562 721564460 /nfs/dbraw/zinc/56/44/60/721564460.db2.gz OLTOQGGEBWCJKN-RDJZCZTQSA-N 1 1 419.884 3.311 20 0 HGADMO CSc1cc(N2CC[N@H+]3C[C@H](Oc4cccc(F)c4)C[C@H]3C2)nc(SC)n1 ZINC001164907226 721566456 /nfs/dbraw/zinc/56/64/56/721566456.db2.gz MWLAYWIKSNVDQC-GOEBONIOSA-N 1 1 406.552 3.401 20 0 HGADMO CSc1ncc(Cl)nc1N1C[C@H]([N@H+](C)Cc2cccnc2)[C@@H]2OCCC[C@@H]21 ZINC001164798608 721573696 /nfs/dbraw/zinc/57/36/96/721573696.db2.gz BOXMYXBWEQVYID-YQQAZPJKSA-N 1 1 405.955 3.115 20 0 HGADMO CSc1ncc(Cl)nc1N1C[C@H]([N@@H+](C)Cc2cccnc2)[C@@H]2OCCC[C@@H]21 ZINC001164798608 721573698 /nfs/dbraw/zinc/57/36/98/721573698.db2.gz BOXMYXBWEQVYID-YQQAZPJKSA-N 1 1 405.955 3.115 20 0 HGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2ncnc3sc4c(c32)CCC4)[C@H]2CCCO[C@@H]12 ZINC001164798576 721576088 /nfs/dbraw/zinc/57/60/88/721576088.db2.gz BLMZCXOITRYDOC-WAOWUJCRSA-N 1 1 421.570 3.443 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2ncnc3sc4c(c32)CCC4)[C@H]2CCCO[C@@H]12 ZINC001164798576 721576090 /nfs/dbraw/zinc/57/60/90/721576090.db2.gz BLMZCXOITRYDOC-WAOWUJCRSA-N 1 1 421.570 3.443 20 0 HGADMO Cc1cc(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@H]32)nc(-c2ccccn2)n1 ZINC001164809838 721576414 /nfs/dbraw/zinc/57/64/14/721576414.db2.gz XMGDGDJFAFACQW-FUPPJEDESA-N 1 1 416.529 3.110 20 0 HGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2CCO[C@]3(CCCN(c4cnccn4)C3)C2)nc1 ZINC001164903408 721580735 /nfs/dbraw/zinc/58/07/35/721580735.db2.gz NENITASZZFGSGW-QPPBQGQZSA-N 1 1 422.577 3.294 20 0 HGADMO CCOC(=O)c1ccc(N2CCC(F)(F)[C@]3(CC[N@@H+](Cc4ccccn4)C3)C2)nc1 ZINC001164902204 721584030 /nfs/dbraw/zinc/58/40/30/721584030.db2.gz CVCXISNJNKNBOI-NRFANRHFSA-N 1 1 416.472 3.391 20 0 HGADMO COc1cnc(Cl)nc1N1CCC(F)(F)[C@]2(CC[N@@H+](Cc3ccccn3)C2)C1 ZINC001164906657 721584833 /nfs/dbraw/zinc/58/48/33/721584833.db2.gz OBAKEPBJKOYYJR-SFHVURJKSA-N 1 1 409.868 3.271 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2nc(C3CCC3)nc3[nH]ccc32)[C@H]2CCCO[C@H]12 ZINC001164802526 721591907 /nfs/dbraw/zinc/59/19/07/721591907.db2.gz GGVYOQJWIPSKAY-HBMCJLEFSA-N 1 1 418.545 3.489 20 0 HGADMO FC(F)Oc1cnc(N2CCC(F)(F)[C@@]3(CC[N@@H+](Cc4ccccn4)C3)C2)nc1 ZINC001164907631 721712446 /nfs/dbraw/zinc/71/24/46/721712446.db2.gz SCFYORZCSYSDBJ-GOSISDBHSA-N 1 1 411.403 3.211 20 0 HGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2CCCn3c(CN(C)C(C)C)nnc3C2)nc1 ZINC001165010353 721719647 /nfs/dbraw/zinc/71/96/47/721719647.db2.gz GKYUWWCPOUFKEB-HXUWFJFHSA-N 1 1 411.598 3.471 20 0 HGADMO CC(C)Oc1cncc(N2CCC(F)(F)[C@@]3(CC[N@@H+](Cc4ccccn4)C3)C2)n1 ZINC001164912206 721726175 /nfs/dbraw/zinc/72/61/75/721726175.db2.gz MVZPIWOMHZVQFO-HXUWFJFHSA-N 1 1 403.477 3.397 20 0 HGADMO Cc1cc(Cl)nc(C(F)(F)N2CCCC23CC[NH+](CC(=O)N(C)C)CC3)c1 ZINC001165010622 721740455 /nfs/dbraw/zinc/74/04/55/721740455.db2.gz HKCMUITUJPSMIG-UHFFFAOYSA-N 1 1 400.901 3.111 20 0 HGADMO C[N@H+](Cc1ccco1)Cc1cncc2c1CCN(c1cc(C(N)=O)c(Cl)cn1)C2 ZINC001164908370 721746718 /nfs/dbraw/zinc/74/67/18/721746718.db2.gz GWERQDQOGMKZJU-UHFFFAOYSA-N 1 1 411.893 3.017 20 0 HGADMO C[N@@H+](Cc1ccco1)Cc1cncc2c1CCN(c1cc(C(N)=O)c(Cl)cn1)C2 ZINC001164908370 721746720 /nfs/dbraw/zinc/74/67/20/721746720.db2.gz GWERQDQOGMKZJU-UHFFFAOYSA-N 1 1 411.893 3.017 20 0 HGADMO COc1cnc(N2C[C@@H]3CCC[C@@H]([N@@H+](C)Cc4ccccn4)[C@@H]3C2)nc1NC(C)C ZINC001165024452 721797753 /nfs/dbraw/zinc/79/77/53/721797753.db2.gz LBOFVLSYHXEEIF-DFQSSKMNSA-N 1 1 410.566 3.437 20 0 HGADMO C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@@H]2CN(c3nc(Cl)c(F)cc3C(N)=O)C[C@@H]21 ZINC001165018704 721806402 /nfs/dbraw/zinc/80/64/02/721806402.db2.gz BYBKQXWCAYJMSV-RPVQJOFSSA-N 1 1 417.916 3.105 20 0 HGADMO COC(=O)c1nc(Cl)cnc1N1C[C@@H]2CCC[C@@H]([N@@H+](C)Cc3ccccn3)[C@H]2C1 ZINC001165028981 721813711 /nfs/dbraw/zinc/81/37/11/721813711.db2.gz YJSXHGHXPIKXRN-BHYGNILZSA-N 1 1 415.925 3.049 20 0 HGADMO CNC(=O)c1nc(N2C[C@@H]3CCC[C@H]([N@@H+](C)Cc4ccccn4)[C@@H]3C2)ccc1Cl ZINC001165025508 721816845 /nfs/dbraw/zinc/81/68/45/721816845.db2.gz NCHZZYPMRJDXHW-WDYCEAGBSA-N 1 1 413.953 3.227 20 0 HGADMO C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@@H]2CN(c3nc(Cl)cc4c3CNC4=O)C[C@H]21 ZINC001165028992 721817258 /nfs/dbraw/zinc/81/72/58/721817258.db2.gz YLDNPMWITLWBQA-NIKGAXFTSA-N 1 1 411.937 3.110 20 0 HGADMO C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@H]2CN(c3ncc4ncnc(Cl)c4n3)C[C@@H]21 ZINC001165025510 721818693 /nfs/dbraw/zinc/81/86/93/721818693.db2.gz NCKBCHPIQQJJFL-QILLFSRXSA-N 1 1 409.925 3.205 20 0 HGADMO CON(C)C(=O)c1cc(C)cnc1N1C[C@@H]2CCC[C@H]([N@@H+](C)Cc3ccccn3)[C@H]2C1 ZINC001165023590 721819739 /nfs/dbraw/zinc/81/97/39/721819739.db2.gz ICNDTQNOARCCCW-NYVOZVTQSA-N 1 1 423.561 3.155 20 0 HGADMO C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@H]2CN(c3cc(N4CCSCC4)ncn3)C[C@H]21 ZINC001165025650 721828195 /nfs/dbraw/zinc/82/81/95/721828195.db2.gz NFDIDNQRUIJKDH-CEWLAPEOSA-N 1 1 424.618 3.162 20 0 HGADMO F[C@@H](Oc1cccc(-c2ccc(Cl)nn2)c1)N1CC[NH+](C[C@H]2CCCO2)CC1 ZINC001165043463 721921113 /nfs/dbraw/zinc/92/11/13/721921113.db2.gz KJVISTKPTAJIFE-YLJYHZDGSA-N 1 1 406.889 3.226 20 0 HGADMO O=C(NCc1ccccc1)c1cccnc1N1CC[NH+](CCOc2ccccc2)CC1 ZINC001165041886 721953645 /nfs/dbraw/zinc/95/36/45/721953645.db2.gz BAFKFERYZPJGJH-UHFFFAOYSA-N 1 1 416.525 3.213 20 0 HGADMO COc1cccc2c1ccnc2N1CCC2(CC1)C(=O)NCC[N@H+]2Cc1ccccc1 ZINC001164950554 721979741 /nfs/dbraw/zinc/97/97/41/721979741.db2.gz VXLUAJRXEPRSRU-UHFFFAOYSA-N 1 1 416.525 3.214 20 0 HGADMO COc1cccc2c1ccnc2N1CCC2(CC1)C(=O)NCC[N@@H+]2Cc1ccccc1 ZINC001164950554 721979744 /nfs/dbraw/zinc/97/97/44/721979744.db2.gz VXLUAJRXEPRSRU-UHFFFAOYSA-N 1 1 416.525 3.214 20 0 HGADMO C(c1nc2sc3c(c2c(N2CCC4(C2)OCCO4)n1)CCC3)[NH+]1CCCCC1 ZINC001165048612 721985452 /nfs/dbraw/zinc/98/54/52/721985452.db2.gz ZTQZFXSPAZLZOR-UHFFFAOYSA-N 1 1 400.548 3.119 20 0 HGADMO C(c1nc2sc3c(c2c(N2CCC4(C2)OCCO4)n1)CCCC3)[NH+]1CCCC1 ZINC001165047771 721985716 /nfs/dbraw/zinc/98/57/16/721985716.db2.gz PQGQFEIVJPFXMZ-UHFFFAOYSA-N 1 1 400.548 3.119 20 0 HGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2CC[C@]3(C2)C[C@@H](NC(=O)N(C)C)CCO3)nc1 ZINC001164954097 722011031 /nfs/dbraw/zinc/01/10/31/722011031.db2.gz IFKISUYRFHJCKC-MIZPHKNDSA-N 1 1 415.582 3.028 20 0 HGADMO COc1cc2nc(Cl)c(N3CC[NH+](CCc4ccccn4)CC3)nc2cc1OC ZINC001165055088 722013080 /nfs/dbraw/zinc/01/30/80/722013080.db2.gz CIQXSAYAEWGALV-UHFFFAOYSA-N 1 1 413.909 3.060 20 0 HGADMO CCOC(=O)c1cc(Cl)nnc1N1CCC2(CC[N@@H+](Cc3cccnc3)C2)CC1 ZINC001164953637 722015028 /nfs/dbraw/zinc/01/50/28/722015028.db2.gz WLGUQEARMCSSES-UHFFFAOYSA-N 1 1 415.925 3.194 20 0 HGADMO Clc1nnc(N2CCC3(CC2)COCC[N@@H+](Cc2ccncc2)C3)c2cnccc12 ZINC001164958900 722053369 /nfs/dbraw/zinc/05/33/69/722053369.db2.gz HQMMUPKKJDVMJZ-UHFFFAOYSA-N 1 1 424.936 3.192 20 0 HGADMO Clc1ccc2c(ncnc2N2CCC3(CC2)COCC[N@@H+](Cc2ccncc2)C3)n1 ZINC001164959447 722053495 /nfs/dbraw/zinc/05/34/95/722053495.db2.gz JLHKWAGSDXMWIK-UHFFFAOYSA-N 1 1 424.936 3.192 20 0 HGADMO Fc1ccc(Oc2ccc(Cl)nn2)c(N2C[C@@H]3C[N@H+](CC4CC4)C[C@H](C2)O3)c1 ZINC001164967223 722075500 /nfs/dbraw/zinc/07/55/00/722075500.db2.gz OIRTVIGDTJTTDC-IYBDPMFKSA-N 1 1 404.873 3.361 20 0 HGADMO c1cc(N2CCCCC2)ccc1-c1ccc(N2C[C@@H]3C[N@@H+](CC4CC4)C[C@H](C2)O3)nn1 ZINC001164968129 722076714 /nfs/dbraw/zinc/07/67/14/722076714.db2.gz RUUCIDYTPIVGPC-ZRZAMGCNSA-N 1 1 419.573 3.433 20 0 HGADMO FC(F)(c1cccc(Cl)n1)N1CC[C@@H]2C[N@@H+](Cc3cccnc3)CCO[C@@H]2C1 ZINC001164983407 722100771 /nfs/dbraw/zinc/10/07/71/722100771.db2.gz PYVPYQKCSVHCAO-IAGOWNOFSA-N 1 1 408.880 3.402 20 0 HGADMO Cc1cc(C(F)(F)N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)nc(Cl)n1 ZINC001164975000 722109589 /nfs/dbraw/zinc/10/95/89/722109589.db2.gz JEDBUHGQVQZAGQ-IRXDYDNUSA-N 1 1 423.895 3.106 20 0 HGADMO CCOc1cc(Cl)nc(N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)c1 ZINC001164981536 722114854 /nfs/dbraw/zinc/11/48/54/722114854.db2.gz ULVPKFUMFIWVRM-PKOBYXMFSA-N 1 1 402.926 3.256 20 0 HGADMO Clc1cccc2nc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)ncc12 ZINC001164975110 722123242 /nfs/dbraw/zinc/12/32/42/722123242.db2.gz JLCPAMYMXYSYAU-UWJYYQICSA-N 1 1 409.921 3.406 20 0 HGADMO Clc1ccnc2nc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)ccc12 ZINC001164977301 722125823 /nfs/dbraw/zinc/12/58/23/722125823.db2.gz MMTIRQRAWBTOFV-YLJYHZDGSA-N 1 1 409.921 3.406 20 0 HGADMO CCCN(CCC)c1cncc(N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)n1 ZINC001164983831 722131811 /nfs/dbraw/zinc/13/18/11/722131811.db2.gz VNEPVHRWHPIXTC-FCHUYYIVSA-N 1 1 424.593 3.225 20 0 HGADMO Clc1ccnc2ccc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)nc12 ZINC001164978085 722135911 /nfs/dbraw/zinc/13/59/11/722135911.db2.gz JQUUOAADWVJPOI-XLIONFOSSA-N 1 1 409.921 3.406 20 0 HGADMO c1csc(-c2cc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)ncn2)c1 ZINC001164983332 722145242 /nfs/dbraw/zinc/14/52/42/722145242.db2.gz UGSLUEZKVLDYQW-ICSRJNTNSA-N 1 1 407.543 3.327 20 0 HGADMO Cc1cc(N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)nc(-c2ccco2)n1 ZINC001164983862 722147543 /nfs/dbraw/zinc/14/75/43/722147543.db2.gz VWQMEYOWTNZJAR-FPOVZHCZSA-N 1 1 405.502 3.167 20 0 HGADMO Cc1ccc(-c2ccc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)nn2)o1 ZINC001164974401 722147715 /nfs/dbraw/zinc/14/77/15/722147715.db2.gz DRMFDXAFNSDCAI-SIKLNZKXSA-N 1 1 405.502 3.167 20 0 HGADMO CC(C)c1c(Cl)ncnc1N1CC[C@H]2C[N@@H+](Cc3cccnc3)CCO[C@H]2C1 ZINC001164973361 722153373 /nfs/dbraw/zinc/15/33/73/722153373.db2.gz LXYYDISJJXIYRI-ROUUACIJSA-N 1 1 401.942 3.376 20 0 HGADMO Cc1nc(CN2CCO[C@H]3CCN(c4[nH+]cnc5[nH]c(C)c(C)c54)CC[C@@H]32)cs1 ZINC001164985919 722182503 /nfs/dbraw/zinc/18/25/03/722182503.db2.gz CFHWYULYKXUJLL-ROUUACIJSA-N 1 1 412.563 3.209 20 0 HGADMO Fc1cccc(C[N@H+]2CC[C@@]23CCCN(c2ccc(CN4CCOCC4)cn2)C3)c1 ZINC001164994972 722192878 /nfs/dbraw/zinc/19/28/78/722192878.db2.gz RDDHBPWZUKNLKW-XMMPIXPASA-N 1 1 410.537 3.298 20 0 HGADMO NC(=O)c1cc(F)c(Cl)nc1N1CCC[C@]2(CC[N@H+]2Cc2cccc(F)c2)C1 ZINC001164995604 722196340 /nfs/dbraw/zinc/19/63/40/722196340.db2.gz WBCSTPUGPRIDGU-FQEVSTJZSA-N 1 1 406.864 3.357 20 0 HGADMO CN1CCOc2c(Cl)nnc(N3CCC[C@]4(CC[N@H+]4Cc4cccc(F)c4)C3)c21 ZINC001164996325 722206730 /nfs/dbraw/zinc/20/67/30/722206730.db2.gz UAPRYNPBPBUCQF-NRFANRHFSA-N 1 1 417.916 3.343 20 0 HGADMO OCC1([NH2+]Cc2ncc(Br)cc2Br)Cc2ccccc2C1 ZINC000474344343 1126094630 /nfs/dbraw/zinc/09/46/30/1126094630.db2.gz ITKFRDIJSQJZTF-UHFFFAOYSA-N 1 1 412.125 3.226 20 0 HGADMO OC[C@@H](Cc1ccc(O)cc1)[NH2+]Cc1ncc(Br)cc1Br ZINC001462083295 1126197052 /nfs/dbraw/zinc/19/70/52/1126197052.db2.gz FLGVLHBWPWVOBK-GFCCVEGCSA-N 1 1 416.113 3.005 20 0 HGADMO NC(=O)[C@@H](c1ccc(F)cc1)[N@@H+]1C[C@H]2CCC[C@@]2(c2nc(-c3cnccn3)no2)C1 ZINC000328603975 569417134 /nfs/dbraw/zinc/41/71/34/569417134.db2.gz HYTJSTMNHXBPFU-SOIKWTOOSA-N 1 1 408.437 3.296 20 0 HGADMO NC(=O)[C@@H](c1ccc(F)cc1)[N@H+]1C[C@H]2CCC[C@@]2(c2nc(-c3cnccn3)no2)C1 ZINC000328603975 569417136 /nfs/dbraw/zinc/41/71/36/569417136.db2.gz HYTJSTMNHXBPFU-SOIKWTOOSA-N 1 1 408.437 3.296 20 0 HGADMO CSc1nc2ncnc(N3CCc4c(C[NH+](C)C)nn(C(C)C)c4C3)c2s1 ZINC001164650479 719313627 /nfs/dbraw/zinc/31/36/27/719313627.db2.gz YREIFVIKLSYWON-UHFFFAOYSA-N 1 1 403.581 3.210 20 0 HGADMO CNC(=O)C[N@H+]1CCCC12CCN(c1ncnc3cc(C(C)(C)C)sc31)CC2 ZINC001164683947 719706845 /nfs/dbraw/zinc/70/68/45/719706845.db2.gz MFZRYFOJWWWJTC-UHFFFAOYSA-N 1 1 401.580 3.170 20 0 HGADMO CNC(=O)C[N@H+]1CCCC12CCN(c1cc(-c3ccc(Cl)nn3)ccc1F)CC2 ZINC001164689341 719746545 /nfs/dbraw/zinc/74/65/45/719746545.db2.gz BPJCTRSJOACXCV-UHFFFAOYSA-N 1 1 417.916 3.117 20 0 HGADMO CNC(=O)C[N@H+]1CCCC12CCN(c1c(Cl)ccc3c(Cl)ncnc31)CC2 ZINC001164692818 719755856 /nfs/dbraw/zinc/75/58/56/719755856.db2.gz VXCXLCURWXOZIU-UHFFFAOYSA-N 1 1 408.333 3.117 20 0 HGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2CC[C@@H]3[C@@H]2CC(=O)N3Cc2cccnc2)nc1 ZINC001164690672 719775174 /nfs/dbraw/zinc/77/51/74/719775174.db2.gz GVYHETYTSDFZSO-VSKRKVRLSA-N 1 1 405.546 3.403 20 0 HGADMO Cc1nc(C[N@@H+]2CCCC23CCN(c2ncnc4c2[C@@H](C)CC(=O)N4)CC3)cs1 ZINC001164693975 719809018 /nfs/dbraw/zinc/80/90/18/719809018.db2.gz SULJMJBPISEQPC-AWEZNQCLSA-N 1 1 412.563 3.322 20 0 HGADMO COC(=O)c1nc(Cl)cc(N2CCC3(CCC[N@H+]3Cc3csc(C)n3)CC2)n1 ZINC001164693522 719815263 /nfs/dbraw/zinc/81/52/63/719815263.db2.gz VZOAFQJKDPKUDP-UHFFFAOYSA-N 1 1 421.954 3.317 20 0 HGADMO COCc1nc(OC)cc(N2CCC3(CCC[N@H+]3Cc3csc(C)n3)CC2)n1 ZINC001164700236 719816702 /nfs/dbraw/zinc/81/67/02/719816702.db2.gz KCKLZYKQSNHQAF-UHFFFAOYSA-N 1 1 403.552 3.032 20 0 HGADMO COC(=O)[C@@]1(C)C[C@H]([NH+]2CCOCC2)CCN1c1cc(Cl)nc2ccccc21 ZINC001164702642 719837864 /nfs/dbraw/zinc/83/78/64/719837864.db2.gz OLGDVLIBZISAGB-QVKFZJNVSA-N 1 1 403.910 3.121 20 0 HGADMO COC(=O)[C@]1(C)C[C@H]([NH+]2CCOCC2)CCN1c1cc(Cl)nc2ccc(F)cc21 ZINC001164701090 719847212 /nfs/dbraw/zinc/84/72/12/719847212.db2.gz LXLHTVQTPFTHBQ-VFNWGFHPSA-N 1 1 421.900 3.260 20 0 HGADMO COC(=O)[C@]1(C)C[C@H]([NH+]2CCOCC2)CCN1c1cc(Cl)nc2ccsc21 ZINC001164703277 719849538 /nfs/dbraw/zinc/84/95/38/719849538.db2.gz PRENUNMBSLFZKY-YJYMSZOUSA-N 1 1 409.939 3.182 20 0 HGADMO COC(=O)[C@]1(C)C[C@@H]([NH+]2CCOCC2)CCN1c1nccc2c(Cl)cccc21 ZINC001164702925 719852609 /nfs/dbraw/zinc/85/26/09/719852609.db2.gz OHVBTQNHVIEJTD-BTYIYWSLSA-N 1 1 403.910 3.121 20 0 HGADMO COC(=O)[C@@]1(C)C[C@@H]([NH+]2CCOCC2)CCN1c1nccc2cccc(Cl)c21 ZINC001164700171 719856382 /nfs/dbraw/zinc/85/63/82/719856382.db2.gz HAZLPADUYGDIRG-HRAATJIYSA-N 1 1 403.910 3.121 20 0 HGADMO COC(=O)c1cc(C)cc(N2CCC3(CC2)C[N@@H+](Cc2cccs2)CCO3)n1 ZINC001164696166 719894621 /nfs/dbraw/zinc/89/46/21/719894621.db2.gz AEGQYVBNYLBYME-UHFFFAOYSA-N 1 1 401.532 3.110 20 0 HGADMO CC(=O)Nc1c(C)ccnc1N1CCC2(CC1)C[N@@H+](Cc1cccs1)CCO2 ZINC001164699149 719896759 /nfs/dbraw/zinc/89/67/59/719896759.db2.gz XTLSHCNRKWGPTI-UHFFFAOYSA-N 1 1 400.548 3.281 20 0 HGADMO Cc1noc(-c2cccnc2N2CCC3(CC2)C[N@@H+](Cc2cccs2)CCO3)n1 ZINC001164706334 719898687 /nfs/dbraw/zinc/89/86/87/719898687.db2.gz HYWPETTXDRTORM-UHFFFAOYSA-N 1 1 411.531 3.373 20 0 HGADMO CCOC(=O)c1cnc(Cl)cc1N1CC[C@@]2(C1)C[N@@H+](CC1CC1)C[C@H]2COC ZINC001164809744 720069548 /nfs/dbraw/zinc/06/95/48/720069548.db2.gz JTEUMGUEMNZPKX-KKSFZXQISA-N 1 1 407.942 3.096 20 0 HGADMO COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1ncc(C)c(NC3CC3)n1)CC2 ZINC001164709627 720093029 /nfs/dbraw/zinc/09/30/29/720093029.db2.gz BNTLEVMGVWXEKG-OAQYLSRUSA-N 1 1 422.577 3.262 20 0 HGADMO COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1cc(C)nc(SC)n1)CC2 ZINC001164710071 720094465 /nfs/dbraw/zinc/09/44/65/720094465.db2.gz GQBDHJGEUBMKKV-LJQANCHMSA-N 1 1 413.591 3.409 20 0 HGADMO COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1nc(Cl)ncc1OC)CC2 ZINC001164710345 720096505 /nfs/dbraw/zinc/09/65/05/720096505.db2.gz JDPMESVZFXZVRK-KRWDZBQOSA-N 1 1 417.941 3.041 20 0 HGADMO COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1ccc3nc(C)n(C)c3n1)CC2 ZINC001164716100 720117472 /nfs/dbraw/zinc/11/74/72/720117472.db2.gz IYLRZKACRTXLRH-FQEVSTJZSA-N 1 1 420.561 3.179 20 0 HGADMO COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1cc(OC)cc(OC)n1)CC2 ZINC001164717326 720117830 /nfs/dbraw/zinc/11/78/30/720117830.db2.gz NEAHREHKAWXBKM-LJQANCHMSA-N 1 1 412.534 3.001 20 0 HGADMO CCCN(CCC)c1cc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COC)ncn1 ZINC001164807417 720143370 /nfs/dbraw/zinc/14/33/70/720143370.db2.gz CGMYRGZZWIBCLB-REWPJTCUSA-N 1 1 401.599 3.288 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1nc(Cl)nc3c1ncn3C(C)C)C2 ZINC001164813859 720147903 /nfs/dbraw/zinc/14/79/03/720147903.db2.gz RGHDMHFAQPNVAV-IIBYNOLFSA-N 1 1 418.973 3.245 20 0 HGADMO COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1nccc3nc(C)cnc31)CC2 ZINC001164713046 720150677 /nfs/dbraw/zinc/15/06/77/720150677.db2.gz PMUIFYZWRPXDOK-HXUWFJFHSA-N 1 1 418.545 3.236 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(C(F)(F)c1cc(Cl)nc(=S)[nH]1)C2 ZINC001164818133 720151739 /nfs/dbraw/zinc/15/17/39/720151739.db2.gz RVGKBGYROHHJPD-DYVFJYSZSA-N 1 1 418.941 3.148 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1ccc(-c3ccc(OC)cc3)nn1)C2 ZINC001164817191 720165792 /nfs/dbraw/zinc/16/57/92/720165792.db2.gz OTCRJFQTJMZFGJ-GBXCKJPGSA-N 1 1 408.546 3.337 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1nc(Cl)cc(-c3ccncc3)n1)C2 ZINC001164812683 720196676 /nfs/dbraw/zinc/19/66/76/720196676.db2.gz LXEFSTKLUWXGKG-AVRDEDQJSA-N 1 1 413.953 3.377 20 0 HGADMO CC(C)[N@@H+](C)Cc1cc(=O)n2c(n1)CN(c1ncnc3c(Cl)cccc31)CCC2 ZINC001164810200 720216085 /nfs/dbraw/zinc/21/60/85/720216085.db2.gz AJPLERJHCHOYRW-UHFFFAOYSA-N 1 1 412.925 3.090 20 0 HGADMO CC(C)[N@@H+](C)Cc1cc(=O)n2c(n1)CN(c1ccc3cc(Cl)cnc3n1)CCC2 ZINC001164812070 720220179 /nfs/dbraw/zinc/22/01/79/720220179.db2.gz CUMRFXIHGMYPFL-UHFFFAOYSA-N 1 1 412.925 3.090 20 0 HGADMO Cc1nc(CN2C(=O)CC[C@@H]3[C@H]2CCN3c2ccc(C[N@H+](C)C3CC3)cn2)cs1 ZINC001164816041 720258967 /nfs/dbraw/zinc/25/89/67/720258967.db2.gz FOTVAYGUBNJJJB-WOJBJXKFSA-N 1 1 411.575 3.211 20 0 HGADMO CCOC(=O)c1sc2ncnc(N3CC[C@H]4[C@H]3CC[N@H+]4Cc3cccnc3)c2c1C ZINC001164728385 720330215 /nfs/dbraw/zinc/33/02/15/720330215.db2.gz VLLHWSNPOQLXGW-DLBZAZTESA-N 1 1 423.542 3.425 20 0 HGADMO CCOC(=O)c1nc2ccccc2c(N2CC[C@@H]3[C@H]2CC[N@H+]3Cc2cccnc2)n1 ZINC001164726649 720341017 /nfs/dbraw/zinc/34/10/17/720341017.db2.gz QTIUWCQPZBUDMP-WOJBJXKFSA-N 1 1 403.486 3.055 20 0 HGADMO CCOC(=O)c1c(C)nc(Cl)cc1N1CC[C@@H]2[C@@H]1CC[N@H+]2Cc1cccnc1 ZINC001164730331 720364159 /nfs/dbraw/zinc/36/41/59/720364159.db2.gz WSAJSNJLEXCPET-SJORKVTESA-N 1 1 400.910 3.468 20 0 HGADMO COC(=O)c1cc(Cl)ncc1C(F)(F)N1CC[C@@H]2[C@@H]1CC[N@@H+]2Cc1cccnc1 ZINC001164731030 720368678 /nfs/dbraw/zinc/36/86/78/720368678.db2.gz YEEFQVQFKRHHHK-SJORKVTESA-N 1 1 422.863 3.315 20 0 HGADMO COC(=O)c1cc(Cl)ncc1C(F)(F)N1CC[C@@H]2[C@@H]1CC[N@H+]2Cc1cccnc1 ZINC001164731030 720368682 /nfs/dbraw/zinc/36/86/82/720368682.db2.gz YEEFQVQFKRHHHK-SJORKVTESA-N 1 1 422.863 3.315 20 0 HGADMO CCOC(=O)c1ccc2ncnc(N3CC[C@H]4[C@H]3CC[N@H+]4Cc3cccnc3)c2c1 ZINC001164725350 720384367 /nfs/dbraw/zinc/38/43/67/720384367.db2.gz MTGQAMCJLNXUQJ-LEWJYISDSA-N 1 1 403.486 3.055 20 0 HGADMO COC(=O)c1cc(Cl)nc(C(F)(F)N2CC[C@@H]3[C@H]2CC[N@@H+]3Cc2cccnc2)c1 ZINC001164730399 720398522 /nfs/dbraw/zinc/39/85/22/720398522.db2.gz XHODZFVMTASPMG-HZPDHXFCSA-N 1 1 422.863 3.315 20 0 HGADMO COC(=O)c1cc(Cl)nc(C(F)(F)N2CC[C@@H]3[C@H]2CC[N@H+]3Cc2cccnc2)c1 ZINC001164730399 720398529 /nfs/dbraw/zinc/39/85/29/720398529.db2.gz XHODZFVMTASPMG-HZPDHXFCSA-N 1 1 422.863 3.315 20 0 HGADMO COC(=O)c1cc2c(N3CC[C@H]4[C@@H]3CC[N@H+]4Cc3cccnc3)[nH]c(Cl)cc-2n1 ZINC001164731729 720412586 /nfs/dbraw/zinc/41/25/86/720412586.db2.gz MDLFKLCVALUDAD-ROUUACIJSA-N 1 1 411.893 3.251 20 0 HGADMO FC(F)(c1cnc2c(Cl)ncnc2c1)N1CC[C@H]2[C@@H]1CC[N@@H+]2Cc1cccnc1 ZINC001164735359 720423008 /nfs/dbraw/zinc/42/30/08/720423008.db2.gz WOFQFJYLLHVVCV-IRXDYDNUSA-N 1 1 416.863 3.471 20 0 HGADMO FC(F)(c1cnc2c(Cl)ncnc2c1)N1CC[C@H]2[C@@H]1CC[N@H+]2Cc1cccnc1 ZINC001164735359 720423016 /nfs/dbraw/zinc/42/30/16/720423016.db2.gz WOFQFJYLLHVVCV-IRXDYDNUSA-N 1 1 416.863 3.471 20 0 HGADMO COC(=O)C[C@H](c1ccnc(N2CC[C@H]3[C@@H]2CC[N@H+]3Cc2cccnc2)c1)C1CC1 ZINC001164731538 720429840 /nfs/dbraw/zinc/42/98/40/720429840.db2.gz LQDXAKXIKMEAKY-FKBYEOEOSA-N 1 1 406.530 3.387 20 0 HGADMO FC(F)(c1nc2ccc(Cl)nc2[nH]1)N1CC[C@@H]2[C@@H]1CC[N@@H+]2Cc1cccnc1 ZINC001164727129 720452844 /nfs/dbraw/zinc/45/28/44/720452844.db2.gz DCKMXLAIIGRKSF-CABCVRRESA-N 1 1 404.852 3.404 20 0 HGADMO FC(F)(c1nc2ccc(Cl)nc2[nH]1)N1CC[C@@H]2[C@@H]1CC[N@H+]2Cc1cccnc1 ZINC001164727129 720452850 /nfs/dbraw/zinc/45/28/50/720452850.db2.gz DCKMXLAIIGRKSF-CABCVRRESA-N 1 1 404.852 3.404 20 0 HGADMO COc1ccc(OC)c(-c2ccc(N3CC[C@H]4[C@H]3CC[N@H+]4Cc3cccnc3)nn2)c1 ZINC001164735041 720458910 /nfs/dbraw/zinc/45/89/10/720458910.db2.gz VEMXZXBXEVZYMF-FCHUYYIVSA-N 1 1 417.513 3.409 20 0 HGADMO CCOC(=O)c1ccc(C)c(N2CC[C@@H]3[C@@H](C[C@H](Cn4cccn4)[N@H+]3C(C)C)C2)n1 ZINC001164832839 720505890 /nfs/dbraw/zinc/50/58/90/720505890.db2.gz BNJNNOHRYYHSSS-QKNQBKEWSA-N 1 1 411.550 3.141 20 0 HGADMO CCOC(=O)c1ccc(C)c(N2CC[C@@H]3[C@@H](C[C@@H](Cn4cccn4)[N@H+]3C(C)C)C2)n1 ZINC001164832834 720506023 /nfs/dbraw/zinc/50/60/23/720506023.db2.gz BNJNNOHRYYHSSS-IRFCIJBXSA-N 1 1 411.550 3.141 20 0 HGADMO CC(C)[N@@H+]1[C@@H]2CCN(c3nnc(Cl)c4ccncc43)C[C@@H]2C[C@H]1Cn1cccn1 ZINC001164841582 720516586 /nfs/dbraw/zinc/51/65/86/720516586.db2.gz YZEMEADUTLKVMX-TXPKVOOTSA-N 1 1 411.941 3.253 20 0 HGADMO CCOC(=O)c1cc(C)cc(N2CC[C@@H]3[C@@H](C[C@@H](Cn4cccn4)[N@H+]3C(C)C)C2)n1 ZINC001164834871 720519514 /nfs/dbraw/zinc/51/95/14/720519514.db2.gz HTSJFHCWLMRSAS-IRFCIJBXSA-N 1 1 411.550 3.141 20 0 HGADMO CCOC(=O)c1cnc(N2CC[C@@H]3[C@@H](C[C@@H](Cn4cccn4)[N@H+]3C(C)C)C2)c(C)c1 ZINC001164837112 720524800 /nfs/dbraw/zinc/52/48/00/720524800.db2.gz NQBIZDUDJYCQSX-PCCBWWKXSA-N 1 1 411.550 3.141 20 0 HGADMO CC(C)[N@@H+]1[C@@H]2CCN(c3nc(Cl)nc4c3SCC4)C[C@H]2C[C@H]1Cn1cccn1 ZINC001164833639 720531205 /nfs/dbraw/zinc/53/12/05/720531205.db2.gz BBLYDWIMDKREBF-HLLBOEOZSA-N 1 1 418.998 3.353 20 0 HGADMO CCOC(=O)c1cc(C)cnc1N1CC[C@@H]2[C@H](C[C@@H](Cn3cccn3)[N@H+]2C(C)C)C1 ZINC001164836340 720546472 /nfs/dbraw/zinc/54/64/72/720546472.db2.gz JOUUFMOOWKPKOS-SVFBPWRDSA-N 1 1 411.550 3.141 20 0 HGADMO C=Cc1nc(Cl)nc(N2CC[C@@H]3[C@@H](C[C@@H](Cn4cccn4)[N@H+]3C(C)C)C2)c1OC ZINC001164841192 720595493 /nfs/dbraw/zinc/59/54/93/720595493.db2.gz RRFXBGUNBFFPPG-XYJFISCASA-N 1 1 416.957 3.356 20 0 HGADMO CC(C)[N@@H+]1[C@@H]2CCN(c3cc(N4CCCCC4)ncn3)C[C@H]2C[C@H]1Cn1cccn1 ZINC001164842812 720601128 /nfs/dbraw/zinc/60/11/28/720601128.db2.gz VQIQWWVXDKKQRN-QHAWAJNXSA-N 1 1 409.582 3.041 20 0 HGADMO Cc1noc(-c2cccnc2N2CC[C@@H]3[C@H](C[C@H](Cn4cccn4)[N@@H+]3C(C)C)C2)n1 ZINC001164837283 720607132 /nfs/dbraw/zinc/60/71/32/720607132.db2.gz HWOHTTQLFNSUOX-QWFCFKBJSA-N 1 1 407.522 3.014 20 0 HGADMO Cc1nc(-c2ccncc2)cc(N2CC[C@@H]3[C@H](C[C@H](Cn4cccn4)[N@@H+]3C(C)C)C2)n1 ZINC001164838157 720621410 /nfs/dbraw/zinc/62/14/10/720621410.db2.gz KCSMWCVSPKIPAN-MQSCRBSSSA-N 1 1 417.561 3.421 20 0 HGADMO FC(F)(c1cc(Cl)ncc1Cl)N1CC[N@@H+]2C[C@H](Oc3cncnc3)C[C@H]2C1 ZINC001164739618 720622278 /nfs/dbraw/zinc/62/22/78/720622278.db2.gz GGIAFQVIIFRALE-NWDGAFQWSA-N 1 1 416.259 3.065 20 0 HGADMO FC(F)(c1cc(Cl)ncc1Cl)N1CC[N@H+]2C[C@H](Oc3cncnc3)C[C@H]2C1 ZINC001164739618 720622296 /nfs/dbraw/zinc/62/22/96/720622296.db2.gz GGIAFQVIIFRALE-NWDGAFQWSA-N 1 1 416.259 3.065 20 0 HGADMO Clc1ccc2nc(N3CC[N@H+]4C[C@H](Oc5cncnc5)C[C@H]4C3)c(Cl)nc2c1 ZINC001164737837 720669819 /nfs/dbraw/zinc/66/98/19/720669819.db2.gz HIDWSBLCINBWQK-UONOGXRCSA-N 1 1 417.300 3.069 20 0 HGADMO c1ccc(-c2nc(N3CC[N@@H+]4C[C@H](Oc5cncnc5)C[C@@H]4C3)nc3ccccc32)cc1 ZINC001164739304 720689908 /nfs/dbraw/zinc/68/99/08/720689908.db2.gz MVZXXMKFDXWLKA-WOJBJXKFSA-N 1 1 424.508 3.429 20 0 HGADMO CCOC(=O)Cc1ccc(N2CCC3(C[C@@H]([N@@H+](C)Cc4ccccc4)CO3)CC2)nc1 ZINC001164843740 720691825 /nfs/dbraw/zinc/69/18/25/720691825.db2.gz QPEAKXSOMANMCV-JOCHJYFZSA-N 1 1 423.557 3.447 20 0 HGADMO C[N@@H+](Cc1ccccc1)[C@H]1COC2(C1)CCN(c1ncnc3c1ncn3C1CC1)CC2 ZINC001164839810 720714878 /nfs/dbraw/zinc/71/48/78/720714878.db2.gz NFCWMIAFGSUYSI-HXUWFJFHSA-N 1 1 418.545 3.421 20 0 HGADMO C[NH+]1CCC(Oc2ccnc(N3CC[C@@H]4[C@@H]3CCC(=O)N4c3ccccc3)c2)CC1 ZINC001164843729 720768193 /nfs/dbraw/zinc/76/81/93/720768193.db2.gz AMUSWLRVGPTLNI-FCHUYYIVSA-N 1 1 406.530 3.329 20 0 HGADMO Clc1cnc(N2CC[C@@H]3[C@H](C[C@@H](Cn4cncn4)[N@H+]3CC3CC3)C2)c(Cl)c1 ZINC001164748309 720810880 /nfs/dbraw/zinc/81/08/80/720810880.db2.gz QQGGKTVPXXGHHL-UWWQBHOKSA-N 1 1 407.349 3.359 20 0 HGADMO CCOc1ccc(Cl)nc1N1CC[C@@H]2[C@@H](C[C@@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164745790 720833403 /nfs/dbraw/zinc/83/34/03/720833403.db2.gz NKLZGJAAECJGIM-OKZBNKHCSA-N 1 1 416.957 3.105 20 0 HGADMO COCC[N@H+]1CCO[C@H]2CN(C(F)(F)c3cnc(Cl)c(Cl)c3)CC[C@H]2C1 ZINC001164852916 720835602 /nfs/dbraw/zinc/83/56/02/720835602.db2.gz MIKTYJAEQXFWPD-WFASDCNBSA-N 1 1 410.292 3.107 20 0 HGADMO COCC[N@H+]1CCO[C@@H]2CN(c3nc(-c4ccccc4)nc4ccccc43)CC[C@H]2C1 ZINC001164853211 720849707 /nfs/dbraw/zinc/84/97/07/720849707.db2.gz NBONUUIWPCIXLP-NZQKXSOJSA-N 1 1 418.541 3.470 20 0 HGADMO c1csc(-c2cc(N3CC[C@@H]4[C@@H](C[C@@H](Cn5cncn5)[N@@H+]4CC4CC4)C3)ncn2)c1 ZINC001164749490 720850125 /nfs/dbraw/zinc/85/01/25/720850125.db2.gz VYAZNYQLOSJPEE-CMKODMSKSA-N 1 1 421.574 3.176 20 0 HGADMO c1ncn(C[C@@H]2C[C@@H]3CN(c4ccc(COC5CCC5)cn4)CC[C@@H]3[N@@H+]2CC2CC2)n1 ZINC001164748669 720855476 /nfs/dbraw/zinc/85/54/76/720855476.db2.gz LMUDNEVVBMQBAH-GIWBLDEGSA-N 1 1 422.577 3.122 20 0 HGADMO Clc1ccc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COCc2cccnc2)nn1 ZINC001164751577 720876406 /nfs/dbraw/zinc/87/64/06/720876406.db2.gz LBKCDQONUICTFU-SIKLNZKXSA-N 1 1 413.953 3.280 20 0 HGADMO COCC[N@H+]1CCO[C@@H]2CN(c3cnc(Cl)nc3Oc3ccccc3)CC[C@H]2C1 ZINC001164865049 720888788 /nfs/dbraw/zinc/88/87/88/720888788.db2.gz YBAHKQBDXGXYEW-QFBILLFUSA-N 1 1 418.925 3.096 20 0 HGADMO CCOc1cc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COCc2cccnc2)ncn1 ZINC001164748469 720910762 /nfs/dbraw/zinc/91/07/62/720910762.db2.gz GESKFSQEZZKDJW-ZJSXRUAMSA-N 1 1 423.561 3.025 20 0 HGADMO Clc1ccc(C[NH+]2CCCC2)c(N2C[C@H](OCc3cccnc3)[C@@H]3COC[C@H]32)n1 ZINC001164762853 721005941 /nfs/dbraw/zinc/00/59/41/721005941.db2.gz WNFJEEVWCUQUDI-AQNXPRMDSA-N 1 1 414.937 3.146 20 0 HGADMO COC(=O)[C@H](C)c1c(Cl)ncnc1N1CCn2c(C[N@@H+](C)C(C)C)cnc2[C@H]1C ZINC001164858858 721022503 /nfs/dbraw/zinc/02/25/03/721022503.db2.gz IABAUWMZOJVHRO-ZIAGYGMSSA-N 1 1 420.945 3.024 20 0 HGADMO CSc1nc2sccc2c(N2C[C@@H]3C[N@H+](Cc4cnn(C)c4)CC[C@@H]3C2)n1 ZINC001164765632 721083657 /nfs/dbraw/zinc/08/36/57/721083657.db2.gz JFEIPAWHINZPLE-CABCVRRESA-N 1 1 400.577 3.105 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4nc(Cl)nc5ccc(F)cc54)C[C@H]3C2)cn1 ZINC001164771196 721084278 /nfs/dbraw/zinc/08/42/78/721084278.db2.gz ROEOECVOWDPORR-HUUCEWRRSA-N 1 1 400.889 3.114 20 0 HGADMO COc1ccc(C(F)(F)N2CC[N@H+]3C[C@H](OCc4cccnc4)C[C@@H]3C2)c(Cl)n1 ZINC001164865404 721084966 /nfs/dbraw/zinc/08/49/66/721084966.db2.gz LBUVSBOMRHZPIB-HZPDHXFCSA-N 1 1 424.879 3.163 20 0 HGADMO Cc1ccc(C(F)(F)N2CC[N@H+]3C[C@H](OCc4cccnc4)C[C@H]3C2)nc1Cl ZINC001164864863 721094252 /nfs/dbraw/zinc/09/42/52/721094252.db2.gz GYMICPDKXIIZHU-DLBZAZTESA-N 1 1 408.880 3.463 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(C(F)(F)c4nc(Cl)ncc4Cl)C[C@@H]3C2)cn1 ZINC001164765626 721095548 /nfs/dbraw/zinc/09/55/48/721095548.db2.gz JEZLCKWXRHWKAS-OLZOCXBDSA-N 1 1 417.291 3.020 20 0 HGADMO c1cn(C2CCCC2)c2ncnc(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@H]4C3)c12 ZINC001164866334 721097041 /nfs/dbraw/zinc/09/70/41/721097041.db2.gz SGPIRBJAQUSIMN-LEWJYISDSA-N 1 1 418.545 3.421 20 0 HGADMO FC(F)(COc1cccc(Cl)n1)N1CC[N@H+]2C[C@H](OCc3cccnc3)C[C@H]2C1 ZINC001164864887 721108527 /nfs/dbraw/zinc/10/85/27/721108527.db2.gz HFCUWDMNAFKGLL-DLBZAZTESA-N 1 1 424.879 3.077 20 0 HGADMO COc1ccc2c(C)cc(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@@H]4C3)nc2c1 ZINC001164867709 721109953 /nfs/dbraw/zinc/10/99/53/721109953.db2.gz ZSJCAQOPPZVOOX-TZIWHRDSSA-N 1 1 404.514 3.427 20 0 HGADMO COc1cccc(-c2ccnc(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@H]4C3)n2)c1 ZINC001164867348 721113166 /nfs/dbraw/zinc/11/31/66/721113166.db2.gz YDWJBMQVUDFGES-RBBKRZOGSA-N 1 1 417.513 3.027 20 0 HGADMO CC(C)(C)c1nc2[nH]ccc2c(N2CC[N@H+]3C[C@H](OCc4cccnc4)C[C@@H]3C2)n1 ZINC001164871558 721127165 /nfs/dbraw/zinc/12/71/65/721127165.db2.gz FGUJSYXNQRRXGH-QZTJIDSGSA-N 1 1 406.534 3.130 20 0 HGADMO Fc1ccc(Oc2ccnc(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@H]4C3)n2)cc1 ZINC001164871075 721160383 /nfs/dbraw/zinc/16/03/83/721160383.db2.gz DHVWITMWQXVJGS-PZJWPPBQSA-N 1 1 421.476 3.283 20 0 HGADMO Fc1cccc(F)c1-c1ccc(N2CC[N@H+]3C[C@H](OCc4cccnc4)C[C@@H]3C2)nn1 ZINC001164879053 721163100 /nfs/dbraw/zinc/16/31/00/721163100.db2.gz ROTJYRKVKMHVOY-QZTJIDSGSA-N 1 1 423.467 3.297 20 0 HGADMO Cc1nc(-c2ccncc2)nc(N2CC[N@H+]3C[C@H](OCc4cccnc4)C[C@H]3C2)c1C ZINC001164872525 721165291 /nfs/dbraw/zinc/16/52/91/721165291.db2.gz HJYLABLMZMHGHP-FCHUYYIVSA-N 1 1 416.529 3.030 20 0 HGADMO Cc1nc(-c2ccccn2)nc(N2CC[N@H+]3C[C@H](OCc4cccnc4)C[C@H]3C2)c1C ZINC001164880340 721166856 /nfs/dbraw/zinc/16/68/56/721166856.db2.gz WAANWLNKPDVCSZ-LEWJYISDSA-N 1 1 416.529 3.030 20 0 HGADMO Cc1nc(C)c(-c2ccc(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@@H]4C3)nn2)s1 ZINC001164873553 721173156 /nfs/dbraw/zinc/17/31/56/721173156.db2.gz IOYDERMBNDBGML-RTBURBONSA-N 1 1 422.558 3.092 20 0 HGADMO CCN(c1ccccc1)c1cc(N2C[C@@H]3CC[N@@H+](Cc4cnn(C)c4)C[C@@H]3C2)ncn1 ZINC001164772420 721225525 /nfs/dbraw/zinc/22/55/25/721225525.db2.gz UQENTQXFFXXRGY-LEWJYISDSA-N 1 1 417.561 3.326 20 0 HGADMO Cc1cc(N2C[C@@H]3C[N@@H+](Cc4cnn(C)c4)CC[C@@H]3C2)nc(-c2ccc(Cl)nc2)n1 ZINC001164763910 721231596 /nfs/dbraw/zinc/23/15/96/721231596.db2.gz OBBANONZPVRUPC-MOPGFXCFSA-N 1 1 423.952 3.192 20 0 HGADMO C[NH+]1CCC(Oc2ccnc(N3CC[C@@H]4O[C@H](COc5cccnc5)CC[C@H]43)c2)CC1 ZINC001164872750 721251784 /nfs/dbraw/zinc/25/17/84/721251784.db2.gz FPVNHILDEMFTHC-ZRBLBEILSA-N 1 1 424.545 3.155 20 0 HGADMO CC(C)(c1ccnc(Cl)c1)[N@H+]1C[C@@H]2COC[C@H](C(=O)NCc3ccco3)[C@H]2C1 ZINC001164760184 721259205 /nfs/dbraw/zinc/25/92/05/721259205.db2.gz CWRQMPUWSFSMJF-JLSDUUJJSA-N 1 1 403.910 3.074 20 0 HGADMO CCC[N@H+]1CCCC[C@@H]1c1ccc(N2C[C@@H]3OCCN(c4ccc(C)nn4)[C@H]3C2)nc1 ZINC001164777550 721313838 /nfs/dbraw/zinc/31/38/38/721313838.db2.gz SRGWVCGODSYLFG-FSSWDIPSSA-N 1 1 422.577 3.211 20 0 HGADMO CN(C)C1=[NH+]OC2(C1)CCN(C(F)(F)Oc1ccc3c(Cl)ncnc3c1)CC2 ZINC001164880542 721326260 /nfs/dbraw/zinc/32/62/60/721326260.db2.gz YFQRWVYLFZHCIU-UHFFFAOYSA-N 1 1 411.840 3.342 20 0 HGADMO CSc1nc(C)cc(N2CCC[C@]3(C2)COCC[N@H+](Cc2c(C)noc2C)C3)n1 ZINC001164776151 721331744 /nfs/dbraw/zinc/33/17/44/721331744.db2.gz CYCWLEYBYRPCLC-NRFANRHFSA-N 1 1 417.579 3.231 20 0 HGADMO CSc1nc(C)cc(N2CCC[C@]3(C2)COCC[N@@H+](Cc2c(C)noc2C)C3)n1 ZINC001164776151 721331749 /nfs/dbraw/zinc/33/17/49/721331749.db2.gz CYCWLEYBYRPCLC-NRFANRHFSA-N 1 1 417.579 3.231 20 0 HGADMO Cc1noc(C)c1CN1CCOC[C@]2(CCCN(c3[nH+]ccc4c3ccn4C)C2)C1 ZINC001164778830 721341445 /nfs/dbraw/zinc/34/14/45/721341445.db2.gz PBAONEQPIKZODQ-HSZRJFAPSA-N 1 1 409.534 3.297 20 0 HGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@]2(CCCN(c3ccc4nc(C)n(C)c4n3)C2)C1 ZINC001164777187 721350284 /nfs/dbraw/zinc/35/02/84/721350284.db2.gz FCDDKNXYJXKYCB-HSZRJFAPSA-N 1 1 424.549 3.001 20 0 HGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2C[C@@H]3OCC(=O)N(c4cccc(F)c4)[C@H]3C2)nc1 ZINC001164883225 721366964 /nfs/dbraw/zinc/36/69/64/721366964.db2.gz OINAEMDOLVWHND-FSSWDIPSSA-N 1 1 424.520 3.388 20 0 HGADMO C[NH+]1CCN(C[C@@H]2CCC[C@@]3(CCN(C(F)(F)c4ccnc(Cl)c4)C3)O2)CC1 ZINC001164885627 721382351 /nfs/dbraw/zinc/38/23/51/721382351.db2.gz CVSHCMBBRZJAEI-HKUYNNGSSA-N 1 1 414.928 3.045 20 0 HGADMO C[NH+]1CCN(C[C@H]2CCC[C@]3(CCN(c4cnc5cccc(Cl)c5n4)C3)O2)CC1 ZINC001164893560 721394567 /nfs/dbraw/zinc/39/45/67/721394567.db2.gz VCZMRRDXMXWMII-VGOFRKELSA-N 1 1 415.969 3.049 20 0 HGADMO COc1cc2c(cc1Cl)ncnc2N1C[C@@H]2C[NH+](Cc3nccs3)C[C@H]2C1 ZINC001164781137 721411347 /nfs/dbraw/zinc/41/13/47/721411347.db2.gz BXBRYMODOFNDPH-STQMWFEESA-N 1 1 401.923 3.317 20 0 HGADMO CC(C)(C)OC(=O)Nc1ccc(N2C[C@H]3C[NH+](Cc4nccs4)C[C@@H]3C2)nc1 ZINC001164788068 721423724 /nfs/dbraw/zinc/42/37/24/721423724.db2.gz RXAKGPAOVWBECE-HUUCEWRRSA-N 1 1 401.536 3.453 20 0 HGADMO C[NH+]1CCN(C[C@@H]2CCC[C@@]3(CCN(c4nccnc4Oc4ccccc4)C3)O2)CC1 ZINC001164889561 721443390 /nfs/dbraw/zinc/44/33/90/721443390.db2.gz BSJVUGLZTYRBFK-URXFXBBRSA-N 1 1 423.561 3.034 20 0 HGADMO C[NH+]1CCN(C[C@@H]2CCC[C@]3(CCN(c4nccnc4Oc4ccccc4)C3)O2)CC1 ZINC001164889562 721443469 /nfs/dbraw/zinc/44/34/69/721443469.db2.gz BSJVUGLZTYRBFK-XUZZJYLKSA-N 1 1 423.561 3.034 20 0 HGADMO CCc1nc2sccc2c(N2CC[C@]3(C2)CCC[C@@H](CN2CC[NH+](C)CC2)O3)n1 ZINC001164893041 721443657 /nfs/dbraw/zinc/44/36/57/721443657.db2.gz IUOKZBUWNVXQEK-JTSKRJEESA-N 1 1 415.607 3.019 20 0 HGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1ncc(Cl)cc1OC)CC2 ZINC001164789268 721452958 /nfs/dbraw/zinc/45/29/58/721452958.db2.gz UGHFSFLNRQLVKQ-IBGZPJMESA-N 1 1 423.985 3.478 20 0 HGADMO CCOc1ccnc(N2CCC3(C[C@@H](COCC4CC4)[N@H+](CCOC)C3)CC2)c1 ZINC001164788702 721459403 /nfs/dbraw/zinc/45/94/03/721459403.db2.gz VRMWLKJBYAPPMX-FQEVSTJZSA-N 1 1 403.567 3.214 20 0 HGADMO CCOc1ccnc(N2CCC3(C[C@@H](COCC4CC4)[N@@H+](CCOC)C3)CC2)c1 ZINC001164788702 721459408 /nfs/dbraw/zinc/45/94/08/721459408.db2.gz VRMWLKJBYAPPMX-FQEVSTJZSA-N 1 1 403.567 3.214 20 0 HGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1nnc(Cl)cc1F)CC2 ZINC001164784358 721460060 /nfs/dbraw/zinc/46/00/60/721460060.db2.gz HMLYJUGJZWDJEP-INIZCTEOSA-N 1 1 412.937 3.003 20 0 HGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1ccc(C3CC3)nn1)CC2 ZINC001164789929 721460773 /nfs/dbraw/zinc/46/07/73/721460773.db2.gz YNQFJRBFBHBDQX-FQEVSTJZSA-N 1 1 400.567 3.088 20 0 HGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1ccnc(C3CC3)n1)CC2 ZINC001164784249 721462364 /nfs/dbraw/zinc/46/23/64/721462364.db2.gz HFTIFHRMPRHCIX-FQEVSTJZSA-N 1 1 400.567 3.088 20 0 HGADMO CC(C)C(=O)N1CC[C@H]2CN(c3ncnc4c3CC[N@H+](Cc3ccccc3)C4)CC[C@H]21 ZINC001164895112 721463852 /nfs/dbraw/zinc/46/38/52/721463852.db2.gz ZLLPWMAGLVBHAH-NZQKXSOJSA-N 1 1 419.573 3.118 20 0 HGADMO CC(C)C(=O)N1CC[C@H]2CN(c3ncnc4c3CC[N@@H+](Cc3ccccc3)C4)CC[C@H]21 ZINC001164895112 721463854 /nfs/dbraw/zinc/46/38/54/721463854.db2.gz ZLLPWMAGLVBHAH-NZQKXSOJSA-N 1 1 419.573 3.118 20 0 HGADMO C[N@H+](Cc1ccncc1)C1CC2(C1)CCN(c1nc(Cl)nc3c1CNCC3)CC2 ZINC001164793374 721489917 /nfs/dbraw/zinc/48/99/17/721489917.db2.gz QYPNPWWWUCQVRT-UHFFFAOYSA-N 1 1 412.969 3.052 20 0 HGADMO C[N@@H+](Cc1ccncc1)C1CC2(C1)CCN(c1nc(Cl)nc3c1CNCC3)CC2 ZINC001164793374 721489920 /nfs/dbraw/zinc/48/99/20/721489920.db2.gz QYPNPWWWUCQVRT-UHFFFAOYSA-N 1 1 412.969 3.052 20 0 HGADMO C[N@H+](Cc1ccncc1)C1CC2(C1)CCN(c1nc(Cl)nc3c1CCNC3)CC2 ZINC001164791191 721491384 /nfs/dbraw/zinc/49/13/84/721491384.db2.gz CIWFTRKYIMPLJH-UHFFFAOYSA-N 1 1 412.969 3.052 20 0 HGADMO C[N@@H+](Cc1ccncc1)C1CC2(C1)CCN(c1nc(Cl)nc3c1CCNC3)CC2 ZINC001164791191 721491386 /nfs/dbraw/zinc/49/13/86/721491386.db2.gz CIWFTRKYIMPLJH-UHFFFAOYSA-N 1 1 412.969 3.052 20 0 HGADMO COC(=O)c1cnc(N2CC[N@H+]3C[C@@H](Oc4cccc(F)c4)C[C@H]3C2)c(Cl)c1 ZINC001164900464 721508798 /nfs/dbraw/zinc/50/87/98/721508798.db2.gz RCQMGVOYLYJVAZ-RDJZCZTQSA-N 1 1 405.857 3.003 20 0 HGADMO COC(=O)c1cc(Cl)cnc1N1CC[N@H+]2C[C@H](Oc3cccc(F)c3)C[C@H]2C1 ZINC001164897060 721513523 /nfs/dbraw/zinc/51/35/23/721513523.db2.gz DMORBQPMIUKFQP-DOTOQJQBSA-N 1 1 405.857 3.003 20 0 HGADMO CC1(C)OCc2c1nc(Cl)nc2N1CC[N@H+]2C[C@@H](Oc3cccc(F)c3)C[C@@H]2C1 ZINC001164901688 721524845 /nfs/dbraw/zinc/52/48/45/721524845.db2.gz XYJNBCYZAIHITI-ZBFHGGJFSA-N 1 1 418.900 3.376 20 0 HGADMO Cc1cc(Cl)nc(C(F)(F)N2C[C@H]([N@H+](C)Cc3cccnc3)[C@H]3OCCC[C@@H]32)n1 ZINC001164803648 721528954 /nfs/dbraw/zinc/52/89/54/721528954.db2.gz IMWOBSZQRCWLFC-BQFCYCMXSA-N 1 1 423.895 3.247 20 0 HGADMO Cc1cc(Cl)nc(C(F)(F)N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@H]3OCCC[C@@H]32)n1 ZINC001164803648 721528956 /nfs/dbraw/zinc/52/89/56/721528956.db2.gz IMWOBSZQRCWLFC-BQFCYCMXSA-N 1 1 423.895 3.247 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2ccnc(-c3ccccc3)n2)[C@H]2CCCO[C@@H]12 ZINC001164801544 721535973 /nfs/dbraw/zinc/53/59/73/721535973.db2.gz FPTBAGPDPNKXOY-QZNHQXDQSA-N 1 1 401.514 3.407 20 0 HGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(C(F)(F)Oc2cccnc2Cl)[C@H]2CCCO[C@H]12 ZINC001164801348 721540152 /nfs/dbraw/zinc/54/01/52/721540152.db2.gz DZDUYKMNXFPENZ-JZXOWHBKSA-N 1 1 424.879 3.423 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(C(F)(F)Oc2cccnc2Cl)[C@H]2CCCO[C@H]12 ZINC001164801348 721540156 /nfs/dbraw/zinc/54/01/56/721540156.db2.gz DZDUYKMNXFPENZ-JZXOWHBKSA-N 1 1 424.879 3.423 20 0 HGADMO COc1ccc2nc(N3CC[N@H+]4C[C@H](Oc5cccc(F)c5)C[C@@H]4C3)nc(C)c2c1 ZINC001164912015 721540441 /nfs/dbraw/zinc/54/04/41/721540441.db2.gz YDDVAFXYBDTDCT-YLJYHZDGSA-N 1 1 408.477 3.428 20 0 HGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(C(F)(F)Oc2ccc(Cl)nc2)[C@@H]2CCCO[C@@H]12 ZINC001164809544 721543399 /nfs/dbraw/zinc/54/33/99/721543399.db2.gz VIXWAWYCARLLMV-ZHALLVOQSA-N 1 1 424.879 3.423 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(C(F)(F)Oc2ccc(Cl)nc2)[C@@H]2CCCO[C@@H]12 ZINC001164809544 721543402 /nfs/dbraw/zinc/54/34/02/721543402.db2.gz VIXWAWYCARLLMV-ZHALLVOQSA-N 1 1 424.879 3.423 20 0 HGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2nc(Cl)nc3c2CSC3)[C@H]2CCCO[C@@H]12 ZINC001164800853 721543523 /nfs/dbraw/zinc/54/35/23/721543523.db2.gz DSXDKKQBVICKLU-RCCFBDPRSA-N 1 1 417.966 3.140 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2nc(Cl)nc3c2CSC3)[C@H]2CCCO[C@@H]12 ZINC001164800853 721543526 /nfs/dbraw/zinc/54/35/26/721543526.db2.gz DSXDKKQBVICKLU-RCCFBDPRSA-N 1 1 417.966 3.140 20 0 HGADMO Cc1c[nH]c2nc(Cl)nc(N3C[C@H]([N@H+](C)Cc4cccnc4)[C@@H]4OCCC[C@H]43)c12 ZINC001164801474 721544467 /nfs/dbraw/zinc/54/44/67/721544467.db2.gz FKZBGUZVDVKGNU-SOLBZPMBSA-N 1 1 412.925 3.183 20 0 HGADMO Cc1c[nH]c2nc(Cl)nc(N3C[C@H]([N@@H+](C)Cc4cccnc4)[C@@H]4OCCC[C@H]43)c12 ZINC001164801474 721544470 /nfs/dbraw/zinc/54/44/70/721544470.db2.gz FKZBGUZVDVKGNU-SOLBZPMBSA-N 1 1 412.925 3.183 20 0 HGADMO CCOc1ccc(Cl)nc1N1C[C@H]([N@H+](C)Cc2cccnc2)[C@H]2OCCC[C@H]21 ZINC001164799726 721560506 /nfs/dbraw/zinc/56/05/06/721560506.db2.gz DIJDQERWRDMLLS-UWVAXJGDSA-N 1 1 402.926 3.397 20 0 HGADMO CCOc1ccc(Cl)nc1N1C[C@H]([N@@H+](C)Cc2cccnc2)[C@H]2OCCC[C@H]21 ZINC001164799726 721560508 /nfs/dbraw/zinc/56/05/08/721560508.db2.gz DIJDQERWRDMLLS-UWVAXJGDSA-N 1 1 402.926 3.397 20 0 HGADMO CSc1cnc(Cl)c(N2C[C@H]([N@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@H]32)n1 ZINC001164806781 721572948 /nfs/dbraw/zinc/57/29/48/721572948.db2.gz RRPLVJBKOKXPNB-HLLBOEOZSA-N 1 1 405.955 3.115 20 0 HGADMO CSc1cnc(Cl)c(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@H]32)n1 ZINC001164806781 721572952 /nfs/dbraw/zinc/57/29/52/721572952.db2.gz RRPLVJBKOKXPNB-HLLBOEOZSA-N 1 1 405.955 3.115 20 0 HGADMO C=Cc1nc(Cl)nc(N2C[C@H]([N@H+](C)Cc3cccnc3)[C@H]3OCCC[C@H]32)c1OC ZINC001164806669 721574553 /nfs/dbraw/zinc/57/45/53/721574553.db2.gz QQJWBHPOQHCKTF-AOIWGVFYSA-N 1 1 415.925 3.045 20 0 HGADMO C=Cc1nc(Cl)nc(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@H]3OCCC[C@H]32)c1OC ZINC001164806669 721574555 /nfs/dbraw/zinc/57/45/55/721574555.db2.gz QQJWBHPOQHCKTF-AOIWGVFYSA-N 1 1 415.925 3.045 20 0 HGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2cc(-c3cccs3)ncn2)[C@@H]2CCCO[C@H]12 ZINC001164799245 721581335 /nfs/dbraw/zinc/58/13/35/721581335.db2.gz ABGJMNGRQVOBHA-KNKQGSTJSA-N 1 1 407.543 3.468 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2cc(-c3cccs3)ncn2)[C@@H]2CCCO[C@H]12 ZINC001164799245 721581336 /nfs/dbraw/zinc/58/13/36/721581336.db2.gz ABGJMNGRQVOBHA-KNKQGSTJSA-N 1 1 407.543 3.468 20 0 HGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2cncc(OCC3CCCC3)n2)[C@H]2CCCO[C@H]12 ZINC001164802590 721589113 /nfs/dbraw/zinc/58/91/13/721589113.db2.gz GXUBRQUDCREVOX-IMSXRSKXSA-N 1 1 423.561 3.309 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2cncc(OCC3CCCC3)n2)[C@H]2CCCO[C@H]12 ZINC001164802590 721589114 /nfs/dbraw/zinc/58/91/14/721589114.db2.gz GXUBRQUDCREVOX-IMSXRSKXSA-N 1 1 423.561 3.309 20 0 HGADMO COc1cc(N2CCC(F)(F)[C@@]3(CC[N@@H+](Cc4ccccn4)C3)C2)nc(SC)n1 ZINC001164905585 721703570 /nfs/dbraw/zinc/70/35/70/721703570.db2.gz HUKQZNPGIVJSIY-LJQANCHMSA-N 1 1 421.517 3.340 20 0 HGADMO COCOc1ccc(N2CCC(F)(F)[C@]3(CC[N@@H+](Cc4ccccn4)C3)C2)nc1 ZINC001164908734 721707077 /nfs/dbraw/zinc/70/70/77/721707077.db2.gz YVAZSYSSAVVALW-FQEVSTJZSA-N 1 1 404.461 3.197 20 0 HGADMO C[N@H+](Cc1ccco1)Cc1cncc2c1CCN(c1nc(Cl)nc(Cl)n1)C2 ZINC001164908475 721750366 /nfs/dbraw/zinc/75/03/66/721750366.db2.gz KFPQQBAGQIPYMP-UHFFFAOYSA-N 1 1 405.289 3.361 20 0 HGADMO C[N@@H+](Cc1ccco1)Cc1cncc2c1CCN(c1nc(Cl)nc(Cl)n1)C2 ZINC001164908475 721750370 /nfs/dbraw/zinc/75/03/70/721750370.db2.gz KFPQQBAGQIPYMP-UHFFFAOYSA-N 1 1 405.289 3.361 20 0 HGADMO CCOC(=O)Cc1ccc(N2CCc3c(C[N@H+](C)Cc4ccco4)cncc3C2)nc1 ZINC001164909616 721754883 /nfs/dbraw/zinc/75/48/83/721754883.db2.gz JYBPLYPGINZKMR-UHFFFAOYSA-N 1 1 420.513 3.370 20 0 HGADMO CCOC(=O)Cc1ccc(N2CCc3c(C[N@@H+](C)Cc4ccco4)cncc3C2)nc1 ZINC001164909616 721754884 /nfs/dbraw/zinc/75/48/84/721754884.db2.gz JYBPLYPGINZKMR-UHFFFAOYSA-N 1 1 420.513 3.370 20 0 HGADMO C[N@H+](Cc1ccco1)Cc1cncc2c1CCN(c1ncc(OC(F)F)cn1)C2 ZINC001164909016 721757612 /nfs/dbraw/zinc/75/76/12/721757612.db2.gz CIUPXMGTXBPYRU-UHFFFAOYSA-N 1 1 401.417 3.261 20 0 HGADMO C[N@@H+](Cc1ccco1)Cc1cncc2c1CCN(c1ncc(OC(F)F)cn1)C2 ZINC001164909016 721757614 /nfs/dbraw/zinc/75/76/14/721757614.db2.gz CIUPXMGTXBPYRU-UHFFFAOYSA-N 1 1 401.417 3.261 20 0 HGADMO CCNC(=O)c1ccc(N2CCc3c(C[N@H+](C)Cc4ccco4)cncc3C2)nc1 ZINC001164910958 721761035 /nfs/dbraw/zinc/76/10/35/721761035.db2.gz MFOSCYHPXRCPKC-UHFFFAOYSA-N 1 1 405.502 3.014 20 0 HGADMO CCNC(=O)c1ccc(N2CCc3c(C[N@@H+](C)Cc4ccco4)cncc3C2)nc1 ZINC001164910958 721761037 /nfs/dbraw/zinc/76/10/37/721761037.db2.gz MFOSCYHPXRCPKC-UHFFFAOYSA-N 1 1 405.502 3.014 20 0 HGADMO C[N@H+](Cc1ccco1)Cc1cncc2c1CCN([C@H](F)Oc1ccc(Cl)nn1)C2 ZINC001164911610 721766737 /nfs/dbraw/zinc/76/67/37/721766737.db2.gz PUMHSOILVNZHSL-FQEVSTJZSA-N 1 1 417.872 3.440 20 0 HGADMO C[N@@H+](Cc1ccco1)Cc1cncc2c1CCN([C@H](F)Oc1ccc(Cl)nn1)C2 ZINC001164911610 721766739 /nfs/dbraw/zinc/76/67/39/721766739.db2.gz PUMHSOILVNZHSL-FQEVSTJZSA-N 1 1 417.872 3.440 20 0 HGADMO C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@@H]2CN(c3ncccc3C(=O)N3CCCC3)C[C@@H]21 ZINC001165020566 721799366 /nfs/dbraw/zinc/79/93/66/721799366.db2.gz FZZDLOIARUMISI-WTIAFYNJSA-N 1 1 419.573 3.450 20 0 HGADMO CN(C)c1nc(Cl)cc(N2C[C@@H]3CCC[C@H]([N@@H+](C)Cc4ccccn4)[C@@H]3C2)n1 ZINC001165028845 721799590 /nfs/dbraw/zinc/79/95/90/721799590.db2.gz ZXANTJRALVYHCV-JQHSSLGASA-N 1 1 400.958 3.328 20 0 HGADMO CSc1nc(Cl)nc(N2C[C@@H]3CCC[C@@H]([N@@H+](C)Cc4ccccn4)[C@@H]3C2)n1 ZINC001165026639 721806871 /nfs/dbraw/zinc/80/68/71/721806871.db2.gz RQKQYULUAKGGBA-NUEKZKHPSA-N 1 1 404.971 3.379 20 0 HGADMO COCc1cc(N2C[C@@H]3CCC[C@@H]([N@@H+](C)Cc4ccccn4)[C@H]3C2)nc(SC)n1 ZINC001165026881 721811098 /nfs/dbraw/zinc/81/10/98/721811098.db2.gz SAPWQBJMRKXYIV-FFZOFVMBSA-N 1 1 413.591 3.477 20 0 HGADMO COC(=O)c1cc(F)c(C)nc1N1C[C@@H]2CCC[C@H]([N@@H+](C)Cc3ccccn3)[C@H]2C1 ZINC001165023583 721812397 /nfs/dbraw/zinc/81/23/97/721812397.db2.gz HYLJCIMQTFGXQR-LRQRDZAKSA-N 1 1 412.509 3.448 20 0 HGADMO CN(C)c1cc(Cl)nc(N2C[C@@H]3CCC[C@@H]([N@@H+](C)Cc4ccccn4)[C@@H]3C2)n1 ZINC001165026860 721814083 /nfs/dbraw/zinc/81/40/83/721814083.db2.gz RUMHQRYCZMWCHB-CGTJXYLNSA-N 1 1 400.958 3.328 20 0 HGADMO CC(C)c1nc(N(C)C)nc(N2C[C@@H]3CCC[C@H]([N@@H+](C)Cc4ccccn4)[C@@H]3C2)n1 ZINC001165024250 721816613 /nfs/dbraw/zinc/81/66/13/721816613.db2.gz KBUGMTBEPCBOIT-SXLOBPIMSA-N 1 1 409.582 3.193 20 0 HGADMO CCS(=O)(=O)c1ccnc(N2C[C@@H]3CCC[C@@H]([N@@H+](C)Cc4ccccn4)[C@@H]3C2)c1 ZINC001165026099 721832180 /nfs/dbraw/zinc/83/21/80/721832180.db2.gz OEQHBUSWZLXTJG-IOMROCGXSA-N 1 1 414.575 3.007 20 0 HGADMO CN(C)CC[N@@H+]1CC[C@@H]2[C@@H]1CCN2c1cnc(Cl)nc1Oc1ccc(F)cc1 ZINC001164935513 721880723 /nfs/dbraw/zinc/88/07/23/721880723.db2.gz XEZONICYRXHDGP-DLBZAZTESA-N 1 1 405.905 3.276 20 0 HGADMO CN(C)CC[N@H+]1CC[C@@H]2[C@@H]1CCN2c1cnc(Cl)nc1Oc1ccc(F)cc1 ZINC001164935513 721880724 /nfs/dbraw/zinc/88/07/24/721880724.db2.gz XEZONICYRXHDGP-DLBZAZTESA-N 1 1 405.905 3.276 20 0 HGADMO CN(C)CC[N@@H+]1CC[C@@H]2[C@H]1CCN2c1ccc(-c2ccc(N3CCCCC3)cc2)nn1 ZINC001164935138 721885699 /nfs/dbraw/zinc/88/56/99/721885699.db2.gz WNCABUMVKLEYPC-DNQXCXABSA-N 1 1 420.605 3.349 20 0 HGADMO CN(C)CC[N@H+]1CC[C@@H]2[C@H]1CCN2c1ccc(-c2ccc(N3CCCCC3)cc2)nn1 ZINC001164935138 721885700 /nfs/dbraw/zinc/88/57/00/721885700.db2.gz WNCABUMVKLEYPC-DNQXCXABSA-N 1 1 420.605 3.349 20 0 HGADMO CC[NH+](CC)Cc1nc2sc(C)c(C)c2c(N2CC[C@@H]3[C@@H]2CCC(=O)N3C)n1 ZINC001164932382 721893293 /nfs/dbraw/zinc/89/32/93/721893293.db2.gz HJGHZMZKCKJHDM-CVEARBPZSA-N 1 1 401.580 3.349 20 0 HGADMO COc1ccc2c(C)cc(N3CCC4(CC3)COCCN4Cc3ccn(C)n3)[nH+]c2c1 ZINC001164936495 721906678 /nfs/dbraw/zinc/90/66/78/721906678.db2.gz PVPMBAXKLBKLEJ-UHFFFAOYSA-N 1 1 421.545 3.157 20 0 HGADMO COC(=O)c1cc(F)cnc1N1CCC2(CC1)C[N@@H+](Cc1ccc(C)cc1)CCO2 ZINC001164939918 721920836 /nfs/dbraw/zinc/92/08/36/721920836.db2.gz WMFZUVHBGRMOQK-UHFFFAOYSA-N 1 1 413.493 3.187 20 0 HGADMO Cc1ccc(C[N@H+]2CCOC3(CCN(c4ncc(Cl)cc4C(N)=O)CC3)C2)cc1 ZINC001164937887 721921578 /nfs/dbraw/zinc/92/15/78/721921578.db2.gz GRODQALQKHZTIK-UHFFFAOYSA-N 1 1 414.937 3.014 20 0 HGADMO CCOC(=O)c1cnc(C)nc1N1CCC2(CC1)C[N@@H+](Cc1ccc(C)cc1)CCO2 ZINC001164939336 721923878 /nfs/dbraw/zinc/92/38/78/721923878.db2.gz IZBBHBBLIHAQKS-UHFFFAOYSA-N 1 1 424.545 3.142 20 0 HGADMO Cc1ccc(C[N@H+]2CCOC3(CCN(c4cc(OCC5CC5)ncn4)CC3)C2)cc1 ZINC001164940714 721927730 /nfs/dbraw/zinc/92/77/30/721927730.db2.gz YIFZABWCQCQRKY-UHFFFAOYSA-N 1 1 408.546 3.445 20 0 HGADMO Cc1cn(-c2ccc(N3CCC4(CC3)C[N@@H+](Cc3ccc(C)cc3)CCO4)nn2)cn1 ZINC001164938626 721928812 /nfs/dbraw/zinc/92/88/12/721928812.db2.gz BSMNGKVLVKSPTH-UHFFFAOYSA-N 1 1 418.545 3.151 20 0 HGADMO O=C1NCC[N@@H+](Cc2ccccc2)C12CCN(c1ncnc3ccc(Cl)cc31)CC2 ZINC001164943722 721970757 /nfs/dbraw/zinc/97/07/57/721970757.db2.gz CHTSIINEAMCYGC-UHFFFAOYSA-N 1 1 421.932 3.254 20 0 HGADMO O=C1NCC[N@H+](Cc2ccccc2)C12CCN(c1ncnc3ccc(Cl)cc31)CC2 ZINC001164943722 721970761 /nfs/dbraw/zinc/97/07/61/721970761.db2.gz CHTSIINEAMCYGC-UHFFFAOYSA-N 1 1 421.932 3.254 20 0 HGADMO O=C1NCC[N@@H+](Cc2ccccc2)C12CCN(c1ncnc3c(Cl)cccc31)CC2 ZINC001164945113 721971545 /nfs/dbraw/zinc/97/15/45/721971545.db2.gz OZMOWFFCFAXIDH-UHFFFAOYSA-N 1 1 421.932 3.254 20 0 HGADMO O=C1NCC[N@H+](Cc2ccccc2)C12CCN(c1ncnc3c(Cl)cccc31)CC2 ZINC001164945113 721971548 /nfs/dbraw/zinc/97/15/48/721971548.db2.gz OZMOWFFCFAXIDH-UHFFFAOYSA-N 1 1 421.932 3.254 20 0 HGADMO O=C1NCC[N@@H+](Cc2ccccc2)C12CCN(c1ncnc3cc(Cl)ccc31)CC2 ZINC001164945907 721972368 /nfs/dbraw/zinc/97/23/68/721972368.db2.gz UOWXYJGHYZUXHW-UHFFFAOYSA-N 1 1 421.932 3.254 20 0 HGADMO O=C1NCC[N@H+](Cc2ccccc2)C12CCN(c1ncnc3cc(Cl)ccc31)CC2 ZINC001164945907 721972370 /nfs/dbraw/zinc/97/23/70/721972370.db2.gz UOWXYJGHYZUXHW-UHFFFAOYSA-N 1 1 421.932 3.254 20 0 HGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2CC[C@]3(C2)C[C@H](NC(=O)N(C)C)CCO3)nc1 ZINC001164954100 722010919 /nfs/dbraw/zinc/01/09/19/722010919.db2.gz IFKISUYRFHJCKC-TXTKFYIRSA-N 1 1 415.582 3.028 20 0 HGADMO O=C(c1cccnc1N1CCC2(CC[N@@H+](Cc3cccnc3)C2)CC1)N1CCCC1 ZINC001164955820 722012024 /nfs/dbraw/zinc/01/20/24/722012024.db2.gz ZSWOIIXHENABEC-UHFFFAOYSA-N 1 1 405.546 3.205 20 0 HGADMO FC(F)(Oc1cnc(Cl)cn1)N1CCC2(CC[N@@H+](Cc3cccnc3)C2)CC1 ZINC001164958930 722025060 /nfs/dbraw/zinc/02/50/60/722025060.db2.gz GXDKOVNRHGHOTC-UHFFFAOYSA-N 1 1 409.868 3.442 20 0 HGADMO Clc1ncnc2[nH]cc(N3CCC4(CC3)COCC[N@@H+](Cc3ccncc3)C4)c21 ZINC001164961959 722053778 /nfs/dbraw/zinc/05/37/78/722053778.db2.gz ZXNYDBGZNVJFKR-UHFFFAOYSA-N 1 1 412.925 3.077 20 0 HGADMO COc1ccc(Cl)c(N2CCC3(CC2)COCC[N@@H+](Cc2ccncc2)C3)n1 ZINC001164964534 722056133 /nfs/dbraw/zinc/05/61/33/722056133.db2.gz VJWYCBHSMHQUQB-UHFFFAOYSA-N 1 1 402.926 3.258 20 0 HGADMO c1cc(C[N@H+]2CCOCC3(CCN(c4cc(-c5ccncc5)ncn4)CC3)C2)ccn1 ZINC001164961537 722060560 /nfs/dbraw/zinc/06/05/60/722060560.db2.gz LMWPLISRVHPNAJ-UHFFFAOYSA-N 1 1 416.529 3.053 20 0 HGADMO Clc1cccc2c1ncnc2N1CC[C@H]2C[N@@H+](Cc3cccnc3)CCO[C@@H]2C1 ZINC001164981602 722105954 /nfs/dbraw/zinc/10/59/54/722105954.db2.gz LTMDNGATOPXPNO-FXAWDEMLSA-N 1 1 409.921 3.406 20 0 HGADMO c1ccc(Oc2ccnc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)n2)cc1 ZINC001164982317 722107447 /nfs/dbraw/zinc/10/74/47/722107447.db2.gz NMVFDZGZONEXKE-IFMALSPDSA-N 1 1 417.513 3.391 20 0 HGADMO c1ccc(Oc2ccnc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)n2)cc1 ZINC001164982323 722107658 /nfs/dbraw/zinc/10/76/58/722107658.db2.gz NMVFDZGZONEXKE-UNMCSNQZSA-N 1 1 417.513 3.391 20 0 HGADMO Clc1cc2ccnc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)c2cn1 ZINC001164982180 722109559 /nfs/dbraw/zinc/10/95/59/722109559.db2.gz WCYNLUCMQOMAMA-UYAOXDASSA-N 1 1 409.921 3.406 20 0 HGADMO Clc1cccc2nc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)cnc12 ZINC001164982012 722110171 /nfs/dbraw/zinc/11/01/71/722110171.db2.gz VSWBZNYTRFFBLZ-FXAWDEMLSA-N 1 1 409.921 3.406 20 0 HGADMO Clc1ncnc2scc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)c21 ZINC001164974089 722110768 /nfs/dbraw/zinc/11/07/68/722110768.db2.gz ILJLCQFZKBKCNA-RDJZCZTQSA-N 1 1 415.950 3.467 20 0 HGADMO COc1ccc2ccc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)nc2c1 ZINC001164975119 722126557 /nfs/dbraw/zinc/12/65/57/722126557.db2.gz JSRICIXEIPKPEU-NFBKMPQASA-N 1 1 404.514 3.366 20 0 HGADMO CCCN(CCC)c1cncc(N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)n1 ZINC001164983832 722131715 /nfs/dbraw/zinc/13/17/15/722131715.db2.gz VNEPVHRWHPIXTC-FGZHOGPDSA-N 1 1 424.593 3.225 20 0 HGADMO Cc1csc2nc(C)nc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)c12 ZINC001164984571 722147881 /nfs/dbraw/zinc/14/78/81/722147881.db2.gz XCVLXYQBZOZZEU-MOPGFXCFSA-N 1 1 409.559 3.430 20 0 HGADMO CCc1nc2sccc2c(N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)n1 ZINC001164980956 722150098 /nfs/dbraw/zinc/15/00/98/722150098.db2.gz OFZWXTHKQZPEDM-IEBWSBKVSA-N 1 1 409.559 3.376 20 0 HGADMO c1cc(-c2ccc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)nn2)cs1 ZINC001164976195 722152207 /nfs/dbraw/zinc/15/22/07/722152207.db2.gz UWJGXGLYAVDELH-NQIIRXRSSA-N 1 1 407.543 3.327 20 0 HGADMO c1cncc(C[N@H+]2CCO[C@H]3CN(c4ccc(COC5CCC5)cn4)CC[C@H]3C2)c1 ZINC001164974802 722152238 /nfs/dbraw/zinc/15/22/38/722152238.db2.gz QRLIEBRMWFLKFT-GMAHTHKFSA-N 1 1 408.546 3.273 20 0 HGADMO Cc1cc2ncnc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)c2cc1C ZINC001164972662 722152945 /nfs/dbraw/zinc/15/29/45/722152945.db2.gz IVMMVXOCEGGQHZ-REWPJTCUSA-N 1 1 403.530 3.369 20 0 HGADMO CCCc1cc(N2CC[C@H]3OCCN(Cc4csc(C)n4)[C@@H]3CC2)nc(C)[nH+]1 ZINC001164988487 722184014 /nfs/dbraw/zinc/18/40/14/722184014.db2.gz JRPJFZCAQUEYNO-WOJBJXKFSA-N 1 1 401.580 3.372 20 0 HGADMO O=C1NCc2c1cc(Cl)nc2N1CCC[C@]2(CC[N@@H+]2Cc2cccc(F)c2)C1 ZINC001164995503 722203280 /nfs/dbraw/zinc/20/32/80/722203280.db2.gz NVYBQWXXQRVICE-NRFANRHFSA-N 1 1 400.885 3.362 20 0 HGADMO OC[C@H](Cc1ccccc1)[NH2+]Cc1ncc(Br)cc1Br ZINC000135301748 1126076462 /nfs/dbraw/zinc/07/64/62/1126076462.db2.gz VONVAXBTWWEFBD-ZDUSSCGKSA-N 1 1 400.114 3.300 20 0 HGADMO CN(C)Cc1ccc(C[NH2+][C@@H](CO)Cc2c[nH]c3ccccc23)c2c1OC(F)(F)O2 ZINC001560330213 1126210237 /nfs/dbraw/zinc/21/02/37/1126210237.db2.gz HQKIJVZFPPXBPL-QGZVFWFLSA-N 1 1 417.456 3.244 20 0 HGADMO COc1ccc2nc(C)c(C(=O)NCc3ccc(N4CCC[N@@H+](C)CC4)nc3)cc2c1 ZINC000040152047 571199757 /nfs/dbraw/zinc/19/97/57/571199757.db2.gz GNJNVVQKRIKYSJ-UHFFFAOYSA-N 1 1 419.529 3.019 20 0 HGADMO CCOC(=O)[C@]12CCO[C@H]1CCN(c1ccc3c(n1)CC[N@H+](Cc1ccccc1)C3)C2 ZINC001164432022 718974146 /nfs/dbraw/zinc/97/41/46/718974146.db2.gz DUCBTJSQKPIJRF-DHLKQENFSA-N 1 1 421.541 3.188 20 0 HGADMO CCOC(=O)c1cc(Cl)nnc1N1CCC[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21 ZINC001164629652 719066784 /nfs/dbraw/zinc/06/67/84/719066784.db2.gz YKQPSIOHIPGYGL-WMZOPIPTSA-N 1 1 400.910 3.408 20 0 HGADMO CCOC(=O)Cc1c(Cl)ncnc1N1CCC[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21 ZINC001164623600 719079659 /nfs/dbraw/zinc/07/96/59/719079659.db2.gz JWPLDNVHRDBNBA-HKUYNNGSSA-N 1 1 414.937 3.336 20 0 HGADMO CCOC(=O)c1ncnc(Cl)c1N1CCC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]21 ZINC001164625981 719093502 /nfs/dbraw/zinc/09/35/02/719093502.db2.gz HVOLGXXATQPDKE-IAGOWNOFSA-N 1 1 400.910 3.408 20 0 HGADMO C[N@H+]1CCO[C@H]2CN(c3nc(-c4cccnc4)nc4sc5c(c43)CCCC5)C[C@@H]21 ZINC000301684047 719432932 /nfs/dbraw/zinc/43/29/32/719432932.db2.gz WIDIEGFCNZTWRM-IRXDYDNUSA-N 1 1 407.543 3.151 20 0 HGADMO CC[N@H+]1CCCC[C@H]1c1ccc(N2C[C@@H](C(=O)N3CC=CC3)C3(C2)CCOCC3)nc1 ZINC001164678185 719561564 /nfs/dbraw/zinc/56/15/64/719561564.db2.gz VVKOSLJOMUPVES-VXKWHMMOSA-N 1 1 424.589 3.260 20 0 HGADMO CNC(=O)C[N@H+]1CCCC12CCN(C(F)(F)c1nc(Cl)c3ccccc3n1)CC2 ZINC001164685057 719701530 /nfs/dbraw/zinc/70/15/30/719701530.db2.gz QKNVFOXHZNBJNY-UHFFFAOYSA-N 1 1 423.895 3.009 20 0 HGADMO CNC(=O)C[N@H+]1CCCC12CCN(c1nc3ccc(Cl)cc3nc1Cl)CC2 ZINC001164683546 719712516 /nfs/dbraw/zinc/71/25/16/719712516.db2.gz KYAYXHFCNIPQBC-UHFFFAOYSA-N 1 1 408.333 3.117 20 0 HGADMO CNC(=O)C[N@H+]1CCCC12CCN(C(F)(F)c1cc(SC)cnc1Cl)CC2 ZINC001164687495 719737527 /nfs/dbraw/zinc/73/75/27/719737527.db2.gz YHLWGFQFIFRAFN-UHFFFAOYSA-N 1 1 418.941 3.183 20 0 HGADMO CNC(=O)C[N@H+]1CCCC12CCN(C(F)(F)Sc1ccc(Cl)nc1)CC2 ZINC001164690018 719754923 /nfs/dbraw/zinc/75/49/23/719754923.db2.gz OWSBBWYLARVTCU-UHFFFAOYSA-N 1 1 404.914 3.054 20 0 HGADMO CCOC(=O)c1cnc(N2CCC3(CCC[N@H+]3Cc3csc(C)n3)CC2)cn1 ZINC001164693092 719807910 /nfs/dbraw/zinc/80/79/10/719807910.db2.gz PXSLKVUDDWKKEH-UHFFFAOYSA-N 1 1 401.536 3.053 20 0 HGADMO Cc1nc(C[N@H+]2CCCC23CCN(c2ncnc4c2C(C)(C)C(=O)N4)CC3)cs1 ZINC001164693818 719812425 /nfs/dbraw/zinc/81/24/25/719812425.db2.gz YUWDZHHUOIFKGM-UHFFFAOYSA-N 1 1 412.563 3.106 20 0 HGADMO COC(=O)[C@@]1(C)C[C@@H]([NH+]2CCOCC2)CCN1c1nc(Cl)cc2cccc(C)c21 ZINC001164702271 719877145 /nfs/dbraw/zinc/87/71/45/719877145.db2.gz HUDDEVKZTFMZPE-HTAPYJJXSA-N 1 1 417.937 3.429 20 0 HGADMO CCN(C)c1cc(C)[nH+]c(N2CCC3(CC2)CN(Cc2cccs2)CCO3)n1 ZINC001164700300 719886349 /nfs/dbraw/zinc/88/63/49/719886349.db2.gz JIZLRPUVENFIDK-UHFFFAOYSA-N 1 1 401.580 3.174 20 0 HGADMO Clc1nc2c(c(N3CCC4(CC3)C[N@@H+](Cc3cccs3)CCO4)n1)COC2 ZINC001164695699 719889617 /nfs/dbraw/zinc/88/96/17/719889617.db2.gz ROLVUNWQQPIOJW-UHFFFAOYSA-N 1 1 406.939 3.093 20 0 HGADMO CCOc1nc(Cl)cc(N2CCC3(CC2)C[N@@H+](Cc2cccs2)CCO3)n1 ZINC001164695040 719889808 /nfs/dbraw/zinc/88/98/08/719889808.db2.gz JPPWRBURBNJVHD-UHFFFAOYSA-N 1 1 408.955 3.462 20 0 HGADMO COC(=O)c1ccc(Cl)c(N2CCC3(CC2)C[N@@H+](Cc2cccs2)CCO3)n1 ZINC001164699024 719893424 /nfs/dbraw/zinc/89/34/24/719893424.db2.gz VQYUWKLIXWTOAI-UHFFFAOYSA-N 1 1 421.950 3.455 20 0 HGADMO F[C@@H](Oc1cncc(Cl)n1)N1CCC2(CC1)C[N@@H+](Cc1cccs1)CCO2 ZINC001164707351 719903720 /nfs/dbraw/zinc/90/37/20/719903720.db2.gz QDPOEZVPUDQWOZ-QGZVFWFLSA-N 1 1 412.918 3.190 20 0 HGADMO CCOC(=O)Cc1ccnc(N2CCC3(CC2)C[N@@H+](Cc2cccs2)CCO3)c1 ZINC001164706340 719906355 /nfs/dbraw/zinc/90/63/55/719906355.db2.gz ICLYNUSBDAWYPF-UHFFFAOYSA-N 1 1 415.559 3.120 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1nnc(Cl)cc1-c1ccncc1)C2 ZINC001164810857 720082128 /nfs/dbraw/zinc/08/21/28/720082128.db2.gz MBYIYYKWACPODY-AVRDEDQJSA-N 1 1 413.953 3.377 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1ccnc(NC(=O)OC(C)(C)C)n1)C2 ZINC001164814805 720098264 /nfs/dbraw/zinc/09/82/64/720098264.db2.gz WVKFZKAVOWVRGL-VGSWGCGISA-N 1 1 417.554 3.008 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1nc3ccc(OC)cc3nc1Cl)C2 ZINC001164810672 720102391 /nfs/dbraw/zinc/10/23/91/720102391.db2.gz KOLFTNVDDGFFGJ-KSFYIVLOSA-N 1 1 416.953 3.477 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(C(F)(F)COc1ccnc(Cl)c1)C2 ZINC001164812028 720111332 /nfs/dbraw/zinc/11/13/32/720111332.db2.gz OBLBPSQNMKJCCW-APWZRJJASA-N 1 1 415.912 3.387 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1cc(OCc3ccccc3)cnn1)C2 ZINC001164807290 720131295 /nfs/dbraw/zinc/13/12/95/720131295.db2.gz BTIYFJKTAQQYJJ-QPPBQGQZSA-N 1 1 408.546 3.240 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(C(F)(F)COc1cccc(Cl)n1)C2 ZINC001164815857 720138613 /nfs/dbraw/zinc/13/86/13/720138613.db2.gz WLNGXAPZHSPWFK-APWZRJJASA-N 1 1 415.912 3.387 20 0 HGADMO COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1nc(OC)ncc1Cl)CC2 ZINC001164710839 720152009 /nfs/dbraw/zinc/15/20/09/720152009.db2.gz DOEBHMLKLYBITC-QGZVFWFLSA-N 1 1 417.941 3.041 20 0 HGADMO COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1ncc(C(F)F)cn1)CC2 ZINC001164714392 720153652 /nfs/dbraw/zinc/15/36/52/720153652.db2.gz WSUYHQBHMSWDAJ-SFHVURJKSA-N 1 1 403.477 3.317 20 0 HGADMO COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1nc(C)nc(OC)c1C)CC2 ZINC001164711756 720154037 /nfs/dbraw/zinc/15/40/37/720154037.db2.gz JSJDQAOPNAUBPN-FQEVSTJZSA-N 1 1 411.550 3.005 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1nc3ccccc3nc1N1CCCC1)C2 ZINC001164817429 720159575 /nfs/dbraw/zinc/15/95/75/720159575.db2.gz PIOMHQPAUZOWKR-NBGIEHNGSA-N 1 1 421.589 3.415 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(C(F)(F)c1cc(C)nnc1Cl)C2 ZINC001164817068 720172328 /nfs/dbraw/zinc/17/23/28/720172328.db2.gz NUQADMGMQPNIOU-MAUKXSAKSA-N 1 1 400.901 3.168 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(C(F)(F)c1cc(C)nnc1Cl)C2 ZINC001164817069 720173058 /nfs/dbraw/zinc/17/30/58/720173058.db2.gz NUQADMGMQPNIOU-QAPCUYQASA-N 1 1 400.901 3.168 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1nccc(-c3ccccc3OC)n1)C2 ZINC001164816654 720173769 /nfs/dbraw/zinc/17/37/69/720173769.db2.gz LZMLEUFFLCMMAL-CYFREDJKSA-N 1 1 408.546 3.337 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1cc3cc(OC)c(OC)cc3cn1)C2 ZINC001164818872 720176859 /nfs/dbraw/zinc/17/68/59/720176859.db2.gz VEDDOQHULFCSKO-GBXCKJPGSA-N 1 1 411.546 3.437 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1cc3cc(OC)c(OC)cc3cn1)C2 ZINC001164818874 720178022 /nfs/dbraw/zinc/17/80/22/720178022.db2.gz VEDDOQHULFCSKO-RDPSFJRHSA-N 1 1 411.546 3.437 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1nc(-c3cccnc3)nc3c1CCC3)C2 ZINC001164816583 720185821 /nfs/dbraw/zinc/18/58/21/720185821.db2.gz LOGUCLZTIJRCFX-NLFFAJNJSA-N 1 1 419.573 3.212 20 0 HGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1ccc3c(cccc3C(=O)OC)n1)C2 ZINC001164812433 720187728 /nfs/dbraw/zinc/18/77/28/720187728.db2.gz AQKGTLXCATVIJE-HOYKHHGWSA-N 1 1 409.530 3.206 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1ccc(-c3sc(C)nc3C)nn1)C2 ZINC001164813045 720188981 /nfs/dbraw/zinc/18/89/81/720188981.db2.gz CCNRFOAIRYVUNZ-AVRDEDQJSA-N 1 1 413.591 3.402 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(C(F)(F)Oc1ccnc(Cl)c1)C2 ZINC001164812758 720196604 /nfs/dbraw/zinc/19/66/04/720196604.db2.gz MBMBCMQRBAEAFR-YJBOKZPZSA-N 1 1 401.885 3.344 20 0 HGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1cncc(OCC3CCCC3)n1)C2 ZINC001164810762 720196928 /nfs/dbraw/zinc/19/69/28/720196928.db2.gz CNKADTDCMYIJLC-NZQKXSOJSA-N 1 1 400.567 3.230 20 0 HGADMO CC(C)[N@@H+](C)Cc1cc(=O)n2c(n1)CN(c1ccc(-c3ccsc3)nn1)CCC2 ZINC001164818011 720243411 /nfs/dbraw/zinc/24/34/11/720243411.db2.gz WEUBHUUUGPANQA-UHFFFAOYSA-N 1 1 410.547 3.012 20 0 HGADMO CCOC(=O)c1cc(Cl)nc(N2CC[C@@H]3[C@@H]2CC[N@H+]3Cc2cccnc2)c1C ZINC001164724326 720380417 /nfs/dbraw/zinc/38/04/17/720380417.db2.gz JQVYYQVBSPPGHD-MSOLQXFVSA-N 1 1 400.910 3.468 20 0 HGADMO CCC[N@H+]1CCCC[C@@H]1c1ccc(N2CCCn3nnc(Cn4ccnc4)c3C2)nc1 ZINC001164831048 720399288 /nfs/dbraw/zinc/39/92/88/720399288.db2.gz UHKAUEVHFFPGFU-OAQYLSRUSA-N 1 1 420.565 3.265 20 0 HGADMO COC(=O)c1cnc(Cl)cc1C(F)(F)N1CC[C@H]2[C@@H]1CC[N@@H+]2Cc1cccnc1 ZINC001164727169 720436634 /nfs/dbraw/zinc/43/66/34/720436634.db2.gz DEQNAZJXBBGDAJ-IRXDYDNUSA-N 1 1 422.863 3.315 20 0 HGADMO COC(=O)c1cnc(Cl)cc1C(F)(F)N1CC[C@H]2[C@@H]1CC[N@H+]2Cc1cccnc1 ZINC001164727169 720436639 /nfs/dbraw/zinc/43/66/39/720436639.db2.gz DEQNAZJXBBGDAJ-IRXDYDNUSA-N 1 1 422.863 3.315 20 0 HGADMO CC1CCN(C(=O)c2cccnc2N2CC[C@H]3[C@@H]2CC[N@H+]3Cc2cccnc2)CC1 ZINC001164727973 720437026 /nfs/dbraw/zinc/43/70/26/720437026.db2.gz FMJQJMMKQJMUAA-VXKWHMMOSA-N 1 1 405.546 3.202 20 0 HGADMO CC(C)[N@@H+]1[C@@H]2CCN(C(F)(F)c3cc(Cl)ncn3)C[C@H]2C[C@H]1Cn1cccn1 ZINC001164838479 720505383 /nfs/dbraw/zinc/50/53/83/720505383.db2.gz RMAXFOWPEOCFRD-OWCLPIDISA-N 1 1 410.900 3.249 20 0 HGADMO COC(=O)c1cnc(N2CC[C@@H]3[C@H](C[C@H](Cn4cccn4)[N@H+]3C(C)C)C2)c(Cl)c1 ZINC001164834741 720506678 /nfs/dbraw/zinc/50/66/78/720506678.db2.gz HKRRJDSDCFYEBB-ZHALLVOQSA-N 1 1 417.941 3.096 20 0 HGADMO CCOC(=O)c1ccc(N2CC[C@@H]3[C@@H](C[C@@H](Cn4cccn4)[N@H+]3C(C)C)C2)nc1C ZINC001164836015 720507417 /nfs/dbraw/zinc/50/74/17/720507417.db2.gz LNVFLVANXJIWIQ-IRFCIJBXSA-N 1 1 411.550 3.141 20 0 HGADMO COC(=O)c1cc(Cl)nc(N2CC[C@@H]3[C@@H](C[C@@H](Cn4cccn4)[N@H+]3C(C)C)C2)c1 ZINC001164835789 720513394 /nfs/dbraw/zinc/51/33/94/720513394.db2.gz LJTVLUJZNAWZQI-OKZBNKHCSA-N 1 1 417.941 3.096 20 0 HGADMO CSc1ncc(Cl)c(N2CC[C@@H]3[C@@H](C[C@@H](Cn4cccn4)[N@H+]3C(C)C)C2)n1 ZINC001164833822 720517611 /nfs/dbraw/zinc/51/76/11/720517611.db2.gz DRKJNHOLUUGWDR-YQQAZPJKSA-N 1 1 406.987 3.426 20 0 HGADMO CC(C)[N@@H+]1[C@@H]2CCN(c3nc(Cl)nc4ncccc43)C[C@@H]2C[C@H]1Cn1cccn1 ZINC001164839437 720518207 /nfs/dbraw/zinc/51/82/07/720518207.db2.gz UJIUINWAKBQVLD-XYJFISCASA-N 1 1 411.941 3.253 20 0 HGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@@H]2CN(C(F)(F)c3ccc(Cl)nn3)CC[C@@H]21 ZINC001164835280 720519745 /nfs/dbraw/zinc/51/97/45/720519745.db2.gz JNBHGXSXFYJDNV-PMPSAXMXSA-N 1 1 410.900 3.249 20 0 HGADMO COC(=O)c1nc(N2CC[C@@H]3[C@@H](C[C@H](Cn4cccn4)[N@H+]3C(C)C)C2)ccc1Cl ZINC001164835892 720540601 /nfs/dbraw/zinc/54/06/01/720540601.db2.gz IXVBSBPNTZLVQD-LZLYRXPVSA-N 1 1 417.941 3.096 20 0 HGADMO CSc1nc(Cl)ncc1N1CC[C@@H]2[C@H](C[C@H](Cn3cccn3)[N@H+]2C(C)C)C1 ZINC001164842015 720544062 /nfs/dbraw/zinc/54/40/62/720544062.db2.gz WDBXCOFZXJEDLS-BZUAXINKSA-N 1 1 406.987 3.426 20 0 HGADMO COc1ccc2c(c1)ncnc2N1CC[C@@H]2[C@@H](C[C@@H](Cn3cccn3)[N@H+]2C(C)C)C1 ZINC001164834952 720545479 /nfs/dbraw/zinc/54/54/79/720545479.db2.gz GBBVRBIWDZQQKT-NPPFBWRTSA-N 1 1 406.534 3.213 20 0 HGADMO CC(C)[N@@H+]1[C@@H]2CCN(c3ccc(C(=O)NC(C)(C)C)cn3)C[C@H]2C[C@H]1Cn1cccn1 ZINC001164837346 720547116 /nfs/dbraw/zinc/54/71/16/720547116.db2.gz LTYCYQDXIJXVDH-QHAWAJNXSA-N 1 1 424.593 3.184 20 0 HGADMO CC(C)[N@@H+]1[C@@H]2CCN(c3nnc(Cl)c4cccnc43)C[C@@H]2C[C@H]1Cn1cccn1 ZINC001164841449 720547275 /nfs/dbraw/zinc/54/72/75/720547275.db2.gz VXRKUHMPJAEGQP-XYJFISCASA-N 1 1 411.941 3.253 20 0 HGADMO CC(C)[N@@H+]1[C@@H]2CCN(c3nc(Cl)nc4ncsc43)C[C@@H]2C[C@H]1Cn1cccn1 ZINC001164838504 720547809 /nfs/dbraw/zinc/54/78/09/720547809.db2.gz ODFPUEYPFPJFCE-SOUVJXGZSA-N 1 1 417.970 3.314 20 0 HGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@H]2CN(C(F)(F)c3cnc(Cl)cc3N)CC[C@@H]21 ZINC001164840199 720549799 /nfs/dbraw/zinc/54/97/99/720549799.db2.gz SDGQDIZVPZFYRM-MPGHIAIKSA-N 1 1 424.927 3.436 20 0 HGADMO COc1ccc2nc(N3CC[C@@H]4[C@@H](C[C@@H](Cn5cccn5)[N@H+]4C(C)C)C3)ncc2c1 ZINC001164836403 720550755 /nfs/dbraw/zinc/55/07/55/720550755.db2.gz JYYXVOAQRPWTIF-CNNODRBYSA-N 1 1 406.534 3.213 20 0 HGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@@H]2CN(c3nccc(-c4cccnc4F)n3)CC[C@@H]21 ZINC001164841415 720572810 /nfs/dbraw/zinc/57/28/10/720572810.db2.gz VFGUEUQLABXACX-LQWHRVPQSA-N 1 1 421.524 3.252 20 0 HGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@H]2CN(C(F)(F)c3cnc(Cl)c(N)c3)CC[C@@H]21 ZINC001164837810 720592588 /nfs/dbraw/zinc/59/25/88/720592588.db2.gz JQGJYMVGULTTNH-ZVZYQTTQSA-N 1 1 424.927 3.436 20 0 HGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@@H]2CN(c3ccnc(N4CCCCC4)n3)CC[C@@H]21 ZINC001164844153 720599107 /nfs/dbraw/zinc/59/91/07/720599107.db2.gz ZHHFYLNMTOMTQA-HKBOAZHASA-N 1 1 409.582 3.041 20 0 HGADMO Cc1noc(-c2ccc(N3CC[C@@H]4[C@H](C[C@@H](Cn5cccn5)[N@@H+]4C(C)C)C3)nc2)n1 ZINC001164838378 720614014 /nfs/dbraw/zinc/61/40/14/720614014.db2.gz KVRSXOOETXUVJT-HSALFYBXSA-N 1 1 407.522 3.014 20 0 HGADMO CC(C)[N@@H+]1[C@@H]2CCN(c3ncnc(-c4cccc(F)c4)n3)C[C@H]2C[C@H]1Cn1cccn1 ZINC001164841354 720616757 /nfs/dbraw/zinc/61/67/57/720616757.db2.gz RZFXVDWHUVEQBY-HLAWJBBLSA-N 1 1 421.524 3.252 20 0 HGADMO CC(C)OC(=O)c1cccnc1N1CC[C@@H]2[C@H](C[C@H](Cn3cccn3)[N@H+]2C(C)C)C1 ZINC001164835185 720635667 /nfs/dbraw/zinc/63/56/67/720635667.db2.gz AMEVVDWEWHTWDK-SFHLNBCPSA-N 1 1 411.550 3.221 20 0 HGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@@H]2CN(c3ccnc(-c4nccs4)n3)CC[C@@H]21 ZINC001164843204 720646992 /nfs/dbraw/zinc/64/69/92/720646992.db2.gz VDZAAXFRFAMZDO-SQNIBIBYSA-N 1 1 409.563 3.174 20 0 HGADMO C[N@@H+](Cc1ccccc1)[C@H]1COC2(C1)CCN(c1cc(Cl)ncc1C(N)=O)CC2 ZINC001164843222 720665369 /nfs/dbraw/zinc/66/53/69/720665369.db2.gz VNOAKHSEYDMIFF-QGZVFWFLSA-N 1 1 414.937 3.094 20 0 HGADMO CCCNC(=O)c1cccnc1N1CCC2(C[C@@H]([N@@H+](C)Cc3ccccc3)CO2)CC1 ZINC001164837686 720711595 /nfs/dbraw/zinc/71/15/95/720711595.db2.gz GNCMWWMAZQXDJG-OAQYLSRUSA-N 1 1 422.573 3.481 20 0 HGADMO COc1ccc2c(cc(Cl)nc2N2CC[N@H+]3C[C@H](Oc4cncnc4)C[C@@H]3C2)c1 ZINC001164744842 720729346 /nfs/dbraw/zinc/72/93/46/720729346.db2.gz SVWAWJILTFLRJF-NVXWUHKLSA-N 1 1 411.893 3.029 20 0 HGADMO Cc1nc(-c2ccccc2)nc(Cl)c1N1CC[N@H+]2C[C@@H](Oc3cncnc3)C[C@H]2C1 ZINC001164737160 720772084 /nfs/dbraw/zinc/77/20/84/720772084.db2.gz AEXDROJZAWSSMV-ROUUACIJSA-N 1 1 422.920 3.237 20 0 HGADMO Clc1cccc2nc(Cl)c(N3CC[N@H+]4C[C@@H](Oc5cncnc5)C[C@H]4C3)nc12 ZINC001164742758 720800896 /nfs/dbraw/zinc/80/08/96/720800896.db2.gz DMYSRNGNJPMXAM-STQMWFEESA-N 1 1 417.300 3.069 20 0 HGADMO FC(F)(c1cccc(Cl)n1)N1CC[C@@H]2[C@@H](C[C@@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164745424 720810362 /nfs/dbraw/zinc/81/03/62/720810362.db2.gz KHRDDZWVJNFEQV-YESZJQIVSA-N 1 1 422.911 3.251 20 0 HGADMO FC(F)(c1ccnc(Cl)c1)N1CC[C@@H]2[C@H](C[C@@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164748952 720810614 /nfs/dbraw/zinc/81/06/14/720810614.db2.gz SBWRLIJANJRMJQ-BPQIPLTHSA-N 1 1 422.911 3.251 20 0 HGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2C[C@H]3CN(Cc4ccncc4)C(=O)[C@@H]3C2)nc1 ZINC001164853204 720814220 /nfs/dbraw/zinc/81/42/20/720814220.db2.gz QOOGRTLWHGJLDY-BHDDXSALSA-N 1 1 405.546 3.118 20 0 HGADMO Cc1sc2ncnc(N3CC[C@@H]4[C@@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)c2c1C ZINC001164751995 720815303 /nfs/dbraw/zinc/81/53/03/720815303.db2.gz YJAMETKSJGTDHW-GBESFXJTSA-N 1 1 423.590 3.279 20 0 HGADMO Clc1ccnc2c1ccnc2N1CC[C@@H]2[C@H](C[C@@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164738783 720815731 /nfs/dbraw/zinc/81/57/31/720815731.db2.gz GLOIGAXYFNIEFE-FUHIMQAGSA-N 1 1 423.952 3.254 20 0 HGADMO c1ncn(C[C@@H]2C[C@@H]3CN(c4ccc(-c5ccccc5)nn4)CC[C@H]3[N@H+]2CC2CC2)n1 ZINC001164738418 720816175 /nfs/dbraw/zinc/81/61/75/720816175.db2.gz FRDRKVKYWSKJSS-FUPPJEDESA-N 1 1 415.545 3.115 20 0 HGADMO Clc1cnc2nc(N3CC[C@@H]4[C@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)ccc2c1 ZINC001164740314 720825643 /nfs/dbraw/zinc/82/56/43/720825643.db2.gz KDHLVHYENXDDPA-YZGWKJHDSA-N 1 1 423.952 3.254 20 0 HGADMO COc1ccc2ccc(N3CC[C@@H]4[C@@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)nc2c1 ZINC001164742969 720835278 /nfs/dbraw/zinc/83/52/78/720835278.db2.gz HPVADJSDDKSYCS-SXWKCWPCSA-N 1 1 418.545 3.214 20 0 HGADMO COc1ccc2ccc(N3CC[C@@H]4[C@@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)nc2c1 ZINC001164742967 720835336 /nfs/dbraw/zinc/83/53/36/720835336.db2.gz HPVADJSDDKSYCS-MIZPHKNDSA-N 1 1 418.545 3.214 20 0 HGADMO c1csc(-c2cc(N3CC[C@@H]4[C@@H](C[C@H](Cn5cncn5)[N@@H+]4CC4CC4)C3)ncn2)c1 ZINC001164749502 720850421 /nfs/dbraw/zinc/85/04/21/720850421.db2.gz VYAZNYQLOSJPEE-NLWGTHIKSA-N 1 1 421.574 3.176 20 0 HGADMO COCC[N@H+]1CCO[C@@H]2CN(c3nc4ccccc4c(-c4ccccc4)n3)CC[C@H]2C1 ZINC001164856007 720852743 /nfs/dbraw/zinc/85/27/43/720852743.db2.gz NHJSQBKNPHEUGN-NZQKXSOJSA-N 1 1 418.541 3.470 20 0 HGADMO COCC[N@H+]1CCO[C@@H]2CN(c3nc(Cl)nc4cc(Cl)ccc43)CC[C@H]2C1 ZINC001164859608 720854005 /nfs/dbraw/zinc/85/40/05/720854005.db2.gz USUBELJHYOPBNQ-SUMWQHHRSA-N 1 1 411.333 3.110 20 0 HGADMO COCC[N@H+]1CCO[C@H]2CN(c3ncc(OC)c4ccc(Cl)cc43)CC[C@H]2C1 ZINC001164853126 720855410 /nfs/dbraw/zinc/85/54/10/720855410.db2.gz GNDAZGGNGDGEAD-YWZLYKJASA-N 1 1 405.926 3.070 20 0 HGADMO COc1cccnc1N1CC[C@@]2(C1)C[N@@H+](CC1CC1)C[C@@H]2COCc1cccnc1 ZINC001164747128 720878089 /nfs/dbraw/zinc/87/80/89/720878089.db2.gz ABSYKTWNNYCIFE-QPPBQGQZSA-N 1 1 408.546 3.240 20 0 HGADMO CCOc1ccnc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COCc2cccnc2)n1 ZINC001164756816 720884223 /nfs/dbraw/zinc/88/42/23/720884223.db2.gz RDHHMVALLICLTI-URXFXBBRSA-N 1 1 423.561 3.025 20 0 HGADMO CCc1cc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COCc2cccnc2)nc(C)n1 ZINC001164755922 720897787 /nfs/dbraw/zinc/89/77/87/720897787.db2.gz NFSIOQBUNMEOHB-WIOPSUGQSA-N 1 1 421.589 3.498 20 0 HGADMO Clc1ccc(C[NH+]2CCCC2)c(N2C[C@H](OCc3cccnc3)[C@H]3COC[C@@H]32)n1 ZINC001164762858 721006320 /nfs/dbraw/zinc/00/63/20/721006320.db2.gz WNFJEEVWCUQUDI-UFYCRDLUSA-N 1 1 414.937 3.146 20 0 HGADMO CC(C)N(C)Cc1cnc2n1CCN(c1ccc(OCC3CC[NH2+]CC3)cn1)[C@@H]2C ZINC001164858800 721020006 /nfs/dbraw/zinc/02/00/06/721020006.db2.gz GYSGXKUWYRDAGO-GOSISDBHSA-N 1 1 412.582 3.078 20 0 HGADMO C[N@@H+](Cc1ccc(N2CCC[C@]3(C[C@H](OCc4ccccn4)CO3)C2)nc1)C1CC1 ZINC001164765368 721030881 /nfs/dbraw/zinc/03/08/81/721030881.db2.gz OVGNMPLFJBDSBM-UPVQGACJSA-N 1 1 408.546 3.416 20 0 HGADMO FC(F)(c1ccc(Cl)nc1Cl)N1CCc2[nH+]cc(Cn3cccn3)n2CC1 ZINC001164862682 721031853 /nfs/dbraw/zinc/03/18/53/721031853.db2.gz OLFFYJWAXZBWBM-UHFFFAOYSA-N 1 1 413.259 3.437 20 0 HGADMO Clc1c[nH]c2nc(Cl)nc(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@@H]4C3)c12 ZINC001164871531 721044655 /nfs/dbraw/zinc/04/46/55/721044655.db2.gz ZNHJQRMKZQDGPN-KGLIPLIRSA-N 1 1 419.316 3.139 20 0 HGADMO FC(F)(COc1ccnc(Cl)c1)N1CC[N@H+]2C[C@@H](OCc3cccnc3)C[C@H]2C1 ZINC001164863414 721083935 /nfs/dbraw/zinc/08/39/35/721083935.db2.gz CGCDYNSVKZDEGB-WMZOPIPTSA-N 1 1 424.879 3.077 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4nc(Cl)nc5c(F)cccc54)C[C@H]3C2)cn1 ZINC001164762537 721118677 /nfs/dbraw/zinc/11/86/77/721118677.db2.gz CSUKKANXOVDZFD-LSDHHAIUSA-N 1 1 400.889 3.114 20 0 HGADMO CSc1nc2ccsc2c(N2C[C@@H]3CC[N@@H+](Cc4cnn(C)c4)C[C@H]3C2)n1 ZINC001164771727 721119495 /nfs/dbraw/zinc/11/94/95/721119495.db2.gz SSZWUZJCJPWYTM-GJZGRUSLSA-N 1 1 400.577 3.105 20 0 HGADMO CC(C)(C)c1nc2[nH]ccc2c(N2CC[N@H+]3C[C@H](OCc4cccnc4)C[C@H]3C2)n1 ZINC001164871560 721127352 /nfs/dbraw/zinc/12/73/52/721127352.db2.gz FGUJSYXNQRRXGH-ZWKOTPCHSA-N 1 1 406.534 3.130 20 0 HGADMO COc1ccc(-c2cc(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@H]4C3)ncn2)cc1 ZINC001164877019 721153711 /nfs/dbraw/zinc/15/37/11/721153711.db2.gz NWKJAFIURWEICN-RBBKRZOGSA-N 1 1 417.513 3.027 20 0 HGADMO c1ccc(Oc2nccnc2N2CC[N@H+]3C[C@H](OCc4cccnc4)C[C@H]3C2)cc1 ZINC001164880716 721171760 /nfs/dbraw/zinc/17/17/60/721171760.db2.gz XFFPBOWCGUYYJV-PZJWPPBQSA-N 1 1 403.486 3.144 20 0 HGADMO Cc1cc(-c2ccccc2F)nnc1N1CC[N@H+]2C[C@H](OCc3cccnc3)C[C@@H]2C1 ZINC001164876483 721181170 /nfs/dbraw/zinc/18/11/70/721181170.db2.gz MRWODYFUMIPJRW-WOJBJXKFSA-N 1 1 419.504 3.466 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4cc(F)cc5ncnc(Cl)c54)C[C@H]3C2)cn1 ZINC001164772348 721181747 /nfs/dbraw/zinc/18/17/47/721181747.db2.gz SQBGDNAVBMXQDL-HUUCEWRRSA-N 1 1 400.889 3.114 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4ncnc5[nH]c6ccc(Cl)cc6c54)C[C@H]3C2)cn1 ZINC001164765063 721184510 /nfs/dbraw/zinc/18/45/10/721184510.db2.gz HOKTZBCPNXGBLK-HZPDHXFCSA-N 1 1 421.936 3.456 20 0 HGADMO Cc1cnc(N2CC[N@H+]3C[C@H](OCc4cccnc4)C[C@@H]3C2)nc1-c1ccccc1F ZINC001164875434 721184801 /nfs/dbraw/zinc/18/48/01/721184801.db2.gz LPLVJUBERYDGGC-WOJBJXKFSA-N 1 1 419.504 3.466 20 0 HGADMO CC(C)n1ccc2c1nc(Cl)nc2N1C[C@H]2CC[N@@H+](Cc3cnn(C)c3)C[C@@H]2C1 ZINC001164771439 721185052 /nfs/dbraw/zinc/18/50/52/721185052.db2.gz PVBLRPXTMJMCMD-IAGOWNOFSA-N 1 1 413.957 3.357 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4ncc(Cl)nc4-c4ccccc4)C[C@H]3C2)cn1 ZINC001164772372 721214995 /nfs/dbraw/zinc/21/49/95/721214995.db2.gz TXSUEOUSTIEUHJ-RBUKOAKNSA-N 1 1 408.937 3.489 20 0 HGADMO CCN(c1ccccc1)c1cc(N2C[C@H]3CC[N@@H+](Cc4cnn(C)c4)C[C@@H]3C2)ncn1 ZINC001164772422 721224791 /nfs/dbraw/zinc/22/47/91/721224791.db2.gz UQENTQXFFXXRGY-NHCUHLMSSA-N 1 1 417.561 3.326 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(C(F)(F)c4cc(Cl)nc5c4CCC5)C[C@@H]3C2)cn1 ZINC001164765484 721248801 /nfs/dbraw/zinc/24/88/01/721248801.db2.gz RLRPGHYSMIBBEO-CVEARBPZSA-N 1 1 421.923 3.460 20 0 HGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(C(F)(F)c4cc(Cl)nc5c4CCC5)C[C@H]3C2)cn1 ZINC001164765486 721249611 /nfs/dbraw/zinc/24/96/11/721249611.db2.gz RLRPGHYSMIBBEO-HZPDHXFCSA-N 1 1 421.923 3.460 20 0 HGADMO C[N@@H+](Cc1ccc(N2CCC3(C[C@@H](Oc4ncccc4F)CO3)CC2)nc1)C1CC1 ZINC001164777679 721327164 /nfs/dbraw/zinc/32/71/64/721327164.db2.gz PFARZDMMKZGHBA-LJQANCHMSA-N 1 1 412.509 3.417 20 0 HGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@@]2(CCCN(c3ncc4ccccc4n3)C2)C1 ZINC001164778665 721331108 /nfs/dbraw/zinc/33/11/08/721331108.db2.gz XZGSADIANLQSOC-QHCPKHFHSA-N 1 1 407.518 3.354 20 0 HGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@@]2(CCCN(c3ncc4ccccc4n3)C2)C1 ZINC001164778665 721331109 /nfs/dbraw/zinc/33/11/09/721331109.db2.gz XZGSADIANLQSOC-QHCPKHFHSA-N 1 1 407.518 3.354 20 0 HGADMO CCOc1ccc(N2CCC[C@]3(C2)COCC[N@@H+](Cc2c(C)noc2C)C3)nc1 ZINC001164780083 721345570 /nfs/dbraw/zinc/34/55/70/721345570.db2.gz ZKNJYIIKXDYITF-QFIPXVFZSA-N 1 1 400.523 3.204 20 0 HGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@]2(CCCN(c3nc(C)c(C)nc3Cl)C2)C1 ZINC001164778296 721351515 /nfs/dbraw/zinc/35/15/15/721351515.db2.gz LZVAAIZCSKMUJS-OAQYLSRUSA-N 1 1 419.957 3.471 20 0 HGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@]2(CCCN(c3nc(C)c(C)nc3Cl)C2)C1 ZINC001164778296 721351521 /nfs/dbraw/zinc/35/15/21/721351521.db2.gz LZVAAIZCSKMUJS-OAQYLSRUSA-N 1 1 419.957 3.471 20 0 HGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@@]2(CCCN(c3ncnc4[nH]c(C)c(C)c43)C2)C1 ZINC001164776201 721352328 /nfs/dbraw/zinc/35/23/28/721352328.db2.gz ALEZDMYMSAEIGZ-QHCPKHFHSA-N 1 1 424.549 3.299 20 0 HGADMO CCOc1cccnc1N1CCC[C@]2(C1)COCC[N@H+](Cc1c(C)noc1C)C2 ZINC001164780258 721371946 /nfs/dbraw/zinc/37/19/46/721371946.db2.gz DVXQEMMCJZDCFA-QFIPXVFZSA-N 1 1 400.523 3.204 20 0 HGADMO CCOc1cccnc1N1CCC[C@]2(C1)COCC[N@@H+](Cc1c(C)noc1C)C2 ZINC001164780258 721371950 /nfs/dbraw/zinc/37/19/50/721371950.db2.gz DVXQEMMCJZDCFA-QFIPXVFZSA-N 1 1 400.523 3.204 20 0 HGADMO CCC[N@H+]1CCCC[C@H]1c1ccc(N2CC[C@@]3(CC(=O)N(c4cnn(C)c4)C3)C2)nc1 ZINC001164886603 721373647 /nfs/dbraw/zinc/37/36/47/721373647.db2.gz MOEBWCDFPYGWAK-XUZZJYLKSA-N 1 1 422.577 3.386 20 0 HGADMO COc1ccc2nc(N3CC[C@]4(C3)CCC[C@H](CN3CC[NH+](C)CC3)O4)c(C)cc2c1 ZINC001164887126 721380747 /nfs/dbraw/zinc/38/07/47/721380747.db2.gz HAKMCMFAEIVXEN-RDGATRHJSA-N 1 1 424.589 3.317 20 0 HGADMO CCOC(=O)c1c(Cl)cc(C)nc1N1C[C@@H]2C[NH+](Cc3nccs3)C[C@H]2C1 ZINC001164785053 721391978 /nfs/dbraw/zinc/39/19/78/721391978.db2.gz KTYYXFDEOPLBQU-KBPBESRZSA-N 1 1 406.939 3.245 20 0 HGADMO C[NH+]1CCN(C[C@@H]2CCC[C@]3(CCN(c4cc(Oc5ccccc5)ncn4)C3)O2)CC1 ZINC001164886707 721392183 /nfs/dbraw/zinc/39/21/83/721392183.db2.gz FOFLYFVHZQVWKL-XUZZJYLKSA-N 1 1 423.561 3.034 20 0 HGADMO C[NH+]1CCN(C[C@H]2CCC[C@]3(CCN(c4nccc5cc(Cl)ncc54)C3)O2)CC1 ZINC001164885736 721400769 /nfs/dbraw/zinc/40/07/69/721400769.db2.gz HDBYXSODCAWIDO-XMSQKQJNSA-N 1 1 415.969 3.049 20 0 HGADMO c1csc(C[NH+]2C[C@H]3CN(c4nccnc4C4SCCCS4)C[C@@H]3C2)n1 ZINC001164787636 721402573 /nfs/dbraw/zinc/40/25/73/721402573.db2.gz QLSMUWLUKCGYJA-KBPBESRZSA-N 1 1 405.618 3.370 20 0 HGADMO C[NH+]1CCN(C[C@@H]2CCC[C@@]3(CCN(c4cnc5cc(Cl)ccc5n4)C3)O2)CC1 ZINC001164883507 721403108 /nfs/dbraw/zinc/40/31/08/721403108.db2.gz AHMPDAYZXPAVBO-AVRDEDQJSA-N 1 1 415.969 3.049 20 0 HGADMO CCOC(=O)c1cc(N2C[C@@H]3C[N@@H+](Cc4nccs4)C[C@@H]3C2)nc2ccccc21 ZINC001164785460 721408573 /nfs/dbraw/zinc/40/85/73/721408573.db2.gz MJPDKIKVQNWJDQ-IYBDPMFKSA-N 1 1 408.527 3.436 20 0 HGADMO CCOC(=O)c1cc(N2C[C@@H]3C[N@H+](Cc4nccs4)C[C@@H]3C2)nc2ccccc21 ZINC001164785460 721408575 /nfs/dbraw/zinc/40/85/75/721408575.db2.gz MJPDKIKVQNWJDQ-IYBDPMFKSA-N 1 1 408.527 3.436 20 0 HGADMO COc1ccc2nc(N3CC[C@@]4(C3)CCC[C@@H](CN3CC[NH+](C)CC3)O4)cc(C)c2c1 ZINC001164893019 721411870 /nfs/dbraw/zinc/41/18/70/721411870.db2.gz ZVXZWKVQNNHBNI-SQJMNOBHSA-N 1 1 424.589 3.317 20 0 HGADMO FC(F)(COc1cccc(Cl)n1)N1C[C@H]2C[NH+](Cc3nccs3)C[C@@H]2C1 ZINC001164785014 721417113 /nfs/dbraw/zinc/41/71/13/721417113.db2.gz MCRPVFJGEWEKOZ-CHWSQXEVSA-N 1 1 400.882 3.227 20 0 HGADMO C[NH+]1CCN(C[C@@H]2CCC[C@@]3(CCN(c4ncc5c(Cl)cccc5n4)C3)O2)CC1 ZINC001164888971 721417193 /nfs/dbraw/zinc/41/71/93/721417193.db2.gz PVXOBPDAQUMTGT-JTSKRJEESA-N 1 1 415.969 3.049 20 0 HGADMO C[NH+]1CCN(C[C@H]2CCC[C@]3(CCN(c4cccc(OC(C)(C)C)n4)C3)O2)CC1 ZINC001164891456 721419129 /nfs/dbraw/zinc/41/91/29/721419129.db2.gz WHUJHLYROGXRRE-AUSIDOKSSA-N 1 1 402.583 3.024 20 0 HGADMO CN(C)c1ccc(-c2ccnc(N3C[C@@H]4C[NH+](Cc5nccs5)C[C@H]4C3)n2)cc1 ZINC001164791043 721421753 /nfs/dbraw/zinc/42/17/53/721421753.db2.gz YZLAVOYZRQMRBP-ROUUACIJSA-N 1 1 406.559 3.234 20 0 HGADMO Cc1ccc(-c2ccc(N3CC[C@@]4(C3)CCC[C@@H](CN3CC[NH+](C)CC3)O4)nn2)cc1 ZINC001164896578 721432549 /nfs/dbraw/zinc/43/25/49/721432549.db2.gz RNKAYAPDLXELSK-WIOPSUGQSA-N 1 1 421.589 3.217 20 0 HGADMO Cc1csc2nc(C)nc(N3CC[C@]4(C3)CCC[C@H](CN3CC[NH+](C)CC3)O4)c12 ZINC001164890241 721441516 /nfs/dbraw/zinc/44/15/16/721441516.db2.gz CQSBSOUZNDWBBA-GCJKJVERSA-N 1 1 415.607 3.074 20 0 HGADMO Cc1cc2ncnc(N3CC[C@]4(C3)CCC[C@H](CN3CC[NH+](C)CC3)O4)c2cc1C ZINC001164890735 721445590 /nfs/dbraw/zinc/44/55/90/721445590.db2.gz DRFITGMZHOVLET-YKSBVNFPSA-N 1 1 409.578 3.012 20 0 HGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1ncnc3[nH]cc(C)c31)CC2 ZINC001164784496 721448397 /nfs/dbraw/zinc/44/83/97/721448397.db2.gz FSSMJQJGIAWKJR-LJQANCHMSA-N 1 1 413.566 3.000 20 0 HGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1ncc(Cl)cc1OC)CC2 ZINC001164789273 721452500 /nfs/dbraw/zinc/45/25/00/721452500.db2.gz UGHFSFLNRQLVKQ-LJQANCHMSA-N 1 1 423.985 3.478 20 0 HGADMO CCOc1ccnc(N2CCC3(C[C@H](COCC4CC4)[N@H+](CCOC)C3)CC2)c1 ZINC001164788705 721459279 /nfs/dbraw/zinc/45/92/79/721459279.db2.gz VRMWLKJBYAPPMX-HXUWFJFHSA-N 1 1 403.567 3.214 20 0 HGADMO CCOc1ccnc(N2CCC3(C[C@H](COCC4CC4)[N@@H+](CCOC)C3)CC2)c1 ZINC001164788705 721459280 /nfs/dbraw/zinc/45/92/80/721459280.db2.gz VRMWLKJBYAPPMX-HXUWFJFHSA-N 1 1 403.567 3.214 20 0 HGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1c(Cl)nccc1OC)CC2 ZINC001164788026 721470166 /nfs/dbraw/zinc/47/01/66/721470166.db2.gz HPPUPGKBRKUNLZ-GOSISDBHSA-N 1 1 423.985 3.478 20 0 HGADMO O=C(c1cccnc1N1CC[N@H+]2C[C@@H](Oc3cccc(F)c3)C[C@H]2C1)N1CCCCC1 ZINC001164900669 721513700 /nfs/dbraw/zinc/51/37/00/721513700.db2.gz SRCOQDTZRRCSOX-FPOVZHCZSA-N 1 1 424.520 3.189 20 0 HGADMO Fc1cccc(O[C@H]2C[C@@H]3CN(c4nc(Cl)nc5ncsc54)CC[N@H+]3C2)c1 ZINC001164908612 721535788 /nfs/dbraw/zinc/53/57/88/721535788.db2.gz PUODREVGXFWMMC-OCCSQVGLSA-N 1 1 405.886 3.221 20 0 HGADMO CCOC(=O)/C=C\c1ccc(N2CC[N@H+]3C[C@H](Oc4cccc(F)c4)C[C@@H]3C2)nc1 ZINC001164907330 721543083 /nfs/dbraw/zinc/54/30/83/721543083.db2.gz MYCYVWHPCNUXGM-VRBGDJKOSA-N 1 1 411.477 3.139 20 0 HGADMO COc1cc2c(cc1F)ncnc2N1CC[N@H+]2C[C@@H](Oc3cccc(F)c3)C[C@H]2C1 ZINC001164903007 721544241 /nfs/dbraw/zinc/54/42/41/721544241.db2.gz BREFVRDQUUDLGG-RDJZCZTQSA-N 1 1 412.440 3.259 20 0 HGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(C(F)(F)c2cnc(Cl)cc2N)[C@@H]2CCCO[C@@H]12 ZINC001164808646 721557828 /nfs/dbraw/zinc/55/78/28/721557828.db2.gz VGYANMZFGZPKFS-ZHALLVOQSA-N 1 1 423.895 3.125 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(C(F)(F)c2cnc(Cl)cc2N)[C@@H]2CCCO[C@@H]12 ZINC001164808646 721557834 /nfs/dbraw/zinc/55/78/34/721557834.db2.gz VGYANMZFGZPKFS-ZHALLVOQSA-N 1 1 423.895 3.125 20 0 HGADMO COc1ccc2nc(N3CC[N@H+]4C[C@@H](Oc5cccc(F)c5)C[C@H]4C3)c(C)nc2c1 ZINC001164910344 721558145 /nfs/dbraw/zinc/55/81/45/721558145.db2.gz WJHBFNMACODGLV-PXNSSMCTSA-N 1 1 408.477 3.428 20 0 HGADMO COc1ccc2nc(N3CC[N@H+]4C[C@H](Oc5cccc(F)c5)C[C@@H]4C3)c(C)nc2c1 ZINC001164910348 721558491 /nfs/dbraw/zinc/55/84/91/721558491.db2.gz WJHBFNMACODGLV-YLJYHZDGSA-N 1 1 408.477 3.428 20 0 HGADMO C=Cc1nc(Cl)nc(N2C[C@H]([N@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@@H]32)c1OC ZINC001164806670 721574596 /nfs/dbraw/zinc/57/45/96/721574596.db2.gz QQJWBHPOQHCKTF-JENIJYKNSA-N 1 1 415.925 3.045 20 0 HGADMO C=Cc1nc(Cl)nc(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@@H]32)c1OC ZINC001164806670 721574599 /nfs/dbraw/zinc/57/45/99/721574599.db2.gz QQJWBHPOQHCKTF-JENIJYKNSA-N 1 1 415.925 3.045 20 0 HGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2cc(-c3ccccc3)ncn2)[C@@H]2CCCO[C@H]12 ZINC001164804032 721575226 /nfs/dbraw/zinc/57/52/26/721575226.db2.gz KYOVOODODCASEG-AKFKNWHVSA-N 1 1 401.514 3.407 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2cc(-c3ccccc3)ncn2)[C@@H]2CCCO[C@H]12 ZINC001164804032 721575229 /nfs/dbraw/zinc/57/52/29/721575229.db2.gz KYOVOODODCASEG-AKFKNWHVSA-N 1 1 401.514 3.407 20 0 HGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2ccc(-c3ccsc3)nn2)[C@@H]2CCCO[C@@H]12 ZINC001164811292 721587448 /nfs/dbraw/zinc/58/74/48/721587448.db2.gz XDRNXKONYWWAKJ-KCZVDYSFSA-N 1 1 407.543 3.468 20 0 HGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2ccc(-c3ccsc3)nn2)[C@@H]2CCCO[C@@H]12 ZINC001164811292 721587451 /nfs/dbraw/zinc/58/74/51/721587451.db2.gz XDRNXKONYWWAKJ-KCZVDYSFSA-N 1 1 407.543 3.468 20 0 HGADMO CN(C)c1cc(Cl)nc(N2CCc3c(C[N@H+](C)Cc4ccco4)cncc3C2)n1 ZINC001164910927 721755602 /nfs/dbraw/zinc/75/56/02/721755602.db2.gz UQNWRYXKUKMMBZ-UHFFFAOYSA-N 1 1 412.925 3.379 20 0 HGADMO CN(C)c1cc(Cl)nc(N2CCc3c(C[N@@H+](C)Cc4ccco4)cncc3C2)n1 ZINC001164910927 721755607 /nfs/dbraw/zinc/75/56/07/721755607.db2.gz UQNWRYXKUKMMBZ-UHFFFAOYSA-N 1 1 412.925 3.379 20 0 HGADMO C[N@H+](Cc1ccco1)Cc1cncc2c1CCN(c1nc(Cl)cc3c1CNC3=O)C2 ZINC001164911423 721757247 /nfs/dbraw/zinc/75/72/47/721757247.db2.gz VNQXFXAGTPDCNP-UHFFFAOYSA-N 1 1 423.904 3.161 20 0 HGADMO C[N@@H+](Cc1ccco1)Cc1cncc2c1CCN(c1nc(Cl)cc3c1CNC3=O)C2 ZINC001164911423 721757254 /nfs/dbraw/zinc/75/72/54/721757254.db2.gz VNQXFXAGTPDCNP-UHFFFAOYSA-N 1 1 423.904 3.161 20 0 HGADMO Cc1cc(Cl)nc(N2C[C@@H]3CCC[C@@H]([N@@H+](C)Cc4ccccn4)[C@@H]3C2)c1C(N)=O ZINC001165024681 721801756 /nfs/dbraw/zinc/80/17/56/721801756.db2.gz MRIGYDCUUOKQAZ-CGTJXYLNSA-N 1 1 413.953 3.274 20 0 HGADMO CCOC(=O)Cc1cccnc1N1C[C@@H]2CCC[C@H]([N@@H+](C)Cc3ccccn3)[C@H]2C1 ZINC001165017754 721804414 /nfs/dbraw/zinc/80/44/14/721804414.db2.gz AJXLKUSGHGNSEI-BVSLBCMMSA-N 1 1 408.546 3.319 20 0 HGADMO CCOC(=O)Cc1ccc(N2C[C@@H]3CCC[C@@H]([N@@H+](C)Cc4ccccn4)[C@@H]3C2)nc1 ZINC001165026239 721812731 /nfs/dbraw/zinc/81/27/31/721812731.db2.gz POVUMDWPJYGLKG-KSEOMHKRSA-N 1 1 408.546 3.319 20 0 HGADMO COC(=O)c1nc(Cl)cnc1N1C[C@@H]2CCC[C@@H]([N@@H+](C)Cc3ccccn3)[C@@H]2C1 ZINC001165028984 721813494 /nfs/dbraw/zinc/81/34/94/721813494.db2.gz YJSXHGHXPIKXRN-USXIJHARSA-N 1 1 415.925 3.049 20 0 HGADMO C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@H]2CN(c3[nH]c4cc(=O)[nH]c-4cc3Cl)C[C@H]21 ZINC001165022725 721813904 /nfs/dbraw/zinc/81/39/04/721813904.db2.gz GWBKJKNKYLBXIH-YYFZDKIDSA-N 1 1 411.937 3.362 20 0 HGADMO CCOC(=O)c1ncnc(N2C[C@@H]3CCC[C@@H]([N@@H+](C)Cc4ccccn4)[C@@H]3C2)c1C ZINC001165023606 721814869 /nfs/dbraw/zinc/81/48/69/721814869.db2.gz IJXVQSQFSBSZSE-DFQSSKMNSA-N 1 1 409.534 3.094 20 0 HGADMO CCCNC(=O)c1cccnc1N1C[C@@H]2CCC[C@H]([N@@H+](C)Cc3ccccn3)[C@@H]2C1 ZINC001165023267 721823420 /nfs/dbraw/zinc/82/34/20/721823420.db2.gz IMXAZXIJSKTLAU-BWAGFHJFSA-N 1 1 407.562 3.353 20 0 HGADMO C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@@H]2CN(c3ncnc4c3ncn4C3CC3)C[C@H]21 ZINC001165024437 721825135 /nfs/dbraw/zinc/82/51/35/721825135.db2.gz JVRSQVFZMPNRPB-NSISKUIASA-N 1 1 403.534 3.293 20 0 HGADMO C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@H]2CN(c3cc(N4CCSCC4)ncn3)C[C@@H]21 ZINC001165025657 721828296 /nfs/dbraw/zinc/82/82/96/721828296.db2.gz NFDIDNQRUIJKDH-SESVDKBCSA-N 1 1 424.618 3.162 20 0 HGADMO CN(C)CC[N@@H+]1CC[C@H]2[C@H]1CCN2c1cnc(Cl)nc1Oc1ccc(F)cc1 ZINC001164935516 721880408 /nfs/dbraw/zinc/88/04/08/721880408.db2.gz XEZONICYRXHDGP-SJORKVTESA-N 1 1 405.905 3.276 20 0 HGADMO CN(C)CC[N@H+]1CC[C@H]2[C@H]1CCN2c1cnc(Cl)nc1Oc1ccc(F)cc1 ZINC001164935516 721880410 /nfs/dbraw/zinc/88/04/10/721880410.db2.gz XEZONICYRXHDGP-SJORKVTESA-N 1 1 405.905 3.276 20 0 HGADMO O=C1NCC[N@@H+](Cc2ccccc2)C12CCN(c1ccc3cc(F)ccc3n1)CC2 ZINC001164946862 721973064 /nfs/dbraw/zinc/97/30/64/721973064.db2.gz XTGKNSWTZOHUOA-UHFFFAOYSA-N 1 1 404.489 3.345 20 0 HGADMO O=C1NCC[N@H+](Cc2ccccc2)C12CCN(c1ccc3cc(F)ccc3n1)CC2 ZINC001164946862 721973069 /nfs/dbraw/zinc/97/30/69/721973069.db2.gz XTGKNSWTZOHUOA-UHFFFAOYSA-N 1 1 404.489 3.345 20 0 HGADMO O=C1NCC[N@@H+](Cc2ccccc2)C12CCN(c1nncc3cc(Cl)ccc31)CC2 ZINC001164948460 721974444 /nfs/dbraw/zinc/97/44/44/721974444.db2.gz ZKMNPFPPYKFKIH-UHFFFAOYSA-N 1 1 421.932 3.254 20 0 HGADMO O=C1NCC[N@H+](Cc2ccccc2)C12CCN(c1nncc3cc(Cl)ccc31)CC2 ZINC001164948460 721974446 /nfs/dbraw/zinc/97/44/46/721974446.db2.gz ZKMNPFPPYKFKIH-UHFFFAOYSA-N 1 1 421.932 3.254 20 0 HGADMO CCOC(=O)c1cnc(Cl)nc1N1CCC2(CC[N@@H+](Cc3cccnc3)C2)CC1 ZINC001164954876 722012799 /nfs/dbraw/zinc/01/27/99/722012799.db2.gz QCDNOTAHMRBSGH-UHFFFAOYSA-N 1 1 415.925 3.194 20 0 HGADMO COc1ccc(Cc2c(C)nc(N3CC[NH+](CCc4ccccn4)CC3)nc2C)cc1 ZINC001165056073 722020057 /nfs/dbraw/zinc/02/00/57/722020057.db2.gz VJTMEHGJYXFURH-UHFFFAOYSA-N 1 1 417.557 3.453 20 0 HGADMO CS(=O)(=O)c1ccc(Cl)nc1N1CCC2(CC[N@H+](Cc3cccnc3)C2)CC1 ZINC001164955424 722021022 /nfs/dbraw/zinc/02/10/22/722021022.db2.gz GHANQWNVXCGIFD-UHFFFAOYSA-N 1 1 420.966 3.026 20 0 HGADMO CS(=O)(=O)c1ccc(Cl)nc1N1CCC2(CC[N@@H+](Cc3cccnc3)C2)CC1 ZINC001164955424 722021025 /nfs/dbraw/zinc/02/10/25/722021025.db2.gz GHANQWNVXCGIFD-UHFFFAOYSA-N 1 1 420.966 3.026 20 0 HGADMO COc1cc(Cl)cnc1N1CCC2(CC1)COCC[N@@H+](Cc1ccncc1)C2 ZINC001164961155 722053321 /nfs/dbraw/zinc/05/33/21/722053321.db2.gz SPUUKTCZCFHQRP-UHFFFAOYSA-N 1 1 402.926 3.258 20 0 HGADMO Cc1ccc2ncnc(N3CCC4(CC3)COCC[N@@H+](Cc3ccncc3)C4)c2c1 ZINC001164960490 722053878 /nfs/dbraw/zinc/05/38/78/722053878.db2.gz PMCOUEGDGNEVCV-UHFFFAOYSA-N 1 1 403.530 3.452 20 0 HGADMO COc1nc(N2CCC3(CC2)COCC[N@@H+](Cc2ccncc2)C3)ccc1Cl ZINC001164960013 722058171 /nfs/dbraw/zinc/05/81/71/722058171.db2.gz CRLJQUFFNVDZSI-UHFFFAOYSA-N 1 1 402.926 3.258 20 0 HGADMO CC(C)COc1cncc(N2CCC3(CC2)COCC[N@@H+](Cc2ccncc2)C3)n1 ZINC001164960687 722060296 /nfs/dbraw/zinc/06/02/96/722060296.db2.gz HPKTYHTYFOWMNS-UHFFFAOYSA-N 1 1 411.550 3.025 20 0 HGADMO F[C@@H](Oc1cccc(-c2ccc(Cl)nn2)c1)N1C[C@@H]2C[N@@H+](CC3CC3)C[C@H](C1)O2 ZINC001164968235 722076676 /nfs/dbraw/zinc/07/66/76/722076676.db2.gz XERGKGAHHSVJLJ-LVCYWYKZSA-N 1 1 418.900 3.224 20 0 HGADMO F[C@@H](Oc1cccc(-c2ccc(Cl)nn2)c1)N1C[C@@H]2C[N@H+](CC3CC3)C[C@H](C1)O2 ZINC001164968235 722076677 /nfs/dbraw/zinc/07/66/77/722076677.db2.gz XERGKGAHHSVJLJ-LVCYWYKZSA-N 1 1 418.900 3.224 20 0 HGADMO Clc1cccc(COc2cncc(N3C[C@@H]4C[N@H+](CC5CC5)C[C@H](C3)O4)n2)c1 ZINC001164968095 722077392 /nfs/dbraw/zinc/07/73/92/722077392.db2.gz QFHNMWRWLRDRAF-KDURUIRLSA-N 1 1 400.910 3.008 20 0 HGADMO CCC[N@H+]1CCCC[C@H]1c1ccc(N2CCO[C@]3(CCCN(C(C)=O)C3)C2)nc1 ZINC001164969094 722084191 /nfs/dbraw/zinc/08/41/91/722084191.db2.gz JVEZIXNXELHDBM-GMAHTHKFSA-N 1 1 400.567 3.236 20 0 HGADMO CC(C)(c1ccnc(Cl)c1)[N@@H+]1C[C@H]2c3ccccc3N(S(C)(=O)=O)C[C@@H]2C1 ZINC001164975051 722091018 /nfs/dbraw/zinc/09/10/18/722091018.db2.gz QCMLIWHDHQQKHZ-WMLDXEAASA-N 1 1 405.951 3.465 20 0 HGADMO c1ccc(-c2nccc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)n2)cc1 ZINC001164984719 722104665 /nfs/dbraw/zinc/10/46/65/722104665.db2.gz UEBFQJKJTJFHRQ-FGZHOGPDSA-N 1 1 401.514 3.266 20 0 HGADMO Clc1cccc2ncc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)nc12 ZINC001164983500 722106527 /nfs/dbraw/zinc/10/65/27/722106527.db2.gz QNJNVRYHKZSXRX-FXAWDEMLSA-N 1 1 409.921 3.406 20 0 HGADMO FC(F)(Oc1cccnc1Cl)N1CC[C@H]2C[N@@H+](Cc3cccnc3)CCO[C@@H]2C1 ZINC001164986647 722106967 /nfs/dbraw/zinc/10/69/67/722106967.db2.gz ZYSVZHBNYWUGSX-FUHWJXTLSA-N 1 1 424.879 3.282 20 0 HGADMO CSc1nc2ccccc2c(N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)n1 ZINC001164980575 722123046 /nfs/dbraw/zinc/12/30/46/722123046.db2.gz RWFXNBCZRWHGTK-GHTZIAJQSA-N 1 1 421.570 3.474 20 0 HGADMO CCOc1ccc(Cl)nc1N1CC[C@H]2C[N@@H+](Cc3cccnc3)CCO[C@@H]2C1 ZINC001164981171 722124898 /nfs/dbraw/zinc/12/48/98/722124898.db2.gz UADDAZHNWPJOSI-PKOBYXMFSA-N 1 1 402.926 3.256 20 0 HGADMO Fc1cccc(-c2ccc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)nn2)c1 ZINC001164985004 722147196 /nfs/dbraw/zinc/14/71/96/722147196.db2.gz YTHHGKZPGLHLBO-NZQKXSOJSA-N 1 1 419.504 3.405 20 0 HGADMO c1ccc(Oc2nccnc2N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)cc1 ZINC001164985062 722150431 /nfs/dbraw/zinc/15/04/31/722150431.db2.gz ZBHOIRAUXMTCAV-IFMALSPDSA-N 1 1 417.513 3.391 20 0 HGADMO Clc1nc2c(nc1N1CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C1)CCCC2 ZINC001164975278 722157462 /nfs/dbraw/zinc/15/74/62/722157462.db2.gz QUKISTNIOSXOIB-PXNSSMCTSA-N 1 1 413.953 3.131 20 0 HGADMO CCNC(=O)c1cc(Cl)nc(N2CCC[C@]3(CC[N@H+]3Cc3cccc(F)c3)C2)n1 ZINC001164998485 722213766 /nfs/dbraw/zinc/21/37/66/722213766.db2.gz VZQDGOAXNXXSAR-NRFANRHFSA-N 1 1 417.916 3.264 20 0 HGADMO C[N@@H+](Cc1ccc(N2CC[C@@]3(CC(=O)N(c4ccc5c(c4)OCO5)C3)C2)nc1)C1CC1 ZINC001164996874 722220303 /nfs/dbraw/zinc/22/03/03/722220303.db2.gz BFRVDTUTVFGLKN-XMMPIXPASA-N 1 1 420.513 3.038 20 0 HGADMO C[C@@](CO)(Cc1ccc(Br)cc1)[NH2+]Cc1nnc(C(F)(F)F)s1 ZINC001176588622 1126149874 /nfs/dbraw/zinc/14/98/74/1126149874.db2.gz UIXZFGOTABLKSL-ZDUSSCGKSA-N 1 1 410.259 3.403 20 0 HGADMO COc1ccc(C[C@@](C)(CO)[NH2+]Cc2nc(-c3cc(F)c(F)c(F)c3)no2)cc1 ZINC001460854946 1126192183 /nfs/dbraw/zinc/19/21/83/1126192183.db2.gz AXBSLCQLCWMEIM-FQEVSTJZSA-N 1 1 407.392 3.246 20 0 HGADMO Cn1c(C[NH+]2CCC(C(=O)N3CCN(c4ccccc4)CC3)CC2)nc2ccccc21 ZINC000248087878 568747463 /nfs/dbraw/zinc/74/74/63/568747463.db2.gz SZXDZOQWANPDRE-UHFFFAOYSA-N 1 1 417.557 3.134 20 0 HGADMO COc1ccc(C[NH+]2CCC(OC)(c3nc(CC(F)(F)F)no3)CC2)cc1F ZINC000555983560 568784940 /nfs/dbraw/zinc/78/49/40/568784940.db2.gz ADOBWCQHYXWSRG-UHFFFAOYSA-N 1 1 403.376 3.460 20 0 HGADMO