smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name O[C@]12CCCC[C@@H]1[C@H](c1ccc3c(c1)OCO3)[N@@H+](Cc1ccc(F)cc1)CC2 ZINC000004301585 817518398 /nfs/dbraw/zinc/51/83/98/817518398.db2.gz NHBIUSXQFCMSRS-OIBXWCBGSA-N 1 1 383.463 4.423 50 0 GIAAMO COc1ccccc1[C@@H]1[C@H]2CCCC[C@]2(O)CC[N@@H+]1CC(=O)Nc1ccccc1 ZINC000004302145 817518715 /nfs/dbraw/zinc/51/87/15/817518715.db2.gz FUOOFZYISRPLNL-HUVFLSCGSA-N 1 1 394.515 4.002 50 0 GIAAMO COc1ccccc1[C@@H]1[C@H]2CCCC[C@]2(O)CC[N@H+]1CC(=O)Nc1ccccc1 ZINC000004302145 817518720 /nfs/dbraw/zinc/51/87/20/817518720.db2.gz FUOOFZYISRPLNL-HUVFLSCGSA-N 1 1 394.515 4.002 50 0 GIAAMO Cc1ocnc1C(=O)N1CC[C@]2(C1)CCC[N@H+](Cc1ccc(C(C)C)cc1)C2 ZINC000012197053 818145806 /nfs/dbraw/zinc/14/58/06/818145806.db2.gz GTFDWNOEZGWZQV-HSZRJFAPSA-N 1 1 381.520 4.235 50 0 GIAAMO CC(C)c1nc(C(=O)N2CC[C@@]3(C2)CCC[N@@H+](CCc2ccccc2)C3)cs1 ZINC000012298175 818152837 /nfs/dbraw/zinc/15/28/37/818152837.db2.gz GNKYNPMLCZDGSN-QHCPKHFHSA-N 1 1 397.588 4.437 50 0 GIAAMO Cc1ccccc1-c1cnnc(NC[C@H]2CCC[N@@H+](CCc3ccccc3)C2)n1 ZINC000012387269 818156456 /nfs/dbraw/zinc/15/64/56/818156456.db2.gz YNYBPXHMGOGXSR-OAQYLSRUSA-N 1 1 387.531 4.214 50 0 GIAAMO CCc1ccc(C[N@H+]2CCC[C@@H](C(=O)Nc3ccc(-c4cc[nH]n4)cc3)C2)o1 ZINC000012429973 818158570 /nfs/dbraw/zinc/15/85/70/818158570.db2.gz IJSBJCBLOBSJOP-QGZVFWFLSA-N 1 1 378.476 4.083 50 0 GIAAMO Cn1ccnc1C[N@@H+]1CCC[C@@H](C(=O)Nc2cccc(-c3ccc(F)cc3)c2)C1 ZINC000012431679 818158760 /nfs/dbraw/zinc/15/87/60/818158760.db2.gz GBUOUHWDVWCTTM-LJQANCHMSA-N 1 1 392.478 4.077 50 0 GIAAMO Cn1ccnc1C[N@H+]1CCC[C@@H](C(=O)Nc2cccc(-c3ccc(F)cc3)c2)C1 ZINC000012431679 818158766 /nfs/dbraw/zinc/15/87/66/818158766.db2.gz GBUOUHWDVWCTTM-LJQANCHMSA-N 1 1 392.478 4.077 50 0 GIAAMO CC[N@@H+](Cc1ccncc1)[C@H]1CCCN(C(=O)c2ccc3oc(C)cc3c2)C1 ZINC000012448992 818160799 /nfs/dbraw/zinc/16/07/99/818160799.db2.gz NCGOLEPQOSKRJQ-NRFANRHFSA-N 1 1 377.488 4.263 50 0 GIAAMO CC[N@@H+](Cc1ccncc1)[C@@H]1CCCN(C(=O)c2ccc3oc(C)cc3c2)C1 ZINC000012448991 818160942 /nfs/dbraw/zinc/16/09/42/818160942.db2.gz NCGOLEPQOSKRJQ-OAQYLSRUSA-N 1 1 377.488 4.263 50 0 GIAAMO Cc1ncc(C[N@H+]2CCC[C@H](C(=O)Nc3ccc(-c4cscn4)cc3)C2)s1 ZINC000012574881 818167481 /nfs/dbraw/zinc/16/74/81/818167481.db2.gz RZCBLTBYTRHTAC-INIZCTEOSA-N 1 1 398.557 4.426 50 0 GIAAMO Cc1ccc2c(c1)[C@@H]1C[N@@H+](C)CC[C@H]1N2S(=O)(=O)c1ccc2ccccc2c1 ZINC000013109756 818203050 /nfs/dbraw/zinc/20/30/50/818203050.db2.gz BGOUJACGWBNQQD-JTHBVZDNSA-N 1 1 392.524 4.145 50 0 GIAAMO COCC[N@H+]1CCC[C@]2(CCN(Cc3cccc(OCc4ccccc4)c3)C2)C1 ZINC000014962590 818279262 /nfs/dbraw/zinc/27/92/62/818279262.db2.gz CMUYKLICSRDAJP-VWLOTQADSA-N 1 1 394.559 4.200 50 0 GIAAMO COCCN1CCC[C@]2(CC[N@H+](Cc3cccc(OCc4ccccc4)c3)C2)C1 ZINC000014962590 818279298 /nfs/dbraw/zinc/27/92/98/818279298.db2.gz CMUYKLICSRDAJP-VWLOTQADSA-N 1 1 394.559 4.200 50 0 GIAAMO COCCN1CCC[C@]2(CC[N@@H+](Cc3cccc(OCc4ccccc4)c3)C2)C1 ZINC000014962590 818279301 /nfs/dbraw/zinc/27/93/01/818279301.db2.gz CMUYKLICSRDAJP-VWLOTQADSA-N 1 1 394.559 4.200 50 0 GIAAMO Cc1ccccc1-c1ccc(C[N@@H+]2CCC(=O)N(Cc3cccnc3)CC2)cc1 ZINC000014986518 818280877 /nfs/dbraw/zinc/28/08/77/818280877.db2.gz WULJOTFJCSARBX-UHFFFAOYSA-N 1 1 385.511 4.292 50 0 GIAAMO Cc1cccc(C[N@H+]2CCC[C@]3(CCN(Cc4nc(C)c(C)nc4C)C3)C2)c1 ZINC000015063485 818286965 /nfs/dbraw/zinc/28/69/65/818286965.db2.gz LLGKRHBDEDDZQI-DEOSSOPVSA-N 1 1 378.564 4.198 50 0 GIAAMO COCc1ccc(C[N@H+]2CC[C@]3(C2)CCCN(CCC2CCCCC2)C3=O)o1 ZINC000015067606 818287799 /nfs/dbraw/zinc/28/77/99/818287799.db2.gz FREZEJUZHBFJKS-QHCPKHFHSA-N 1 1 388.552 4.211 50 0 GIAAMO Cc1[nH]c2ccc(Br)cc2c(=O)c1C[N@H+]1CCc2ccccc2C1 ZINC000019793726 818605341 /nfs/dbraw/zinc/60/53/41/818605341.db2.gz XFVMFHZRNDWCKB-UHFFFAOYSA-N 1 1 383.289 4.157 50 0 GIAAMO COc1cccc2ccc(C[NH+]3CCN(c4nc5ccccc5s4)CC3)nc21 ZINC000020167048 818616090 /nfs/dbraw/zinc/61/60/90/818616090.db2.gz CERNCJIIHUBTPN-UHFFFAOYSA-N 1 1 390.512 4.175 50 0 GIAAMO O[C@H](C[NH+]1CCN(c2cccc(C(F)(F)F)c2)CC1)c1cccc(Cl)c1 ZINC000020218829 818617820 /nfs/dbraw/zinc/61/78/20/818617820.db2.gz LHYOMQJJVQWXBT-GOSISDBHSA-N 1 1 384.829 4.214 50 0 GIAAMO COc1ccc(C(=O)N2CC[NH+](C3c4ccccc4-c4ccccc43)CC2)cc1 ZINC000020766738 818630694 /nfs/dbraw/zinc/63/06/94/818630694.db2.gz VYZRFFKACXYYTB-UHFFFAOYSA-N 1 1 384.479 4.223 50 0 GIAAMO O=C(NC1CC1)c1ccc([C@@H]2CCC[N@@H+]2Cc2cccn2-c2ccccn2)s1 ZINC000020906884 818639483 /nfs/dbraw/zinc/63/94/83/818639483.db2.gz SLPXIADBTDGYIV-SFHVURJKSA-N 1 1 392.528 4.163 50 0 GIAAMO O=C(NC1CC1)c1ccc([C@@H]2CCC[N@H+]2Cc2cccn2-c2ccccn2)s1 ZINC000020906884 818639487 /nfs/dbraw/zinc/63/94/87/818639487.db2.gz SLPXIADBTDGYIV-SFHVURJKSA-N 1 1 392.528 4.163 50 0 GIAAMO C[C@@H]1CCC[N@@H+](CCCNC(=O)c2cc(-c3cccnc3)nc3ccccc32)C1 ZINC000021934594 818757433 /nfs/dbraw/zinc/75/74/33/818757433.db2.gz QRBHFCRRFREVOY-GOSISDBHSA-N 1 1 388.515 4.149 50 0 GIAAMO Cc1ccc2c(CN3CC[NH+](C/C=C\c4ccccc4)CC3)cc(=O)oc2c1C ZINC000022865381 818867818 /nfs/dbraw/zinc/86/78/18/818867818.db2.gz IKTNUUFNNFYTJG-TWGQIWQCSA-N 1 1 388.511 4.241 50 0 GIAAMO CCc1ccc2c(CN3CC[NH+](C/C=C\c4ccccc4)CC3)cc(=O)oc2c1 ZINC000022874254 818869083 /nfs/dbraw/zinc/86/90/83/818869083.db2.gz RMUXBSOWRVCUDU-TWGQIWQCSA-N 1 1 388.511 4.186 50 0 GIAAMO C[C@@H](c1ccccn1)[N@@H+](C)Cc1cccc(-c2nc3c(c(=O)[nH]2)CCCCC3)c1 ZINC000023429253 818939743 /nfs/dbraw/zinc/93/97/43/818939743.db2.gz JNNTYILSLMFTMS-KRWDZBQOSA-N 1 1 388.515 4.294 50 0 GIAAMO C[NH+]1CCN(c2ncnc3c2oc2nc(C4CCCCC4)c4c(c23)CCC4)CC1 ZINC000031809612 820863598 /nfs/dbraw/zinc/86/35/98/820863598.db2.gz XCSITPBOJMDBNT-UHFFFAOYSA-N 1 1 391.519 4.059 50 0 GIAAMO C/C=C\c1ccc(OC[C@H](O)C[N@@H+](C)Cc2ccc(SC)cc2)c(OC)c1 ZINC000034702112 821062297 /nfs/dbraw/zinc/06/22/97/821062297.db2.gz BZDGCTZQNFLBHE-SFFCAUCYSA-N 1 1 387.545 4.322 50 0 GIAAMO CCn1nc(C(=O)NCC[C@@H]2CCC[N@H+]2C)cc1-c1ccc(C(C)(C)C)cc1 ZINC000034902057 821063294 /nfs/dbraw/zinc/06/32/94/821063294.db2.gz XYMBVYDDFLDMLG-IBGZPJMESA-N 1 1 382.552 4.082 50 0 GIAAMO COc1ccc(OCc2noc(C[N@H+](Cc3ccccc3)[C@H](C)C3CC3)n2)cc1 ZINC000040120229 821142496 /nfs/dbraw/zinc/14/24/96/821142496.db2.gz IHUZLCITWFGBSM-QGZVFWFLSA-N 1 1 393.487 4.458 50 0 GIAAMO COc1ccc(OCc2noc(C[N@@H+](Cc3ccccc3)[C@H](C)C3CC3)n2)cc1 ZINC000040120229 821142502 /nfs/dbraw/zinc/14/25/02/821142502.db2.gz IHUZLCITWFGBSM-QGZVFWFLSA-N 1 1 393.487 4.458 50 0 GIAAMO COc1ccc(C[N@H+]2CCC[C@@H](c3n[nH]cc3-c3c(F)cccc3F)C2)cc1O ZINC000042460126 821307339 /nfs/dbraw/zinc/30/73/39/821307339.db2.gz DEQNEUJSKBRLCZ-OAHLLOKOSA-N 1 1 399.441 4.449 50 0 GIAAMO CCN(C[C@H]1CC[N@@H+](Cc2nc3ccc(OC)cc3s2)C1)CC(F)(F)F ZINC000187116673 823013064 /nfs/dbraw/zinc/01/30/64/823013064.db2.gz PVEOBKNZEYFCJN-CYBMUJFWSA-N 1 1 387.471 4.011 50 0 GIAAMO CC(C)NC(=O)c1ccccc1OC[C@H]1CCC[N@@H+](Cc2ccc(F)cc2)C1 ZINC000169765061 823913943 /nfs/dbraw/zinc/91/39/43/823913943.db2.gz MOPOAMXFRDTPKX-IBGZPJMESA-N 1 1 384.495 4.255 50 0 GIAAMO O=C(c1ccco1)N1CCC2(CC1)C[C@@H]([N@@H+](Cc1ccccc1)C1CC1)CCO2 ZINC000169776650 823915553 /nfs/dbraw/zinc/91/55/53/823915553.db2.gz VJNRMRFGYSSDMG-NRFANRHFSA-N 1 1 394.515 4.098 50 0 GIAAMO c1ccc(-c2nc(-c3ccncc3)no2)c(O[C@H]2CC[N@H+](C3CCCC3)C2)c1 ZINC000169785100 823916176 /nfs/dbraw/zinc/91/61/76/823916176.db2.gz AUZACZRBFQHEFC-SFHVURJKSA-N 1 1 376.460 4.194 50 0 GIAAMO CCn1cc(CN2CCC([N@H+]3CC4(CCCCC4)[C@@H]3c3ccncc3)CC2)cn1 ZINC000575545500 823975615 /nfs/dbraw/zinc/97/56/15/823975615.db2.gz NYEVQTWIUNSXJO-QHCPKHFHSA-N 1 1 393.579 4.270 50 0 GIAAMO Cc1ccsc1CN(C)C(=O)NC[C@H]1CCC[N@@H+](CCc2ccccc2)C1 ZINC000426552127 231241263 /nfs/dbraw/zinc/24/12/63/231241263.db2.gz ZIJWYARMGPCZKP-HXUWFJFHSA-N 1 1 385.577 4.153 50 0 GIAAMO CC[N@H+]1CCC[C@@H]1CNC(=O)c1c(C)onc1-c1c(Cl)cccc1Cl ZINC000004322923 204037864 /nfs/dbraw/zinc/03/78/64/204037864.db2.gz BSCCVUAAVZMDBG-GFCCVEGCSA-N 1 1 382.291 4.171 50 0 GIAAMO C[C@@H]1CCC[N@H+](CC(=O)Nc2oc3ccccc3c(=O)c2-c2ccccc2)C1 ZINC000005451653 204132758 /nfs/dbraw/zinc/13/27/58/204132758.db2.gz QXUBCDXXWSULFM-MRXNPFEDSA-N 1 1 376.456 4.130 50 0 GIAAMO C[C@@H]1CCC[N@@H+](CC(=O)Nc2oc3ccccc3c(=O)c2-c2ccccc2)C1 ZINC000005451653 204132761 /nfs/dbraw/zinc/13/27/61/204132761.db2.gz QXUBCDXXWSULFM-MRXNPFEDSA-N 1 1 376.456 4.130 50 0 GIAAMO COc1ccc(OC)c([C@@H]2CCC[N@H+]2Cc2cc(=O)oc3c(C)c(O)ccc23)c1 ZINC000007718598 204247738 /nfs/dbraw/zinc/24/77/38/204247738.db2.gz AMDHCKRBASEHCI-IBGZPJMESA-N 1 1 395.455 4.161 50 0 GIAAMO COc1ccc([C@@H](CNC(=O)CCC(=O)c2ccccc2)[NH+]2CCCCC2)cc1 ZINC000007988342 204257650 /nfs/dbraw/zinc/25/76/50/204257650.db2.gz XQOTVVRAJVLARH-JOCHJYFZSA-N 1 1 394.515 4.002 50 0 GIAAMO O=C(C[N@@H+]1CCC[C@H]1c1ccc2c(c1)OCCCO2)c1c[nH]c2ccccc12 ZINC000008723661 204285835 /nfs/dbraw/zinc/28/58/35/204285835.db2.gz SHFAIKMVFPNRFC-FQEVSTJZSA-N 1 1 376.456 4.349 50 0 GIAAMO O=C(C[N@H+]1CCC[C@H]1c1ccc2c(c1)OCCCO2)c1c[nH]c2ccccc12 ZINC000008723661 204285839 /nfs/dbraw/zinc/28/58/39/204285839.db2.gz SHFAIKMVFPNRFC-FQEVSTJZSA-N 1 1 376.456 4.349 50 0 GIAAMO COc1ccccc1[C@@H](CNC(=O)CSc1ccc2ccccc2c1)[NH+](C)C ZINC000008088781 204261329 /nfs/dbraw/zinc/26/13/29/204261329.db2.gz KOURUEMGPPOODZ-OAQYLSRUSA-N 1 1 394.540 4.360 50 0 GIAAMO Cc1ccc(C)c(NC(=O)C[N@@H+]2CCC[C@@H]2c2ccc3c(c2)OCCCO3)c1 ZINC000008310350 204270168 /nfs/dbraw/zinc/27/01/68/204270168.db2.gz PBWIWSGJGPEUQB-HXUWFJFHSA-N 1 1 380.488 4.240 50 0 GIAAMO Cc1ccc(C)c(NC(=O)C[N@H+]2CCC[C@@H]2c2ccc3c(c2)OCCCO3)c1 ZINC000008310350 204270172 /nfs/dbraw/zinc/27/01/72/204270172.db2.gz PBWIWSGJGPEUQB-HXUWFJFHSA-N 1 1 380.488 4.240 50 0 GIAAMO O[C@@H](COCc1ccccc1)C[N@@H+](Cc1ccccc1)Cc1cccc(F)c1 ZINC000036104284 204306146 /nfs/dbraw/zinc/30/61/46/204306146.db2.gz BZCJWBODSLCZIW-XMMPIXPASA-N 1 1 379.475 4.406 50 0 GIAAMO C[C@H]1CCCC[N@H+]1CCCNC(=O)c1ccc(-n2cnc3ccccc32)cc1 ZINC000009379506 204309802 /nfs/dbraw/zinc/30/98/02/204309802.db2.gz FWTRAEGZKCQBFY-SFHVURJKSA-N 1 1 376.504 4.020 50 0 GIAAMO O=C(C[N@@H+](Cc1ccc(C(F)(F)F)cc1)C1CC1)N1CCc2ccccc2C1 ZINC000036392148 204322223 /nfs/dbraw/zinc/32/22/23/204322223.db2.gz BXJLFFAOBQEGTI-UHFFFAOYSA-N 1 1 388.433 4.255 50 0 GIAAMO O=C(C[N@H+](Cc1ccc(C(F)(F)F)cc1)C1CC1)N1CCc2ccccc2C1 ZINC000036392148 204322227 /nfs/dbraw/zinc/32/22/27/204322227.db2.gz BXJLFFAOBQEGTI-UHFFFAOYSA-N 1 1 388.433 4.255 50 0 GIAAMO CC(C)(C)c1ccc(C(=O)NCCC[N@@H+]2CCO[C@H](c3ccccc3)C2)cc1 ZINC000036699998 204324800 /nfs/dbraw/zinc/32/48/00/204324800.db2.gz SVFWURFKJYDHRV-QFIPXVFZSA-N 1 1 380.532 4.178 50 0 GIAAMO CC(C)(C)c1ccc(C(=O)NCCC[N@H+]2CCO[C@H](c3ccccc3)C2)cc1 ZINC000036699998 204324805 /nfs/dbraw/zinc/32/48/05/204324805.db2.gz SVFWURFKJYDHRV-QFIPXVFZSA-N 1 1 380.532 4.178 50 0 GIAAMO Cc1ccc2nc(C[N@@H+]3CCc4sccc4[C@H]3c3ccccc3)cc(=O)n2c1 ZINC000010032005 204328736 /nfs/dbraw/zinc/32/87/36/204328736.db2.gz APZZHPRXBLNLJG-HSZRJFAPSA-N 1 1 387.508 4.212 50 0 GIAAMO Cc1ccc2nc(C[N@H+]3CCc4sccc4[C@H]3c3ccccc3)cc(=O)n2c1 ZINC000010032005 204328738 /nfs/dbraw/zinc/32/87/38/204328738.db2.gz APZZHPRXBLNLJG-HSZRJFAPSA-N 1 1 387.508 4.212 50 0 GIAAMO O=C(C[NH+]1CCC(c2c[nH]c3ccccc32)CC1)Nc1ccnn1C1CCCC1 ZINC000010224992 204332249 /nfs/dbraw/zinc/33/22/49/204332249.db2.gz TZPWKMOLYSORDG-UHFFFAOYSA-N 1 1 391.519 4.298 50 0 GIAAMO CC(C)[N@@H+](CC(=O)Nc1ccccc1C(=O)NC1CCCC1)Cc1ccccc1 ZINC000010930581 204340037 /nfs/dbraw/zinc/34/00/37/204340037.db2.gz TVGBLVNXVWMODY-UHFFFAOYSA-N 1 1 393.531 4.208 50 0 GIAAMO Cc1ccccc1CC[N@@H+]1CCC[C@H](CN(C)C(=O)c2cc(C(C)C)no2)C1 ZINC000011661412 204348167 /nfs/dbraw/zinc/34/81/67/204348167.db2.gz NBWSGNWCKAUTHL-LJQANCHMSA-N 1 1 383.536 4.133 50 0 GIAAMO CCOC(=O)C[C@@H]1CCCC[N@@H+]1Cc1nc(-c2ccc(OC)cc2F)oc1C ZINC000011662196 204348996 /nfs/dbraw/zinc/34/89/96/204348996.db2.gz GJZRBPDJPQBQEB-HNNXBMFYSA-N 1 1 390.455 4.105 50 0 GIAAMO CCOC(=O)C[C@@H]1CCCC[N@H+]1Cc1nc(-c2ccc(OC)cc2F)oc1C ZINC000011662196 204348999 /nfs/dbraw/zinc/34/89/99/204348999.db2.gz GJZRBPDJPQBQEB-HNNXBMFYSA-N 1 1 390.455 4.105 50 0 GIAAMO OC[C@]1(Cc2ccccc2)CCC[N@@H+](Cc2c[nH]nc2-c2cccc(F)c2)C1 ZINC000011663277 204349228 /nfs/dbraw/zinc/34/92/28/204349228.db2.gz CTRVRMVSZLCKPX-QHCPKHFHSA-N 1 1 379.479 4.033 50 0 GIAAMO CCOC(=O)C[C@H]1CCCC[N@@H+]1Cc1nc(-c2cc(OC)ccc2F)oc1C ZINC000011713264 204350818 /nfs/dbraw/zinc/35/08/18/204350818.db2.gz VGPSHVISVJUWJF-OAHLLOKOSA-N 1 1 390.455 4.105 50 0 GIAAMO CCOC(=O)C[C@H]1CCCC[N@H+]1Cc1nc(-c2cc(OC)ccc2F)oc1C ZINC000011713264 204350822 /nfs/dbraw/zinc/35/08/22/204350822.db2.gz VGPSHVISVJUWJF-OAHLLOKOSA-N 1 1 390.455 4.105 50 0 GIAAMO COc1cc(Cl)c(C[N@H+]2CCC[C@@](CO)(Cc3ccccc3)C2)cc1OC ZINC000011759368 204353295 /nfs/dbraw/zinc/35/32/95/204353295.db2.gz HKARJZCBZDESBG-JOCHJYFZSA-N 1 1 389.923 4.174 50 0 GIAAMO CCOC(=O)C1(CCCc2ccccc2)CC[NH+](Cc2[nH]c(CC)nc2C)CC1 ZINC000011820033 204354776 /nfs/dbraw/zinc/35/47/76/204354776.db2.gz OBHDWPUASRKWQP-UHFFFAOYSA-N 1 1 397.563 4.449 50 0 GIAAMO CN(C(=O)c1cc2ccccc2n1C)[C@@H]1CCC[N@@H+](CCCc2ccccc2)C1 ZINC000011820501 204355013 /nfs/dbraw/zinc/35/50/13/204355013.db2.gz BKKSHHHCIVEWNU-JOCHJYFZSA-N 1 1 389.543 4.348 50 0 GIAAMO Cc1nc2sccn2c1CN(C)C[C@@H]1CCC[N@@H+](CCc2ccccc2C)C1 ZINC000011820263 204355954 /nfs/dbraw/zinc/35/59/54/204355954.db2.gz GKQJZIJUGPQYMI-FQEVSTJZSA-N 1 1 396.604 4.399 50 0 GIAAMO CN(C[C@H]1CCC[N@@H+](CCc2ccc(Cl)cc2)C1)C(=O)CCC(F)(F)F ZINC000011839900 204356000 /nfs/dbraw/zinc/35/60/00/204356000.db2.gz FJUSEHGXHZDUFT-MRXNPFEDSA-N 1 1 390.877 4.395 50 0 GIAAMO Cc1nn(C(C)C)c(C)c1C[N@@H+]1CCC[C@@H](C(=O)c2cc(F)ccc2F)C1 ZINC000011873226 204359461 /nfs/dbraw/zinc/35/94/61/204359461.db2.gz SRYNSJORLZGBKM-MRXNPFEDSA-N 1 1 375.463 4.454 50 0 GIAAMO Cc1nn(C(C)C)c(C)c1C[N@H+]1CCC[C@@H](C(=O)c2cc(F)ccc2F)C1 ZINC000011873226 204359466 /nfs/dbraw/zinc/35/94/66/204359466.db2.gz SRYNSJORLZGBKM-MRXNPFEDSA-N 1 1 375.463 4.454 50 0 GIAAMO CC1CC[NH+]([C@@H](CNC(=O)c2cc(-c3ccccc3)on2)c2ccco2)CC1 ZINC000011905248 204361299 /nfs/dbraw/zinc/36/12/99/204361299.db2.gz IMOZIRLIJGKYRH-IBGZPJMESA-N 1 1 379.460 4.138 50 0 GIAAMO COc1ccccc1[C@@H]1C[C@H]2CN(Cc3cccc(Cl)c3)C(=O)[C@]23CCC[N@@H+]13 ZINC000011932765 204361977 /nfs/dbraw/zinc/36/19/77/204361977.db2.gz VOKQPAYNIOZUTN-NYDSKATKSA-N 1 1 396.918 4.287 50 0 GIAAMO CCN(CC)C(=O)[C@H]1CCC[N@@H+](Cc2nc(-c3ccc(OC)c(C)c3)oc2C)C1 ZINC000011949782 204363835 /nfs/dbraw/zinc/36/38/35/204363835.db2.gz HPVLPUMCTCNBNH-IBGZPJMESA-N 1 1 399.535 4.047 50 0 GIAAMO Cc1ncc(C[N@H+]2CCC[C@H](CNC(=O)c3cccc4ccccc43)C2)s1 ZINC000011957046 204364258 /nfs/dbraw/zinc/36/42/58/204364258.db2.gz ZPZFJMTUNHZWEK-QGZVFWFLSA-N 1 1 379.529 4.247 50 0 GIAAMO C[N@H+]1CCC[C@H](COc2cccc(CN(C(=O)c3cccc(F)c3)C3CC3)c2)C1 ZINC000012040234 204368589 /nfs/dbraw/zinc/36/85/89/204368589.db2.gz RUJCWKGEXZAHBQ-IBGZPJMESA-N 1 1 396.506 4.351 50 0 GIAAMO Cn1cc(C[N@H+](C)Cc2cn(C)nc2-c2ccc(Oc3ccccc3)cc2)cn1 ZINC000012192914 204381593 /nfs/dbraw/zinc/38/15/93/204381593.db2.gz AAWCSCAVVMSXDG-UHFFFAOYSA-N 1 1 387.487 4.245 50 0 GIAAMO Cn1cc(C[N@@H+](C)Cc2cn(C)nc2-c2ccc(Oc3ccccc3)cc2)cn1 ZINC000012192914 204381596 /nfs/dbraw/zinc/38/15/96/204381596.db2.gz AAWCSCAVVMSXDG-UHFFFAOYSA-N 1 1 387.487 4.245 50 0 GIAAMO COc1cccc(C[N@@H+]2CCC[C@@H](C(=O)c3cc(F)ccc3F)C2)c1OC ZINC000012227115 204385702 /nfs/dbraw/zinc/38/57/02/204385702.db2.gz JSNLECRYBDZBPU-CQSZACIVSA-N 1 1 375.415 4.077 50 0 GIAAMO COc1cccc(C[N@H+]2CCC[C@@H](C(=O)c3cc(F)ccc3F)C2)c1OC ZINC000012227115 204385704 /nfs/dbraw/zinc/38/57/04/204385704.db2.gz JSNLECRYBDZBPU-CQSZACIVSA-N 1 1 375.415 4.077 50 0 GIAAMO O=C(Nc1ccc(-c2cccc(F)c2)cc1)[C@@H]1CCC[N@@H+]1Cc1cccnc1 ZINC000012305954 204393566 /nfs/dbraw/zinc/39/35/66/204393566.db2.gz IBXXWOLWYGDUPB-QFIPXVFZSA-N 1 1 375.447 4.491 50 0 GIAAMO O=C(Nc1ccc(-c2cccc(F)c2)cc1)[C@@H]1CCC[N@H+]1Cc1cccnc1 ZINC000012305954 204393568 /nfs/dbraw/zinc/39/35/68/204393568.db2.gz IBXXWOLWYGDUPB-QFIPXVFZSA-N 1 1 375.447 4.491 50 0 GIAAMO COc1cccc([C@H]2c3[nH]c4ccccc4c3CC[N@H+]2CCCn2cccn2)c1 ZINC000012315696 204394864 /nfs/dbraw/zinc/39/48/64/204394864.db2.gz OIWFSUDBUAHVMP-DEOSSOPVSA-N 1 1 386.499 4.411 50 0 GIAAMO COc1cccc([C@H]2c3[nH]c4ccccc4c3CC[N@@H+]2CCCn2cccn2)c1 ZINC000012315696 204394868 /nfs/dbraw/zinc/39/48/68/204394868.db2.gz OIWFSUDBUAHVMP-DEOSSOPVSA-N 1 1 386.499 4.411 50 0 GIAAMO COc1ccc(C(=O)[C@@H]2CCC[N@H+](Cc3cccn3-c3nccs3)C2)cc1F ZINC000012314449 204396184 /nfs/dbraw/zinc/39/61/84/204396184.db2.gz YRWYXGXPDZQBKW-MRXNPFEDSA-N 1 1 399.491 4.176 50 0 GIAAMO COc1ccc(C(=O)[C@@H]2CCC[N@@H+](Cc3cccn3-c3nccs3)C2)cc1F ZINC000012314449 204396189 /nfs/dbraw/zinc/39/61/89/204396189.db2.gz YRWYXGXPDZQBKW-MRXNPFEDSA-N 1 1 399.491 4.176 50 0 GIAAMO CC[C@@H]1C[N@H+](Cc2ccc(Oc3ncccn3)cc2)Cc2cc(OC)ccc2O1 ZINC000012332027 204398099 /nfs/dbraw/zinc/39/80/99/204398099.db2.gz ILXPVARUIGJGCL-LJQANCHMSA-N 1 1 391.471 4.451 50 0 GIAAMO CC[C@@H]1C[N@@H+](Cc2ccc(Oc3ncccn3)cc2)Cc2cc(OC)ccc2O1 ZINC000012332027 204398101 /nfs/dbraw/zinc/39/81/01/204398101.db2.gz ILXPVARUIGJGCL-LJQANCHMSA-N 1 1 391.471 4.451 50 0 GIAAMO Cc1ccc(S(=O)(=O)N2CC[NH+](C3CCC(c4ccccc4)CC3)CC2)cc1 ZINC000036011476 205001765 /nfs/dbraw/zinc/00/17/65/205001765.db2.gz HQFKMLYKKCPPSI-UHFFFAOYSA-N 1 1 398.572 4.028 50 0 GIAAMO COc1ccc(C[N@H+](Cc2ccccc2F)C[C@@H](O)Cc2ccccc2)cc1 ZINC000036095347 205005038 /nfs/dbraw/zinc/00/50/38/205005038.db2.gz KOGAMEKGHPGXQG-QFIPXVFZSA-N 1 1 379.475 4.440 50 0 GIAAMO CCCC(=O)OC[C@H](O)C[N@@H+](Cc1ccc(F)cc1)Cc1cc(C)ccc1C ZINC000036103988 205005087 /nfs/dbraw/zinc/00/50/87/205005087.db2.gz DHSBIWMHFWWGDH-JOCHJYFZSA-N 1 1 387.495 4.149 50 0 GIAAMO COc1ccc(OC[C@@H](O)C[N@@H+](CCC(C)C)Cc2ccc(C)s2)cc1 ZINC000036101658 205005352 /nfs/dbraw/zinc/00/53/52/205005352.db2.gz ZPIMSWHJQGUKNP-SFHVURJKSA-N 1 1 377.550 4.353 50 0 GIAAMO O[C@@H](COc1ccccc1)C[N@H+](Cc1ccc(F)cc1)Cc1ccccc1F ZINC000036102623 205005578 /nfs/dbraw/zinc/00/55/78/205005578.db2.gz ZFZXBDKBFLIALN-OAQYLSRUSA-N 1 1 383.438 4.407 50 0 GIAAMO O[C@@H](COc1ccccc1)C[N@@H+](Cc1ccc(F)cc1)Cc1ccccc1F ZINC000036102623 205005581 /nfs/dbraw/zinc/00/55/81/205005581.db2.gz ZFZXBDKBFLIALN-OAQYLSRUSA-N 1 1 383.438 4.407 50 0 GIAAMO Cc1ccc(C)c(C[N@H+](Cc2ccc3c(c2)OCO3)C[C@H](O)COC(C)(C)C)c1 ZINC000036103938 205005873 /nfs/dbraw/zinc/00/58/73/205005873.db2.gz MYZPFBGCUMVELB-NRFANRHFSA-N 1 1 399.531 4.210 50 0 GIAAMO COc1ccc(C[N@H+](Cc2ccc(F)cc2)C[C@@H](O)Cc2ccccc2)cc1 ZINC000036102370 205005911 /nfs/dbraw/zinc/00/59/11/205005911.db2.gz ONBBFZJNBORZRO-QHCPKHFHSA-N 1 1 379.475 4.440 50 0 GIAAMO O[C@@H](COCc1ccccc1)C[N@@H+](Cc1cccs1)Cc1ccc(F)cc1 ZINC000036103507 205006615 /nfs/dbraw/zinc/00/66/15/205006615.db2.gz VQSPZTBPJMCFLC-OAQYLSRUSA-N 1 1 385.504 4.467 50 0 GIAAMO COc1ccc(OC[C@H](O)C[N@@H+](CCC(C)C)Cc2ccc(F)cc2F)cc1 ZINC000036099805 205006705 /nfs/dbraw/zinc/00/67/05/205006705.db2.gz OAKYPLKPHGNKCL-LJQANCHMSA-N 1 1 393.474 4.261 50 0 GIAAMO COc1cccc([C@H]2CC(c3cccc(C)c3)=NN2C(=O)C[NH+]2CCCCC2)c1 ZINC000036345630 205012735 /nfs/dbraw/zinc/01/27/35/205012735.db2.gz XYWUSQFPVIJTKK-HSZRJFAPSA-N 1 1 391.515 4.167 50 0 GIAAMO Cc1cccc(C2=NN(C(=O)C[NH+]3CCCCC3)[C@@H](c3ccc(F)cc3)C2)c1 ZINC000036345238 205013114 /nfs/dbraw/zinc/01/31/14/205013114.db2.gz PUHUDMIQRJPPCC-JOCHJYFZSA-N 1 1 379.479 4.298 50 0 GIAAMO Cc1nn(-c2ccccc2)c2sc(C(=O)NCC[N@H+](C)C3CCCCC3)cc12 ZINC000035509916 204991628 /nfs/dbraw/zinc/99/16/28/204991628.db2.gz RADKETJWYJNWSO-UHFFFAOYSA-N 1 1 396.560 4.390 50 0 GIAAMO COc1ccc(OC)c([C@H]2CCC[N@@H+]2CC(=O)N[C@H](C)c2ccccc2C)c1 ZINC000037218977 205024159 /nfs/dbraw/zinc/02/41/59/205024159.db2.gz LHYHSINTGNPXLN-DYESRHJHSA-N 1 1 382.504 4.027 50 0 GIAAMO COc1ccc(OC)c([C@H]2CCC[N@H+]2CC(=O)N[C@H](C)c2ccccc2C)c1 ZINC000037218977 205024162 /nfs/dbraw/zinc/02/41/62/205024162.db2.gz LHYHSINTGNPXLN-DYESRHJHSA-N 1 1 382.504 4.027 50 0 GIAAMO C[C@H](OCc1ccccc1)C(=O)NC[C@H](c1cccc(Cl)c1)[NH+]1CCCC1 ZINC000040089242 205051960 /nfs/dbraw/zinc/05/19/60/205051960.db2.gz KOHGZBRGMGKVDC-LAUBAEHRSA-N 1 1 386.923 4.198 50 0 GIAAMO C[N@@H+]1CCN(C(=O)Nc2ccccc2OC(F)(F)F)[C@@H](c2ccccc2)C1 ZINC000040104283 205052555 /nfs/dbraw/zinc/05/25/55/205052555.db2.gz JNICDVPQVFADBQ-MRXNPFEDSA-N 1 1 379.382 4.106 50 0 GIAAMO C[N@H+]1CCN(C(=O)Nc2ccccc2OC(F)(F)F)[C@@H](c2ccccc2)C1 ZINC000040104283 205052560 /nfs/dbraw/zinc/05/25/60/205052560.db2.gz JNICDVPQVFADBQ-MRXNPFEDSA-N 1 1 379.382 4.106 50 0 GIAAMO CCc1[nH]c(C(=O)Nc2ccc(C[N@H+]3CCCC[C@@H]3C)cc2)c(C)c1C(=O)OC ZINC000040119469 205054032 /nfs/dbraw/zinc/05/40/32/205054032.db2.gz SZTXSQZOVOBPMQ-HNNXBMFYSA-N 1 1 397.519 4.299 50 0 GIAAMO O=C(c1ccc(-n2cccc2)cc1)N1CCC([N@H+]2CCc3ccccc3C2)CC1 ZINC000040150152 205058191 /nfs/dbraw/zinc/05/81/91/205058191.db2.gz SAQDVCJBIRRCIR-UHFFFAOYSA-N 1 1 385.511 4.140 50 0 GIAAMO C[N@@H+](CCCNC(=O)CCc1ccc(-c2ccccc2)[nH]1)Cc1ccccc1 ZINC000040156775 205060183 /nfs/dbraw/zinc/06/01/83/205060183.db2.gz RZMFIMDWBBJWRN-UHFFFAOYSA-N 1 1 375.516 4.253 50 0 GIAAMO COc1cccc(CNCC[NH+](C)C)c1OCc1ccc(Cl)c(Cl)c1 ZINC000040719483 205067905 /nfs/dbraw/zinc/06/79/05/205067905.db2.gz QDDNLMXYWMEODZ-UHFFFAOYSA-N 1 1 383.319 4.232 50 0 GIAAMO CCOC(=O)CCCCCCC(=O)c1cccc(C[NH+]2CCSCC2)c1 ZINC000043211355 205082361 /nfs/dbraw/zinc/08/23/61/205082361.db2.gz NPFJRSOAKUXZKM-UHFFFAOYSA-N 1 1 377.550 4.322 50 0 GIAAMO C[C@H](c1cc2ccccc2o1)[N@H+](C)Cc1ccc(S(=O)(=O)N2CCCC2)o1 ZINC000047280021 205109860 /nfs/dbraw/zinc/10/98/60/205109860.db2.gz UXOXIRAXNDGLPW-OAHLLOKOSA-N 1 1 388.489 4.003 50 0 GIAAMO C[C@H](c1cc2ccccc2o1)[N@@H+](C)Cc1ccc(S(=O)(=O)N2CCCC2)o1 ZINC000047280021 205109863 /nfs/dbraw/zinc/10/98/63/205109863.db2.gz UXOXIRAXNDGLPW-OAHLLOKOSA-N 1 1 388.489 4.003 50 0 GIAAMO Cc1ccc(CCCC(=O)NCc2ccc(C[N@H+]3C[C@@H](C)O[C@@H](C)C3)cc2)cc1 ZINC000048285916 205116309 /nfs/dbraw/zinc/11/63/09/205116309.db2.gz SYFHTILYAOVNRQ-OYRHEFFESA-N 1 1 394.559 4.243 50 0 GIAAMO C[N@H+](CCOc1cccc(Cl)c1)CC(=O)N[C@H](c1ccco1)c1ccccc1 ZINC000049634655 205129585 /nfs/dbraw/zinc/12/95/85/205129585.db2.gz GGRUOXJGJQLIBP-QFIPXVFZSA-N 1 1 398.890 4.149 50 0 GIAAMO C[N@@H+](CCOc1cccc(Cl)c1)CC(=O)N[C@H](c1ccco1)c1ccccc1 ZINC000049634655 205129589 /nfs/dbraw/zinc/12/95/89/205129589.db2.gz GGRUOXJGJQLIBP-QFIPXVFZSA-N 1 1 398.890 4.149 50 0 GIAAMO Fc1ccc(N[C@H]2CCC[N@@H+](Cc3cnc(N4CCCC4)s3)C2)cc1F ZINC000055183009 205144389 /nfs/dbraw/zinc/14/43/89/205144389.db2.gz CBVAAAFWOWRKCG-HNNXBMFYSA-N 1 1 378.492 4.098 50 0 GIAAMO Cc1[nH+]ccn1C[C@H]1CCCN(C(=O)CSCc2ccccc2Cl)C1 ZINC000055382757 205147627 /nfs/dbraw/zinc/14/76/27/205147627.db2.gz QPYVYIFHVKUZRX-MRXNPFEDSA-N 1 1 377.941 4.017 50 0 GIAAMO CCNC(=O)c1cccc(NC(=O)C[NH2+][C@@H](C)c2ccc(Cl)cc2Cl)c1 ZINC000057318508 205156854 /nfs/dbraw/zinc/15/68/54/205156854.db2.gz RASXMAOHRDEIMV-LBPRGKRZSA-N 1 1 394.302 4.032 50 0 GIAAMO CCOC(=O)c1c(C)[nH]c(C(=O)[C@H](C)[NH2+][C@H](C)c2ccc(F)c(F)c2)c1C ZINC000057392027 205157292 /nfs/dbraw/zinc/15/72/92/205157292.db2.gz QDAGJCGCGPQLKF-YPMHNXCESA-N 1 1 378.419 4.008 50 0 GIAAMO Cc1ccc(NC(=O)C2CC[NH+](Cc3nc(-c4ccccc4)no3)CC2)c(F)c1 ZINC000051317158 205132241 /nfs/dbraw/zinc/13/22/41/205132241.db2.gz QDXNRCCYRUTZKE-UHFFFAOYSA-N 1 1 394.450 4.035 50 0 GIAAMO CC(C)COc1ccc(CNC(=O)NCCCC[N@H+]2CCC[C@@H](C)C2)cc1 ZINC000058168670 205166579 /nfs/dbraw/zinc/16/65/79/205166579.db2.gz DPJYAGVTKWHTRS-LJQANCHMSA-N 1 1 375.557 4.033 50 0 GIAAMO Cc1[nH+]ccn1-c1ccccc1CNC(=O)c1nc(-c2cccs2)oc1C ZINC000058433599 205177624 /nfs/dbraw/zinc/17/76/24/205177624.db2.gz RQVBEEKFWOXNGU-UHFFFAOYSA-N 1 1 378.457 4.136 50 0 GIAAMO CC(C)Oc1cccc(C(=O)[C@H]2CCC[N@@H+](Cc3ccc4nonc4c3)C2)c1 ZINC000059955614 205180169 /nfs/dbraw/zinc/18/01/69/205180169.db2.gz LWCABGZAOJAOMK-SFHVURJKSA-N 1 1 379.460 4.105 50 0 GIAAMO C[C@@H]1CCC[N@@H+](CCCNC(=O)c2ccc3nc(Cc4ccccc4)oc3c2)C1 ZINC000064967971 205203693 /nfs/dbraw/zinc/20/36/93/205203693.db2.gz HSORDUQXWZOUAU-GOSISDBHSA-N 1 1 391.515 4.270 50 0 GIAAMO CC(C)Oc1ccc(CNC(=O)C2=CC[N@@H+](Cc3cccc(F)c3)CC2)cc1 ZINC000064818115 205197165 /nfs/dbraw/zinc/19/71/65/205197165.db2.gz YPGGEOMHHUGLEN-UHFFFAOYSA-N 1 1 382.479 4.061 50 0 GIAAMO COc1ccc(-c2cc3n(n2)CCC[N@H+](Cc2ccc(F)cc2)C3)cc1OC ZINC000065270390 205224277 /nfs/dbraw/zinc/22/42/77/205224277.db2.gz OZAZZJNRXFYONC-UHFFFAOYSA-N 1 1 381.451 4.112 50 0 GIAAMO COc1ccc(-c2cc3n(n2)CCC[N@@H+](Cc2ccc(F)cc2)C3)cc1OC ZINC000065270390 205224283 /nfs/dbraw/zinc/22/42/83/205224283.db2.gz OZAZZJNRXFYONC-UHFFFAOYSA-N 1 1 381.451 4.112 50 0 GIAAMO Cc1cc(C)cc(NC(=O)N2CC[NH+](Cc3cn(C)c4ccccc34)CC2)c1 ZINC000065330049 205231055 /nfs/dbraw/zinc/23/10/55/205231055.db2.gz ZJEYLANFCIXLNN-UHFFFAOYSA-N 1 1 376.504 4.145 50 0 GIAAMO c1ccc(-c2noc(C[N@H+]3CC[C@@H](c4ccnc(-c5ccncc5)c4)C3)n2)cc1 ZINC000065375237 205232802 /nfs/dbraw/zinc/23/28/02/205232802.db2.gz LUVXJRHJVGLXCF-HXUWFJFHSA-N 1 1 383.455 4.183 50 0 GIAAMO Cc1noc(C)c1NC(=O)c1ccc(C[N@H+]2CCCC[C@@H]2c2ccn(C)n2)cc1 ZINC000065404917 205233295 /nfs/dbraw/zinc/23/32/95/205233295.db2.gz RRTGXULYQPLLHQ-HXUWFJFHSA-N 1 1 393.491 4.004 50 0 GIAAMO Cc1noc(C)c1NC(=O)c1ccc(C[N@@H+]2CCCC[C@@H]2c2ccn(C)n2)cc1 ZINC000065404917 205233300 /nfs/dbraw/zinc/23/33/00/205233300.db2.gz RRTGXULYQPLLHQ-HXUWFJFHSA-N 1 1 393.491 4.004 50 0 GIAAMO CCn1c[nH+]cc1Cn1cnc(-c2ccccc2)c1-c1nc2ccccc2n1C ZINC000065526988 205236794 /nfs/dbraw/zinc/23/67/94/205236794.db2.gz NZTFBFLGBLAGQR-UHFFFAOYSA-N 1 1 382.471 4.369 50 0 GIAAMO C[N@H+]1CCC[C@@H]1CCN1CCOc2c(O)cc(-c3cccc(Cl)c3)cc2C1 ZINC000067655017 205252263 /nfs/dbraw/zinc/25/22/63/205252263.db2.gz INPMINPLJZJZQQ-HXUWFJFHSA-N 1 1 386.923 4.391 50 0 GIAAMO Oc1cc(-c2cccc(Cl)c2)cc2c1OCCN(c1[nH+]cnc3[nH]ccc31)C2 ZINC000067713474 205255820 /nfs/dbraw/zinc/25/58/20/205255820.db2.gz GKJFZCPTTXBAJK-UHFFFAOYSA-N 1 1 392.846 4.383 50 0 GIAAMO CC(C)NC(=O)[C@H](C)[N@@H+]1CCc2[nH]nc(-c3ccc(-c4ccccc4)cc3)c2C1 ZINC000067820814 205263332 /nfs/dbraw/zinc/26/33/32/205263332.db2.gz VFYFEAKJJJZKFC-KRWDZBQOSA-N 1 1 388.515 4.015 50 0 GIAAMO CC(C)NC(=O)[C@H](C)[N@H+]1CCc2[nH]nc(-c3ccc(-c4ccccc4)cc3)c2C1 ZINC000067820814 205263335 /nfs/dbraw/zinc/26/33/35/205263335.db2.gz VFYFEAKJJJZKFC-KRWDZBQOSA-N 1 1 388.515 4.015 50 0 GIAAMO Fc1cccc(C[N@H+]2CCCN(c3nncc(-c4cccc(Cl)c4)n3)CC2)c1 ZINC000067947935 205269039 /nfs/dbraw/zinc/26/90/39/205269039.db2.gz CQPOYWZCMSQMQI-UHFFFAOYSA-N 1 1 397.885 4.043 50 0 GIAAMO COc1ccc(F)cc1-c1ccc(C(=O)NCCCn2cc[nH+]c2C(C)C)cn1 ZINC000067432690 205246957 /nfs/dbraw/zinc/24/69/57/205246957.db2.gz HOCIZVAMUFYOLC-UHFFFAOYSA-N 1 1 396.466 4.036 50 0 GIAAMO C[N@H+]1CCC[C@@H](C(=O)Nc2cccc(C(=O)c3ccc(C(C)(C)C)cc3)c2)C1 ZINC000071375388 205282680 /nfs/dbraw/zinc/28/26/80/205282680.db2.gz LVJQRJOPJBUQCJ-LJQANCHMSA-N 1 1 378.516 4.495 50 0 GIAAMO COc1ccc2cc([C@H]3CN(Cc4[nH+]cc(C)c(OC)c4C)CCO3)ccc2c1 ZINC000071748598 205289511 /nfs/dbraw/zinc/28/95/11/205289511.db2.gz DTBATCJZYGRBHJ-HSZRJFAPSA-N 1 1 392.499 4.442 50 0 GIAAMO COc1ccc(C[N@H+]2CCC(=O)N(Cc3ccc(F)cc3)[C@@H](C(C)C)C2)cc1 ZINC000071758947 205293090 /nfs/dbraw/zinc/29/30/90/205293090.db2.gz JZCQEEHQIVWVLJ-JOCHJYFZSA-N 1 1 384.495 4.093 50 0 GIAAMO Cn1nccc1[C@H]1CCC[N@@H+](Cc2cc(Cl)ccc2OCc2cccnc2)C1 ZINC000071817053 205299285 /nfs/dbraw/zinc/29/92/85/205299285.db2.gz SGDYUIANSBZHNV-SFHVURJKSA-N 1 1 396.922 4.427 50 0 GIAAMO CCN(C(=O)Nc1nnc(C2CC2)s1)[C@@H]1CC[N@H+]([C@@H](C)c2ccccc2)C1 ZINC000072314421 205324178 /nfs/dbraw/zinc/32/41/78/205324178.db2.gz LTADSNRBKKRSIL-WMLDXEAASA-N 1 1 385.537 4.105 50 0 GIAAMO Cc1cccc2c(C[N@H+]3CCOC[C@@H](CN(C)C)C3)c(-c3ccccc3)[nH]c21 ZINC000072148769 205310603 /nfs/dbraw/zinc/31/06/03/205310603.db2.gz SMFDXQWTNREWLM-IBGZPJMESA-N 1 1 377.532 4.153 50 0 GIAAMO Cc1cccc2c(C[N@@H+]3CCOC[C@@H](CN(C)C)C3)c(-c3ccccc3)[nH]c21 ZINC000072148769 205310607 /nfs/dbraw/zinc/31/06/07/205310607.db2.gz SMFDXQWTNREWLM-IBGZPJMESA-N 1 1 377.532 4.153 50 0 GIAAMO CCS[C@@H]1CC[C@@H]([N@@H+](C)CC(=O)Nc2ccc(Br)cc2C)C1 ZINC000072305263 205321948 /nfs/dbraw/zinc/32/19/48/205321948.db2.gz HSJTYKXMCBXAAS-HUUCEWRRSA-N 1 1 385.371 4.302 50 0 GIAAMO CN(Cc1cn(C)nc1-c1ccc(Oc2ccccc2)cc1)[C@H]1CC[N@@H+](C)C1 ZINC000072435227 205351776 /nfs/dbraw/zinc/35/17/76/205351776.db2.gz LGRCBRYWLMBKCS-FQEVSTJZSA-N 1 1 376.504 4.015 50 0 GIAAMO Cn1cc(C[N@@H+](C)[C@H]2CCN(C)C2)c(-c2ccc(Oc3ccccc3)cc2)n1 ZINC000072435227 205351779 /nfs/dbraw/zinc/35/17/79/205351779.db2.gz LGRCBRYWLMBKCS-FQEVSTJZSA-N 1 1 376.504 4.015 50 0 GIAAMO Cn1cc(C[N@H+](C)[C@H]2CCN(C)C2)c(-c2ccc(Oc3ccccc3)cc2)n1 ZINC000072435227 205351782 /nfs/dbraw/zinc/35/17/82/205351782.db2.gz LGRCBRYWLMBKCS-FQEVSTJZSA-N 1 1 376.504 4.015 50 0 GIAAMO Cc1ccc2nc(-c3ccc(F)cc3)c(C[N@H+]3CCC[C@H](C(N)=O)C3)cc2c1 ZINC000072463864 205354433 /nfs/dbraw/zinc/35/44/33/205354433.db2.gz VJUCCCFWFQYZHX-KRWDZBQOSA-N 1 1 377.463 4.047 50 0 GIAAMO CC(C)(O)CCc1ccc(C[N@H+]2CC[C@@]3(C2)CC(=O)c2ccccc2O3)cc1 ZINC000072480079 205354889 /nfs/dbraw/zinc/35/48/89/205354889.db2.gz KAHZSXGKJIDMIR-DEOSSOPVSA-N 1 1 379.500 4.000 50 0 GIAAMO O[C@]1(c2ccccc2)CCC[N@@H+](CCCc2nc(-c3ccccc3)no2)CC1 ZINC000225674676 206065871 /nfs/dbraw/zinc/06/58/71/206065871.db2.gz AVMATHWIROJUON-HSZRJFAPSA-N 1 1 377.488 4.043 50 0 GIAAMO COc1ccc([C@@H]([NH2+][C@@H](C)C(=O)Nc2ccccc2OC)c2ccccc2)cc1 ZINC000032718926 206090353 /nfs/dbraw/zinc/09/03/53/206090353.db2.gz UQOVJZDWPCKXKZ-SBUREZEXSA-N 1 1 390.483 4.410 50 0 GIAAMO COc1cc2c(cc1OC)[C@@H](c1cccs1)[N@@H+](C[C@@H](O)c1ccccc1)CC2 ZINC000229651552 206107306 /nfs/dbraw/zinc/10/73/06/206107306.db2.gz FJFFCYJYGDSGJR-XXBNENTESA-N 1 1 395.524 4.446 50 0 GIAAMO C[C@@H]1C[NH+](Cc2ccc(C(=O)N3CCC[C@H]3c3ccsc3)cc2)C[C@@H](C)O1 ZINC000229719494 206109138 /nfs/dbraw/zinc/10/91/38/206109138.db2.gz CXLRGMFDVFXTRE-LZJOCLMNSA-N 1 1 384.545 4.335 50 0 GIAAMO Cc1ccc(C)c([C@H](c2ccccc2)[NH+]2CCN(C(=O)c3cccnc3)CC2)c1 ZINC000096183736 206121230 /nfs/dbraw/zinc/12/12/30/206121230.db2.gz XJWVHIPBLGTGCQ-DEOSSOPVSA-N 1 1 385.511 4.246 50 0 GIAAMO CC(C)n1c(C[N@H+]2CCC[C@@H](C(=O)NC3CCCCC3)C2)nc2ccccc21 ZINC000248162519 206135142 /nfs/dbraw/zinc/13/51/42/206135142.db2.gz MGCATDLDXVVZSO-GOSISDBHSA-N 1 1 382.552 4.278 50 0 GIAAMO CCn1c(C[N@H+]2CCC[C@H](C(=O)Nc3ccc(C)cc3)C2)nc2ccccc21 ZINC000247991753 206135980 /nfs/dbraw/zinc/13/59/80/206135980.db2.gz NIZSGBMAUZWXHF-SFHVURJKSA-N 1 1 376.504 4.215 50 0 GIAAMO C[C@@H]1CC[C@H](O)[C@H]([C@H]2CCCC[N@H+]2Cc2cccc(C(=O)N3CCCCC3)c2)C1 ZINC000253393146 206146251 /nfs/dbraw/zinc/14/62/51/206146251.db2.gz AFVNDNOBNVMNSE-GOUWZUTHSA-N 1 1 398.591 4.464 50 0 GIAAMO O=C(NCc1cc(F)c(F)c(F)c1F)[C@H]1C[C@@H](c2ccccc2)[N@H+]2CCC[C@H]12 ZINC000299765805 206186300 /nfs/dbraw/zinc/18/63/00/206186300.db2.gz BNTPKVXGSAOKLY-UAGQMJEPSA-N 1 1 392.396 4.085 50 0 GIAAMO Cc1nc(C)c(Cc2nc([C@H]3C[C@@H](c4ccccc4)[N@H+]4CCC[C@H]34)no2)s1 ZINC000299793841 206191832 /nfs/dbraw/zinc/19/18/32/206191832.db2.gz IVMFRTLCGFCPPI-KSZLIROESA-N 1 1 380.517 4.427 50 0 GIAAMO COCCN(Cc1ccc(C)cc1)C[C@H]1CCC[N@@H+](C2Cc3ccccc3C2)C1 ZINC000055134351 206209820 /nfs/dbraw/zinc/20/98/20/206209820.db2.gz BWWAZZFGIUUWGC-HSZRJFAPSA-N 1 1 392.587 4.323 50 0 GIAAMO COCCN(Cc1ccc(C)cc1)C[C@H]1CCC[N@H+](C2Cc3ccccc3C2)C1 ZINC000055134351 206209824 /nfs/dbraw/zinc/20/98/24/206209824.db2.gz BWWAZZFGIUUWGC-HSZRJFAPSA-N 1 1 392.587 4.323 50 0 GIAAMO CCN1CCN(c2nc3cc(OC)ccc3cc2C[NH2+]CC2CCCCC2)CC1 ZINC000011813746 221126414 /nfs/dbraw/zinc/12/64/14/221126414.db2.gz OLVSHFWKRUFNSX-UHFFFAOYSA-N 1 1 396.579 4.055 50 0 GIAAMO O=C(N[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1cc(Br)ccc1Cl ZINC000012787808 221231100 /nfs/dbraw/zinc/23/11/00/221231100.db2.gz JMPMBHHVCGJAKF-OAHLLOKOSA-N 1 1 393.712 4.107 50 0 GIAAMO Cc1cc(C)cc(OCC(=O)Nc2nc(C[NH+]3C[C@@H](C)C[C@H](C)C3)cs2)c1 ZINC000012789831 221232842 /nfs/dbraw/zinc/23/28/42/221232842.db2.gz JUISMLKCWUPEIT-IRXDYDNUSA-N 1 1 387.549 4.255 50 0 GIAAMO Cc1cc(C)cc(OCC(=O)Nc2nc(C[N@H+]3C[C@H](C)C[C@H](C)C3)cs2)c1 ZINC000012789827 221233100 /nfs/dbraw/zinc/23/31/00/221233100.db2.gz JUISMLKCWUPEIT-CALCHBBNSA-N 1 1 387.549 4.255 50 0 GIAAMO Cc1cc(C)cc(OCC(=O)Nc2nc(C[N@@H+]3C[C@H](C)C[C@H](C)C3)cs2)c1 ZINC000012789827 221233104 /nfs/dbraw/zinc/23/31/04/221233104.db2.gz JUISMLKCWUPEIT-CALCHBBNSA-N 1 1 387.549 4.255 50 0 GIAAMO Cc1cc2oc(=O)cc(C[NH+]3CCN(c4ccccc4O)CC3)c2cc1C(C)C ZINC000058159143 136154684 /nfs/dbraw/zinc/15/46/84/136154684.db2.gz VWXWZBAYTVYTHK-UHFFFAOYSA-N 1 1 392.499 4.253 50 0 GIAAMO FC(F)(F)c1ccc(N2CCC[C@@H](c3[nH+]ccn3Cc3ccccn3)C2)nc1 ZINC000095512813 136180716 /nfs/dbraw/zinc/18/07/16/136180716.db2.gz HKKAURFXQBZKGE-OAHLLOKOSA-N 1 1 387.409 4.124 50 0 GIAAMO Cc1cccc(N2CC[N@H+](Cc3cc(=O)oc4cc(C)cc(C)c34)C[C@@H]2C)c1 ZINC000012462803 560212234 /nfs/dbraw/zinc/21/22/34/560212234.db2.gz YFUZCABQQDJMCB-IBGZPJMESA-N 1 1 376.500 4.429 50 0 biogenic,in-vitro GIAAMO CCc1nccc(CN2CCC3(CC2)C[C@H](c2ccccc2)C[N@@H+](CC)C3)n1 ZINC000096136330 570212051 /nfs/dbraw/zinc/21/20/51/570212051.db2.gz RWORHLQPMIVPCJ-NRFANRHFSA-N 1 1 378.564 4.131 50 0 GIAAMO CCc1nccc(CN2CCC3(CC2)C[C@H](c2ccccc2)C[N@H+](CC)C3)n1 ZINC000096136330 570212057 /nfs/dbraw/zinc/21/20/57/570212057.db2.gz RWORHLQPMIVPCJ-NRFANRHFSA-N 1 1 378.564 4.131 50 0 GIAAMO O=C(Nc1ccc2c(c1)OCO2)c1ccc(C[N@H+]2CCc3ccccc3C2)cc1 ZINC000019800401 570220599 /nfs/dbraw/zinc/22/05/99/570220599.db2.gz NSAZPKFRITXKLD-UHFFFAOYSA-N 1 1 386.451 4.226 50 0 GIAAMO C[C@H]1CCC[N@@H+](CCCNC(=O)c2ccc(N3CCc4ccccc43)s2)C1 ZINC000015732279 570223366 /nfs/dbraw/zinc/22/33/66/570223366.db2.gz WQTFUNSXKDMFPS-KRWDZBQOSA-N 1 1 383.561 4.294 50 0 GIAAMO CCOC(=O)N1CC[NH+]([C@H](c2cccs2)c2c(C)[nH]c3ccccc32)CC1 ZINC000020191935 570246501 /nfs/dbraw/zinc/24/65/01/570246501.db2.gz RNUAYIUMCVOJLD-HXUWFJFHSA-N 1 1 383.517 4.401 50 0 GIAAMO COc1ccccc1N1CCN(C2CC[NH+](Cc3cccc(Cl)c3)CC2)CC1 ZINC000001155013 570249838 /nfs/dbraw/zinc/24/98/38/570249838.db2.gz PRFDASTXGZOLPD-UHFFFAOYSA-N 1 1 399.966 4.135 50 0 GIAAMO CCOc1ccc2oc(=O)cc(C[N@@H+]3CCN(c4cccc(C)c4)[C@@H](C)C3)c2c1 ZINC000020352968 570252688 /nfs/dbraw/zinc/25/26/88/570252688.db2.gz SRSJHFIKFYYGRC-SFHVURJKSA-N 1 1 392.499 4.211 50 0 GIAAMO CCOc1ccc2oc(=O)cc(C[N@H+]3CCN(c4cccc(C)c4)[C@@H](C)C3)c2c1 ZINC000020352968 570252690 /nfs/dbraw/zinc/25/26/90/570252690.db2.gz SRSJHFIKFYYGRC-SFHVURJKSA-N 1 1 392.499 4.211 50 0 GIAAMO CCOc1ccc(NC(=O)C[NH2+][C@@H](C)c2ccccc2Br)cc1 ZINC000012864684 570268952 /nfs/dbraw/zinc/26/89/52/570268952.db2.gz WTYZCPXHZNLDEO-ZDUSSCGKSA-N 1 1 377.282 4.137 50 0 GIAAMO CC(=O)Nc1cccc(NC(=O)C[NH2+][C@H](C)c2ccc(Cl)cc2Cl)c1 ZINC000012864626 570269061 /nfs/dbraw/zinc/26/90/61/570269061.db2.gz BJKPLIOKRMIXLT-LLVKDONJSA-N 1 1 380.275 4.241 50 0 GIAAMO COc1ccc(N[C@@H]2CCC[N@@H+](Cc3cc(OC)c(O)cc3Cl)C2)cc1 ZINC000020855429 570282262 /nfs/dbraw/zinc/28/22/62/570282262.db2.gz SDYZWYMNLQJXRY-MRXNPFEDSA-N 1 1 376.884 4.139 50 0 GIAAMO O=C(Nc1cc[nH]n1)c1ccc([C@@H]2CCC[N@H+]2C2Cc3ccccc3C2)s1 ZINC000020858642 570282340 /nfs/dbraw/zinc/28/23/40/570282340.db2.gz CIZUKYSPKNHJRE-KRWDZBQOSA-N 1 1 378.501 4.028 50 0 GIAAMO O=C(c1nc2sccn2c1C[N@H+]1CCC[C@@H](c2ccccc2)C1)N1CCCC1 ZINC000020915070 570284413 /nfs/dbraw/zinc/28/44/13/570284413.db2.gz LEWSJZVQZZGTJO-GOSISDBHSA-N 1 1 394.544 4.011 50 0 GIAAMO C[C@H](NC(=O)C[N@@H+]1CCC[C@@H]1c1ccc2c(c1)OCCCO2)c1ccc(F)cc1 ZINC000012886854 570285142 /nfs/dbraw/zinc/28/51/42/570285142.db2.gz SAURDOVVGVPZAG-OXJNMPFZSA-N 1 1 398.478 4.001 50 0 GIAAMO C[C@H](NC(=O)C[N@H+]1CCC[C@@H]1c1ccc2c(c1)OCCCO2)c1ccc(F)cc1 ZINC000012886854 570285144 /nfs/dbraw/zinc/28/51/44/570285144.db2.gz SAURDOVVGVPZAG-OXJNMPFZSA-N 1 1 398.478 4.001 50 0 GIAAMO CC(C)c1nccc(CN2CCC[C@@]3(CCC[N@@H+](Cc4ccccc4)C3)C2)n1 ZINC000215535521 570289783 /nfs/dbraw/zinc/28/97/83/570289783.db2.gz IJKHPTSRNAUSQK-XMMPIXPASA-N 1 1 378.564 4.478 50 0 GIAAMO C[N@@H+](Cc1ccccc1NC(=O)c1ccc2c(c1)OCC(=O)N2)C1CCCCC1 ZINC000012917513 570293693 /nfs/dbraw/zinc/29/36/93/570293693.db2.gz DGCQPGYDZLQNFC-UHFFFAOYSA-N 1 1 393.487 4.034 50 0 GIAAMO C[C@@H](C(=O)Nc1ccccc1-c1ccccc1)N1CC[NH+](Cc2ccccc2)CC1 ZINC000021822266 570297049 /nfs/dbraw/zinc/29/70/49/570297049.db2.gz JFLYHTYNRNQOFY-NRFANRHFSA-N 1 1 399.538 4.498 50 0 GIAAMO COc1cc(CNCC[NH+](C)C)cc(Cl)c1OCc1ccc(Cl)cc1 ZINC000022075729 570305200 /nfs/dbraw/zinc/30/52/00/570305200.db2.gz ZKWPCNMFPKNJKK-UHFFFAOYSA-N 1 1 383.319 4.232 50 0 GIAAMO Cc1cccc(OCC(=O)Nc2nc(C[N@H+]3C[C@H](C)C[C@H](C)C3)cs2)c1C ZINC000022293005 570312227 /nfs/dbraw/zinc/31/22/27/570312227.db2.gz XPXIYEJCIBFGGQ-GASCZTMLSA-N 1 1 387.549 4.255 50 0 GIAAMO Cc1cccc(OCC(=O)Nc2nc(C[N@@H+]3C[C@H](C)C[C@H](C)C3)cs2)c1C ZINC000022293005 570312229 /nfs/dbraw/zinc/31/22/29/570312229.db2.gz XPXIYEJCIBFGGQ-GASCZTMLSA-N 1 1 387.549 4.255 50 0 GIAAMO Cc1noc(C(C)C)c1C(=O)NC[C@H](c1ccccc1Cl)[NH+]1CCCC1 ZINC000022619747 570323520 /nfs/dbraw/zinc/32/35/20/570323520.db2.gz QLKDQPJRICTHRK-QGZVFWFLSA-N 1 1 375.900 4.327 50 0 GIAAMO COc1ccccc1Oc1nc(N2CCCCC2)nc2c1C[N@@H+](CC(C)C)CC2 ZINC000034755602 570332757 /nfs/dbraw/zinc/33/27/57/570332757.db2.gz UNQUNFNWTMXRBL-UHFFFAOYSA-N 1 1 396.535 4.282 50 0 GIAAMO Cc1ccc(NC(=O)CN2CC[NH+](Cc3csc4ccccc34)CC2)c(C)c1 ZINC000022930536 570336859 /nfs/dbraw/zinc/33/68/59/570336859.db2.gz YXEIVEXHNVAHDK-UHFFFAOYSA-N 1 1 393.556 4.274 50 0 GIAAMO COc1ccc(C[N@H+]2CCCN(Cc3ncc(-c4ccccc4)o3)CC2)cc1 ZINC000023007519 570340208 /nfs/dbraw/zinc/34/02/08/570340208.db2.gz XNUKRRWQZTWJQS-UHFFFAOYSA-N 1 1 377.488 4.058 50 0 GIAAMO COc1cccc(NC(=O)c2ccc([C@@H]3CCC[N@@H+]3Cc3cnn(C)c3)s2)c1 ZINC000023129932 570345688 /nfs/dbraw/zinc/34/56/88/570345688.db2.gz XTSYTARLJNJIBF-SFHVURJKSA-N 1 1 396.516 4.080 50 0 GIAAMO COc1cccc(NC(=O)c2ccc([C@@H]3CCC[N@H+]3Cc3cnn(C)c3)s2)c1 ZINC000023129932 570345690 /nfs/dbraw/zinc/34/56/90/570345690.db2.gz XTSYTARLJNJIBF-SFHVURJKSA-N 1 1 396.516 4.080 50 0 GIAAMO CNC(=O)c1ccc([C@H]2CCC[N@@H+]2CC2=Cc3cc(Cl)ccc3OC2)s1 ZINC000023340011 570355515 /nfs/dbraw/zinc/35/55/15/570355515.db2.gz YIZMRZKWKPLJAH-MRXNPFEDSA-N 1 1 388.920 4.374 50 0 GIAAMO CNC(=O)c1ccc([C@H]2CCC[N@H+]2CC2=Cc3cc(Cl)ccc3OC2)s1 ZINC000023340011 570355519 /nfs/dbraw/zinc/35/55/19/570355519.db2.gz YIZMRZKWKPLJAH-MRXNPFEDSA-N 1 1 388.920 4.374 50 0 GIAAMO O=c1[nH]c(-c2cccc(C[N@H+]3CC[C@H]3c3ccc(F)cc3)c2)nc2c1CCC2 ZINC000023379933 570358833 /nfs/dbraw/zinc/35/88/33/570358833.db2.gz WNWXCXCRVCQFRH-NRFANRHFSA-N 1 1 375.447 4.012 50 0 GIAAMO O=c1[nH]c(-c2cccc(C[N@@H+]3CC[C@H]3c3ccc(F)cc3)c2)nc2c1CCC2 ZINC000023379933 570358834 /nfs/dbraw/zinc/35/88/34/570358834.db2.gz WNWXCXCRVCQFRH-NRFANRHFSA-N 1 1 375.447 4.012 50 0 GIAAMO Cc1nn(C)c(Cl)c1C[NH2+][C@H]1CCCc2c1cnn2-c1cc(F)cc(F)c1 ZINC000014976731 570390780 /nfs/dbraw/zinc/39/07/80/570390780.db2.gz LUDPDKDUGOFEJA-KRWDZBQOSA-N 1 1 391.853 4.013 50 0 GIAAMO Cc1ccc([C@H]([NH2+]CC(=O)Nc2ccc3c(c2)OCCO3)c2cccs2)cc1 ZINC000025058632 570404772 /nfs/dbraw/zinc/40/47/72/570404772.db2.gz AVVTWXJIFUGRPH-QFIPXVFZSA-N 1 1 394.496 4.145 50 0 GIAAMO CC(C)(CNC(=O)c1ccc(Br)s1)[N@H+]1CCc2ccccc2C1 ZINC000025897738 570420541 /nfs/dbraw/zinc/42/05/41/570420541.db2.gz HMJBNGJVDLAKBX-UHFFFAOYSA-N 1 1 393.350 4.077 50 0 GIAAMO CC(C)Cn1ccc2cc(NC(=O)N3C[C@@H]4C[N@H+]5CCCC[C@H]5[C@H]4C3)ccc21 ZINC000242338967 570432466 /nfs/dbraw/zinc/43/24/66/570432466.db2.gz ZDVRLEZRGXLOBD-VCOUNFBDSA-N 1 1 380.536 4.245 50 0 GIAAMO O=c1cc(C[NH+]2CCN(c3ccc(F)cc3)CC2)c2cc3c(cc2o1)CCCC3 ZINC000054105922 570440256 /nfs/dbraw/zinc/44/02/56/570440256.db2.gz ABHTWRAHNNWKAR-UHFFFAOYSA-N 1 1 392.474 4.133 50 0 aggregator GIAAMO COc1ccc(C[N@@H+](Cc2ccco2)C[C@@H](O)COc2ccc(C)cc2)cc1 ZINC000028580883 570461458 /nfs/dbraw/zinc/46/14/58/570461458.db2.gz SIBBKWFNABOIKM-HXUWFJFHSA-N 1 1 381.472 4.039 50 0 GIAAMO COc1ccc(C[N@H+](Cc2ccco2)C[C@@H](O)COc2ccc(C)cc2)cc1 ZINC000028580883 570461462 /nfs/dbraw/zinc/46/14/62/570461462.db2.gz SIBBKWFNABOIKM-HXUWFJFHSA-N 1 1 381.472 4.039 50 0 GIAAMO Cc1sc(-c2ccco2)nc1C(=O)N1CCC[N@H+](Cc2ccc(F)cc2)CC1 ZINC000030615520 570492363 /nfs/dbraw/zinc/49/23/63/570492363.db2.gz IWXPEBQPZOTMLM-UHFFFAOYSA-N 1 1 399.491 4.199 50 0 GIAAMO Cc1sc(-c2ccco2)nc1C(=O)N1CCC[N@@H+](Cc2ccc(F)cc2)CC1 ZINC000030615520 570492365 /nfs/dbraw/zinc/49/23/65/570492365.db2.gz IWXPEBQPZOTMLM-UHFFFAOYSA-N 1 1 399.491 4.199 50 0 GIAAMO Cc1[nH+]ccn1CC(=O)Nc1ccc(Oc2ccc(Br)cc2)cc1 ZINC000030696941 570493884 /nfs/dbraw/zinc/49/38/84/570493884.db2.gz POJOZAADCIMIMB-UHFFFAOYSA-N 1 1 386.249 4.385 50 0 GIAAMO O=C(Nc1cccc(Cl)c1)C1CC[NH+](Cc2nc(-c3ccccc3)no2)CC1 ZINC000030955124 570502311 /nfs/dbraw/zinc/50/23/11/570502311.db2.gz QNLSCDCORIZGDL-UHFFFAOYSA-N 1 1 396.878 4.241 50 0 GIAAMO CCOc1cc(C[N@H+]2CCCCC[C@@H]2c2ccc(C)cc2)ccc1OCC(N)=O ZINC000033087222 570519617 /nfs/dbraw/zinc/51/96/17/570519617.db2.gz PKANNZXBRFZQLD-OAQYLSRUSA-N 1 1 396.531 4.375 50 0 GIAAMO O=C(NC[C@H](c1ccsc1)[N@@H+]1CCc2ccccc2C1)c1ccccc1F ZINC000022766056 570543782 /nfs/dbraw/zinc/54/37/82/570543782.db2.gz WDQFKDDUQJYAQC-OAQYLSRUSA-N 1 1 380.488 4.417 50 0 GIAAMO O=C(NC[C@H](c1ccsc1)[N@H+]1CCc2ccccc2C1)c1ccccc1F ZINC000022766056 570543784 /nfs/dbraw/zinc/54/37/84/570543784.db2.gz WDQFKDDUQJYAQC-OAQYLSRUSA-N 1 1 380.488 4.417 50 0 GIAAMO O=C(NC[C@@H](c1ccco1)[NH+]1CCCCC1)c1ccc(Br)s1 ZINC000032967235 570550836 /nfs/dbraw/zinc/55/08/36/570550836.db2.gz HQKZMNVRWIMLIP-LBPRGKRZSA-N 1 1 383.311 4.061 50 0 GIAAMO COc1cccc(C(=O)NC[C@H](c2cccs2)[N@@H+]2CCc3ccccc3C2)c1 ZINC000022907780 570563937 /nfs/dbraw/zinc/56/39/37/570563937.db2.gz BQEHBUXVVNEIKU-OAQYLSRUSA-N 1 1 392.524 4.286 50 0 GIAAMO COc1cccc(C(=O)NC[C@H](c2cccs2)[N@H+]2CCc3ccccc3C2)c1 ZINC000022907780 570563940 /nfs/dbraw/zinc/56/39/40/570563940.db2.gz BQEHBUXVVNEIKU-OAQYLSRUSA-N 1 1 392.524 4.286 50 0 GIAAMO O=C(NC[C@@H](c1cccs1)[N@@H+]1CCc2ccccc2C1)c1ccccc1F ZINC000022907747 570564257 /nfs/dbraw/zinc/56/42/57/570564257.db2.gz RQVZROCCDDLBOL-FQEVSTJZSA-N 1 1 380.488 4.417 50 0 GIAAMO O=C(NC[C@@H](c1cccs1)[N@H+]1CCc2ccccc2C1)c1ccccc1F ZINC000022907747 570564261 /nfs/dbraw/zinc/56/42/61/570564261.db2.gz RQVZROCCDDLBOL-FQEVSTJZSA-N 1 1 380.488 4.417 50 0 GIAAMO O[C@@H](Cn1c2ccccc2c2ccccc21)C[NH+]1CCN(C2CCCCC2)CC1 ZINC000019371773 570596913 /nfs/dbraw/zinc/59/69/13/570596913.db2.gz WKPISNNUENYDRL-OAQYLSRUSA-N 1 1 391.559 4.106 50 0 GIAAMO CC[N@H+]1CCc2cc(OC)c(OC)cc2[C@H]1[C@@H](NC(=O)c1ccccc1)C(C)C ZINC000169681290 570601438 /nfs/dbraw/zinc/60/14/38/570601438.db2.gz SDEDZPKGPMPZOG-GOTSBHOMSA-N 1 1 396.531 4.078 50 0 GIAAMO COc1ccc(-c2nn(-c3ccccc3)cc2C[N@@H+]2CCC[C@@H](OC)C2)c(F)c1 ZINC000012387611 570652228 /nfs/dbraw/zinc/65/22/28/570652228.db2.gz NFXGOGKUZMNFRP-HXUWFJFHSA-N 1 1 395.478 4.298 50 0 GIAAMO Cc1ccccc1CCC(=O)N(C)C[C@H]1CCC[N@@H+](CCc2ccccc2F)C1 ZINC000012429486 570658166 /nfs/dbraw/zinc/65/81/66/570658166.db2.gz IAFCBLYBABTMSQ-OAQYLSRUSA-N 1 1 396.550 4.480 50 0 GIAAMO O=C(C[N@@H+]1CC[C@]2(O)CCCC[C@@H]2[C@H]1c1ccc(F)cc1)Nc1ccccc1 ZINC000013814167 570671222 /nfs/dbraw/zinc/67/12/22/570671222.db2.gz FHFBPLPSTLMVAQ-YMPZKCBVSA-N 1 1 382.479 4.133 50 0 GIAAMO O=C(C[N@H+]1CC[C@]2(O)CCCC[C@@H]2[C@H]1c1ccc(F)cc1)Nc1ccccc1 ZINC000013814167 570671226 /nfs/dbraw/zinc/67/12/26/570671226.db2.gz FHFBPLPSTLMVAQ-YMPZKCBVSA-N 1 1 382.479 4.133 50 0 GIAAMO CSCCC[N@H+]1CCC[C@@H](C(=O)Nc2ccc(-c3cscn3)cc2)C1 ZINC000012470246 570672064 /nfs/dbraw/zinc/67/20/64/570672064.db2.gz WTRXZRBFLYHIMG-MRXNPFEDSA-N 1 1 375.563 4.214 50 0 GIAAMO Cc1ccc(C(=O)N2CC[C@@]3(C2)CCC[N@H+](Cc2cccc(F)c2F)C3)s1 ZINC000012579311 570683308 /nfs/dbraw/zinc/68/33/08/570683308.db2.gz OAURJNXFJKMXRI-NRFANRHFSA-N 1 1 390.499 4.463 50 0 GIAAMO Cc1ccc(C(=O)N2CC[C@@]3(C2)CCC[N@@H+](Cc2cccc(F)c2F)C3)s1 ZINC000012579311 570683314 /nfs/dbraw/zinc/68/33/14/570683314.db2.gz OAURJNXFJKMXRI-NRFANRHFSA-N 1 1 390.499 4.463 50 0 GIAAMO CCOc1cc(C[N@H+]2CCC[C@H](C(=O)c3ccc(OC)c(F)c3)C2)ccc1O ZINC000012580790 570683804 /nfs/dbraw/zinc/68/38/04/570683804.db2.gz QBZVSKIEKHRAGW-KRWDZBQOSA-N 1 1 387.451 4.034 50 0 GIAAMO CCN(C[C@@H]1CCC[N@@H+](CCc2cccc(F)c2)C1)C(=O)c1cc(C)oc1C ZINC000012589292 570686482 /nfs/dbraw/zinc/68/64/82/570686482.db2.gz HLEOWZVZGQPICN-HXUWFJFHSA-N 1 1 386.511 4.452 50 0 GIAAMO COc1ccc(C(=O)[C@@H]2CCC[N@H+](Cc3cc4ccccc4[nH]3)C2)c(OC)c1 ZINC000012594284 570688869 /nfs/dbraw/zinc/68/88/69/570688869.db2.gz XUISZGVNZUCQCN-QGZVFWFLSA-N 1 1 378.472 4.280 50 0 GIAAMO COc1ccc(C(=O)[C@@H]2CCC[N@@H+](Cc3cc4ccccc4[nH]3)C2)c(OC)c1 ZINC000012594284 570688871 /nfs/dbraw/zinc/68/88/71/570688871.db2.gz XUISZGVNZUCQCN-QGZVFWFLSA-N 1 1 378.472 4.280 50 0 GIAAMO CC(C)(C)C(=O)Nc1ccnn1C1CC[NH+](Cc2ccc(F)cc2Cl)CC1 ZINC000012595647 570689176 /nfs/dbraw/zinc/68/91/76/570689176.db2.gz 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/nfs/dbraw/zinc/21/09/54/570210954.db2.gz CESQIEUUKLAMLY-KRWDZBQOSA-N 1 1 379.529 4.457 50 0 GIAAMO COc1cccc(C(=O)N2CC[NH+](C(c3ccccc3)c3ccccc3)CC2)c1 ZINC000019720578 570211362 /nfs/dbraw/zinc/21/13/62/570211362.db2.gz LBIPVBRZQSUOJR-UHFFFAOYSA-N 1 1 386.495 4.243 50 0 GIAAMO OCC1CCN([C@H]2CCC[N@@H+](Cc3cccc4c5ccccc5oc43)C2)CC1 ZINC000019732426 570211753 /nfs/dbraw/zinc/21/17/53/570211753.db2.gz KVIQSMSOJZJKSO-FQEVSTJZSA-N 1 1 378.516 4.255 50 0 GIAAMO OCC1CC[NH+]([C@H]2CCCN(Cc3cccc4c5ccccc5oc43)C2)CC1 ZINC000019732426 570211755 /nfs/dbraw/zinc/21/17/55/570211755.db2.gz KVIQSMSOJZJKSO-FQEVSTJZSA-N 1 1 378.516 4.255 50 0 GIAAMO CN(C[C@@]1(C)CC[N@@H+](C)C1)C(=O)Nc1ccc2oc(-c3ccccc3)nc2c1 ZINC000096151023 570215311 /nfs/dbraw/zinc/21/53/11/570215311.db2.gz HMUXOMZTMDBCAX-QFIPXVFZSA-N 1 1 378.476 4.300 50 0 GIAAMO Cn1cc(NC(=O)c2ccc([C@H]3CCC[N@@H+]3C/C=C/c3ccco3)s2)cn1 ZINC000019792483 570219490 /nfs/dbraw/zinc/21/94/90/570219490.db2.gz DHTNIJSNBYNPRL-WAUBUAMCSA-N 1 1 382.489 4.177 50 0 GIAAMO Cn1cc(NC(=O)c2ccc([C@H]3CCC[N@H+]3C/C=C/c3ccco3)s2)cn1 ZINC000019792483 570219492 /nfs/dbraw/zinc/21/94/92/570219492.db2.gz DHTNIJSNBYNPRL-WAUBUAMCSA-N 1 1 382.489 4.177 50 0 GIAAMO Fc1ccc(N2CCN([C@@H]3CCC[N@@H+](CCCc4ccccc4)C3)CC2)cc1 ZINC000019836007 570223856 /nfs/dbraw/zinc/22/38/56/570223856.db2.gz YIRVPHWXQIYZAT-XMMPIXPASA-N 1 1 381.539 4.045 50 0 GIAAMO CC(C)Cc1ccc(C[N@@H+]2CCc3nnc(CCc4ccccc4)n3CC2)cc1 ZINC000019839982 570224057 /nfs/dbraw/zinc/22/40/57/570224057.db2.gz IYEFCKVELCOQCD-UHFFFAOYSA-N 1 1 388.559 4.320 50 0 GIAAMO C[N@H+](CCC(=O)Nc1cc(Cl)ccc1Cl)CC(=O)Nc1cccc(F)c1 ZINC000012818399 570232084 /nfs/dbraw/zinc/23/20/84/570232084.db2.gz ZGMJFKBVAFMGOY-UHFFFAOYSA-N 1 1 398.265 4.032 50 0 GIAAMO C[N@@H+](CCC(=O)Nc1cc(Cl)ccc1Cl)CC(=O)Nc1cccc(F)c1 ZINC000012818399 570232086 /nfs/dbraw/zinc/23/20/86/570232086.db2.gz ZGMJFKBVAFMGOY-UHFFFAOYSA-N 1 1 398.265 4.032 50 0 GIAAMO CCc1ccc2c(c1)c(C)c(C(=O)N1CC[NH+](Cc3ccccc3)CC1)n2C ZINC000020019543 570235229 /nfs/dbraw/zinc/23/52/29/570235229.db2.gz HUMFGHFFEUTPDL-UHFFFAOYSA-N 1 1 375.516 4.007 50 0 GIAAMO C[C@@H]1C[NH+](C[C@H](O)COc2ccc(C34CC5CC(CC(C5)C3)C4)cc2)C[C@@H](C)O1 ZINC000020117792 570241557 /nfs/dbraw/zinc/24/15/57/570241557.db2.gz PRIUSAKWLFGHOY-HQNNPFIKSA-N 1 1 399.575 4.003 50 0 GIAAMO COCCNC(=O)c1ccc([C@H]2CCC[N@H+]2Cc2cccc3cnccc32)s1 ZINC000020201347 570247429 /nfs/dbraw/zinc/24/74/29/570247429.db2.gz BRLRUIOHTRCTEI-LJQANCHMSA-N 1 1 395.528 4.010 50 0 GIAAMO COc1ccc(NC(=O)NCC[C@H]2CC[N@@H+](Cc3ccccc3)C2)cc1Cl ZINC000097784857 570256003 /nfs/dbraw/zinc/25/60/03/570256003.db2.gz MYGZMSDWJADKAH-KRWDZBQOSA-N 1 1 387.911 4.382 50 0 GIAAMO COc1cc(C[N@H+]2CCC[C@@](CO)(Cc3ccccc3C)C2)cc(Cl)c1O ZINC000020451215 570257472 /nfs/dbraw/zinc/25/74/72/570257472.db2.gz GAQVFHXYQSKCJC-JOCHJYFZSA-N 1 1 389.923 4.180 50 0 GIAAMO CN(C)c1nc(Cl)c(CN2CCC[C@H]([N@@H+](C)CCc3ccccc3)C2)s1 ZINC000020452140 570257635 /nfs/dbraw/zinc/25/76/35/570257635.db2.gz PUUAGJYOQMOWNX-KRWDZBQOSA-N 1 1 393.000 4.001 50 0 GIAAMO c1ccc(OCc2noc(C[N@@H+]3CCC[C@@H](c4nc5ccccc5o4)C3)n2)cc1 ZINC000020453991 570258285 /nfs/dbraw/zinc/25/82/85/570258285.db2.gz DZOQVORIPZFRCX-MRXNPFEDSA-N 1 1 390.443 4.169 50 0 GIAAMO c1ccc(OCc2noc(C[N@H+]3CCC[C@@H](c4nc5ccccc5o4)C3)n2)cc1 ZINC000020453991 570258286 /nfs/dbraw/zinc/25/82/86/570258286.db2.gz DZOQVORIPZFRCX-MRXNPFEDSA-N 1 1 390.443 4.169 50 0 GIAAMO Cc1oc(-c2cccc(F)c2F)nc1CN1CC[NH+](Cc2cccs2)CC1 ZINC000020534162 570265752 /nfs/dbraw/zinc/26/57/52/570265752.db2.gz MAFOYVVLDAHKJR-UHFFFAOYSA-N 1 1 389.471 4.308 50 0 GIAAMO COc1ccc(NC(=O)c2ccc(C[N@@H+]3CCn4cccc4[C@@H]3C)cc2)cc1 ZINC000012866663 570269404 /nfs/dbraw/zinc/26/94/04/570269404.db2.gz SNFSMIUQHWMWGO-KRWDZBQOSA-N 1 1 375.472 4.326 50 0 GIAAMO COc1ccc(NC(=O)c2ccc(C[N@H+]3CCn4cccc4[C@@H]3C)cc2)cc1 ZINC000012866663 570269406 /nfs/dbraw/zinc/26/94/06/570269406.db2.gz SNFSMIUQHWMWGO-KRWDZBQOSA-N 1 1 375.472 4.326 50 0 GIAAMO CCOc1ccc([C@H](C)[NH2+][C@@H](C)c2nc3ccccc3c(=O)[nH]2)cc1OCC ZINC000049581351 570271436 /nfs/dbraw/zinc/27/14/36/570271436.db2.gz HZQZXLBGHNRKRP-GJZGRUSLSA-N 1 1 381.476 4.132 50 0 GIAAMO Cc1c(Cl)cccc1NC(=O)[C@@H](C)[N@@H+]1CCC[C@H](C(=O)Nc2ccccc2)C1 ZINC000035271113 570280160 /nfs/dbraw/zinc/28/01/60/570280160.db2.gz RLTSELQLVOGZBG-SJORKVTESA-N 1 1 399.922 4.326 50 0 GIAAMO Cc1c(Cl)cccc1NC(=O)[C@@H](C)[N@H+]1CCC[C@H](C(=O)Nc2ccccc2)C1 ZINC000035271113 570280161 /nfs/dbraw/zinc/28/01/61/570280161.db2.gz RLTSELQLVOGZBG-SJORKVTESA-N 1 1 399.922 4.326 50 0 GIAAMO C[NH2+]CCCNCc1ccc(OCc2ccc(Cl)cc2)c(Br)c1 ZINC000020876527 570283465 /nfs/dbraw/zinc/28/34/65/570283465.db2.gz LTLHJFMZLAYDGP-UHFFFAOYSA-N 1 1 397.744 4.381 50 0 GIAAMO CC[N@@H+]1CCc2nc(NC(=O)CCCc3nc4ccccc4s3)sc2C1 ZINC000021295342 570296465 /nfs/dbraw/zinc/29/64/65/570296465.db2.gz CXCSZOIJQBDIMD-UHFFFAOYSA-N 1 1 386.546 4.092 50 0 GIAAMO CC[N@H+]1CCc2nc(NC(=O)CCCc3nc4ccccc4s3)sc2C1 ZINC000021295342 570296467 /nfs/dbraw/zinc/29/64/67/570296467.db2.gz CXCSZOIJQBDIMD-UHFFFAOYSA-N 1 1 386.546 4.092 50 0 GIAAMO C[C@H](C(=O)Nc1ccc(Cl)cc1Cl)N1CC[NH+](Cc2ccccc2)CC1 ZINC000021822203 570297067 /nfs/dbraw/zinc/29/70/67/570297067.db2.gz PPFKQUGSHKKUCF-OAHLLOKOSA-N 1 1 392.330 4.138 50 0 GIAAMO Cc1cccc(OCC(=O)Nc2nc(C[NH+]3C[C@@H](C)C[C@H](C)C3)cs2)c1C ZINC000022293008 570312472 /nfs/dbraw/zinc/31/24/72/570312472.db2.gz XPXIYEJCIBFGGQ-GJZGRUSLSA-N 1 1 387.549 4.255 50 0 GIAAMO COc1ccccc1C[N@H+]1CCC[C@@H](N2CCN(c3cccc(Cl)c3)CC2)C1 ZINC000022913316 570334123 /nfs/dbraw/zinc/33/41/23/570334123.db2.gz AHVXUAHKPLIGIQ-JOCHJYFZSA-N 1 1 399.966 4.135 50 0 GIAAMO COc1ccccc1CN1CCC[C@@H]([NH+]2CCN(c3cccc(Cl)c3)CC2)C1 ZINC000022913316 570334126 /nfs/dbraw/zinc/33/41/26/570334126.db2.gz AHVXUAHKPLIGIQ-JOCHJYFZSA-N 1 1 399.966 4.135 50 0 GIAAMO O=C(NCCc1ccncc1)c1ccc([C@@H]2CCC[N@@H+]2Cc2ccoc2)s1 ZINC000023130420 570345611 /nfs/dbraw/zinc/34/56/11/570345611.db2.gz QBOXQZSNFBQQAA-SFHVURJKSA-N 1 1 381.501 4.046 50 0 GIAAMO O=C(NCCc1ccncc1)c1ccc([C@@H]2CCC[N@H+]2Cc2ccoc2)s1 ZINC000023130420 570345615 /nfs/dbraw/zinc/34/56/15/570345615.db2.gz QBOXQZSNFBQQAA-SFHVURJKSA-N 1 1 381.501 4.046 50 0 GIAAMO Cc1cccc(C[NH+]2CCN([C@H](C)c3nnc(-c4ccc(F)cc4)o3)CC2)c1 ZINC000022925455 570379509 /nfs/dbraw/zinc/37/95/09/570379509.db2.gz KSTBRSRHSBFJSQ-QGZVFWFLSA-N 1 1 380.467 4.063 50 0 GIAAMO CCc1nn2c(nc(C[N@H+](Cc3ccc(C(C)C)cc3)CC(C)C)cc2=O)s1 ZINC000035509828 570382554 /nfs/dbraw/zinc/38/25/54/570382554.db2.gz OFRWLJFZKHHOAP-UHFFFAOYSA-N 1 1 398.576 4.495 50 0 GIAAMO CC[N@H+](CC(=O)Nc1ccc(SC(F)F)cc1)Cc1ccc2c(c1)OCO2 ZINC000012982437 570406904 /nfs/dbraw/zinc/40/69/04/570406904.db2.gz WZCRNMWPIOIURM-UHFFFAOYSA-N 1 1 394.443 4.191 50 0 GIAAMO CC[N@@H+](CC(=O)Nc1ccc(SC(F)F)cc1)Cc1ccc2c(c1)OCO2 ZINC000012982437 570406905 /nfs/dbraw/zinc/40/69/05/570406905.db2.gz WZCRNMWPIOIURM-UHFFFAOYSA-N 1 1 394.443 4.191 50 0 GIAAMO O=C(Nc1ccccc1)[C@H]1CCC[N@H+](CN2c3cccc4cccc(c34)C2=O)C1 ZINC000013007982 570415877 /nfs/dbraw/zinc/41/58/77/570415877.db2.gz JKBLFAXHQOSMRQ-SFHVURJKSA-N 1 1 385.467 4.108 50 0 GIAAMO O=C(Nc1ccccc1)[C@H]1CCC[N@@H+](CN2c3cccc4cccc(c34)C2=O)C1 ZINC000013007982 570415878 /nfs/dbraw/zinc/41/58/78/570415878.db2.gz JKBLFAXHQOSMRQ-SFHVURJKSA-N 1 1 385.467 4.108 50 0 GIAAMO CC(C)(Oc1ccc(Cl)cc1)C(=O)NC[C@H](c1ccco1)[NH+]1CCCCC1 ZINC000013010095 570416214 /nfs/dbraw/zinc/41/62/14/570416214.db2.gz SSRLLARLRIRSEB-GOSISDBHSA-N 1 1 390.911 4.434 50 0 GIAAMO CCOc1ccccc1-c1noc(C[NH+]2CCC([C@H](O)c3ccccc3)CC2)n1 ZINC000026120247 570422349 /nfs/dbraw/zinc/42/23/49/570422349.db2.gz FZEZBHWGXCEXCZ-JOCHJYFZSA-N 1 1 393.487 4.081 50 0 GIAAMO c1ccc(-c2noc(C[N@H+](Cc3ccc4c(c3)OCO4)C3CCCC3)n2)cc1 ZINC000027235889 570432744 /nfs/dbraw/zinc/43/27/44/570432744.db2.gz AQNBYYNCNXNPSQ-UHFFFAOYSA-N 1 1 377.444 4.410 50 0 GIAAMO c1ccc(-c2noc(C[N@@H+](Cc3ccc4c(c3)OCO4)C3CCCC3)n2)cc1 ZINC000027235889 570432747 /nfs/dbraw/zinc/43/27/47/570432747.db2.gz AQNBYYNCNXNPSQ-UHFFFAOYSA-N 1 1 377.444 4.410 50 0 GIAAMO Cc1cc(C)c2oc(=O)cc(C[NH+]3CCN(c4cccc(Cl)c4)CC3)c2c1 ZINC000054106047 570441334 /nfs/dbraw/zinc/44/13/34/570441334.db2.gz VQCOSGGXCXSXQE-UHFFFAOYSA-N 1 1 382.891 4.385 50 0 GIAAMO COc1ccc2[nH]cc(C3=CC[N@@H+](Cc4ccc(C(=O)N(C)C)cc4)CC3)c2c1 ZINC000089312081 570445900 /nfs/dbraw/zinc/44/59/00/570445900.db2.gz CBDKZUNAJSQRNM-UHFFFAOYSA-N 1 1 389.499 4.168 50 0 GIAAMO Cc1cc(C)c2oc(C(=O)NC[C@@H](c3cccs3)[NH+]3CCCC3)cc(=O)c2c1 ZINC000028288432 570454932 /nfs/dbraw/zinc/45/49/32/570454932.db2.gz IFSSEDRUHBNJSO-KRWDZBQOSA-N 1 1 396.512 4.038 50 0 GIAAMO CCN1CC[NH+](C2(CNC(=O)c3oc4cc(C)ccc4c3C)CCCCC2)CC1 ZINC000028292633 570456570 /nfs/dbraw/zinc/45/65/70/570456570.db2.gz GHRZTXIKGLZGOP-UHFFFAOYSA-N 1 1 397.563 4.120 50 0 GIAAMO O=C(C[NH+]1CCC(c2nc3ccccc3s2)CC1)N1CCc2ccccc21 ZINC000006553497 570476021 /nfs/dbraw/zinc/47/60/21/570476021.db2.gz MJFVPAAATFKXCB-UHFFFAOYSA-N 1 1 377.513 4.065 50 0 GIAAMO CCOC(=O)[C@H]1CCC[N@H+](Cc2cc(F)cc3c2O[C@H](c2ccccc2)OC3)C1 ZINC000016695718 570495187 /nfs/dbraw/zinc/49/51/87/570495187.db2.gz LSLFUYBBYJAPSU-GAJHUEQPSA-N 1 1 399.462 4.209 50 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COc1ccc([C@H]([NH2+][C@H](C)C(=O)Nc2ccccc2OC)c2ccccc2)cc1 ZINC000032718929 206091570 /nfs/dbraw/zinc/09/15/70/206091570.db2.gz UQOVJZDWPCKXKZ-UZUQRXQVSA-N 1 1 390.483 4.410 50 0 GIAAMO O[C@]12CCCC[C@H]1[C@H](c1ccc3c(c1)OCO3)[N@@H+](Cc1cccc(F)c1)CC2 ZINC000230017942 206109479 /nfs/dbraw/zinc/10/94/79/206109479.db2.gz ORZUIMGMXAQGPX-VJBMBRPKSA-N 1 1 383.463 4.423 50 0 GIAAMO CC(=O)N[C@H](CC(=O)Nc1ccc(C[N@@H+]2CCCC[C@H]2C)cc1)c1cccs1 ZINC000230206771 206112323 /nfs/dbraw/zinc/11/23/23/206112323.db2.gz MKRGJHJYJFYREU-OXQOHEQNSA-N 1 1 399.560 4.329 50 0 GIAAMO CCn1c(C[NH+]2CCC(C(=O)N[C@@H](C)c3ccccc3)CC2)nc2ccccc21 ZINC000248245916 206138931 /nfs/dbraw/zinc/13/89/31/206138931.db2.gz JQOYPUXHOWTWQV-SFHVURJKSA-N 1 1 390.531 4.146 50 0 GIAAMO CCn1c(C[N@H+]2CCC[C@@H](C(=O)Nc3cccc(C)c3)C2)nc2ccccc21 ZINC000248007719 206135619 /nfs/dbraw/zinc/13/56/19/206135619.db2.gz WEEHETLVLVTAFM-GOSISDBHSA-N 1 1 376.504 4.215 50 0 GIAAMO CCn1c(C[NH+]2CCC(C(=O)N[C@H](C)c3ccccc3)CC2)nc2ccccc21 ZINC000248245913 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0 GIAAMO Cc1ccccc1CC[N@@H+]1CCC[C@H](CN(C)C(=O)NCc2ccccc2)C1 ZINC000014974164 204549441 /nfs/dbraw/zinc/54/94/41/204549441.db2.gz BTPAKMJBYHTFNE-JOCHJYFZSA-N 1 1 379.548 4.091 50 0 GIAAMO COCCNC(=O)c1ccc([C@@H]2CCC[N@H+]2Cc2cccc3cnccc32)s1 ZINC000020201344 204706817 /nfs/dbraw/zinc/70/68/17/204706817.db2.gz BRLRUIOHTRCTEI-IBGZPJMESA-N 1 1 395.528 4.010 50 0 GIAAMO COc1ccc(OCC[N@@H+](C)Cc2cc(=O)oc3cc(C)c(Cl)cc23)cc1 ZINC000020799262 204741127 /nfs/dbraw/zinc/74/11/27/204741127.db2.gz PCFDYRVZWHXXGA-UHFFFAOYSA-N 1 1 387.863 4.274 50 0 GIAAMO C[C@@H]([NH2+]Cc1c(C(=O)N2CCCC2)nc2ccccn21)c1ccccc1Cl ZINC000020920732 204745500 /nfs/dbraw/zinc/74/55/00/204745500.db2.gz STHPCDLVNZKMPP-OAHLLOKOSA-N 1 1 382.895 4.075 50 0 GIAAMO C[C@H]1CN(Cc2cn(C)nc2-c2ccc(Oc3ccccc3)cc2)CC[N@H+]1C ZINC000022932698 204794698 /nfs/dbraw/zinc/79/46/98/204794698.db2.gz MHWRNFKFDKMEMA-SFHVURJKSA-N 1 1 376.504 4.015 50 0 GIAAMO C[C@H]1C[N@H+](Cc2cn(C)nc2-c2ccc(Oc3ccccc3)cc2)CCN1C ZINC000022932698 204794702 /nfs/dbraw/zinc/79/47/02/204794702.db2.gz MHWRNFKFDKMEMA-SFHVURJKSA-N 1 1 376.504 4.015 50 0 GIAAMO C[C@H]1C[N@@H+](Cc2cn(C)nc2-c2ccc(Oc3ccccc3)cc2)CCN1C ZINC000022932698 204794706 /nfs/dbraw/zinc/79/47/06/204794706.db2.gz MHWRNFKFDKMEMA-SFHVURJKSA-N 1 1 376.504 4.015 50 0 GIAAMO COc1ccc(C[N@@H+](Cc2ccccc2F)C[C@@H](O)COc2ccccc2)cc1 ZINC000036095339 205005532 /nfs/dbraw/zinc/00/55/32/205005532.db2.gz WVGNJFDVMPBAMM-OAQYLSRUSA-N 1 1 395.474 4.276 50 0 GIAAMO COc1ccc(C[N@H+](Cc2ccccc2F)C[C@@H](O)COc2ccccc2)cc1 ZINC000036095339 205005536 /nfs/dbraw/zinc/00/55/36/205005536.db2.gz WVGNJFDVMPBAMM-OAQYLSRUSA-N 1 1 395.474 4.276 50 0 GIAAMO CCOc1cc(CNC[C@@H]2CCC[N@@H+]2CC)cc(Br)c1OC(C)C ZINC000040719603 205069055 /nfs/dbraw/zinc/06/90/55/205069055.db2.gz DLVLHDBYLPXAMT-INIZCTEOSA-N 1 1 399.373 4.209 50 0 GIAAMO CCOc1cc(CNC[C@@H]2CCC[N@H+]2CC)cc(Br)c1OC(C)C ZINC000040719603 205069059 /nfs/dbraw/zinc/06/90/59/205069059.db2.gz DLVLHDBYLPXAMT-INIZCTEOSA-N 1 1 399.373 4.209 50 0 GIAAMO C[C@@H](c1cc2ccccc2o1)[N@H+](C)Cc1ccc(S(=O)(=O)N2CCCC2)o1 ZINC000047280019 205110161 /nfs/dbraw/zinc/11/01/61/205110161.db2.gz UXOXIRAXNDGLPW-HNNXBMFYSA-N 1 1 388.489 4.003 50 0 GIAAMO C[C@@H](c1cc2ccccc2o1)[N@@H+](C)Cc1ccc(S(=O)(=O)N2CCCC2)o1 ZINC000047280019 205110164 /nfs/dbraw/zinc/11/01/64/205110164.db2.gz UXOXIRAXNDGLPW-HNNXBMFYSA-N 1 1 388.489 4.003 50 0 GIAAMO CCOc1ccc(OCC)c(NC(=O)N2CC[N@H+](C)C[C@@H]2c2ccccc2)c1 ZINC000048236305 205115550 /nfs/dbraw/zinc/11/55/50/205115550.db2.gz CFXMWLVTIRZCBX-HXUWFJFHSA-N 1 1 383.492 4.005 50 0 GIAAMO CCOc1ccc(OCC)c(NC(=O)N2CC[N@@H+](C)C[C@@H]2c2ccccc2)c1 ZINC000048236305 205115553 /nfs/dbraw/zinc/11/55/53/205115553.db2.gz CFXMWLVTIRZCBX-HXUWFJFHSA-N 1 1 383.492 4.005 50 0 GIAAMO C[C@@H]1C[NH+](Cc2ccc(C(=O)N3CCC[C@@H]3c3ccsc3)cc2)C[C@@H](C)O1 ZINC000048251678 205115579 /nfs/dbraw/zinc/11/55/79/205115579.db2.gz CXLRGMFDVFXTRE-CBGDNZLLSA-N 1 1 384.545 4.335 50 0 GIAAMO COc1ccc([C@@H]2CCC[N@@H+]2CC(=O)N2CCC[C@H]3CCCC[C@@H]32)cc1OC 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ZINC000065330047 205230125 /nfs/dbraw/zinc/23/01/25/205230125.db2.gz NITKUXBTRFZVEP-UHFFFAOYSA-N 1 1 382.895 4.181 50 0 GIAAMO CCCc1ccc(-c2c(-c3ccccc3)ncn2CCN2CC[NH+](C)CC2)o1 ZINC000065528280 205236182 /nfs/dbraw/zinc/23/61/82/205236182.db2.gz JJAJRBNWHYZGQU-UHFFFAOYSA-N 1 1 378.520 4.010 50 0 GIAAMO Cc1ccc(O)c(C(=O)NC2CC[NH+](Cc3cccc(C(F)(F)F)c3)CC2)c1 ZINC000065553062 205237275 /nfs/dbraw/zinc/23/72/75/205237275.db2.gz LAZPIWUNTOUWSJ-UHFFFAOYSA-N 1 1 392.421 4.114 50 0 GIAAMO Cc1csc([C@@H]2CCCCN2C(=O)[C@H]2CCC[N@@H+](Cc3ccccc3)C2)n1 ZINC000065553713 205238405 /nfs/dbraw/zinc/23/84/05/205238405.db2.gz OBZRVCMGVGGFKO-PMACEKPBSA-N 1 1 383.561 4.417 50 0 GIAAMO O=C(NC1CCCCC1)C1CC[NH+](Cc2ccc(Br)cc2)CC1 ZINC000065627118 205239679 /nfs/dbraw/zinc/23/96/79/205239679.db2.gz DYPBNSPPYHHFPJ-UHFFFAOYSA-N 1 1 379.342 4.110 50 0 GIAAMO CCOC(=O)CCC[N@@H+]1CCOc2c(O)cc(-c3cccc(Cl)c3)cc2C1 ZINC000067654322 205252458 /nfs/dbraw/zinc/25/24/58/205252458.db2.gz PGATZUGVBUFZHN-UHFFFAOYSA-N 1 1 389.879 4.250 50 0 GIAAMO CCOC(=O)CCC[N@H+]1CCOc2c(O)cc(-c3cccc(Cl)c3)cc2C1 ZINC000067654322 205252461 /nfs/dbraw/zinc/25/24/61/205252461.db2.gz PGATZUGVBUFZHN-UHFFFAOYSA-N 1 1 389.879 4.250 50 0 GIAAMO CC(C)c1[nH+]ccn1CCCNC(=O)c1ccc(NC2CCCCCC2)nc1 ZINC000067641065 205252898 /nfs/dbraw/zinc/25/28/98/205252898.db2.gz PXLVHYCIUVJAIA-UHFFFAOYSA-N 1 1 383.540 4.356 50 0 GIAAMO COC(=O)CCCC[N@H+]1CCOc2c(O)cc(-c3cccc(Cl)c3)cc2C1 ZINC000067743061 205258312 /nfs/dbraw/zinc/25/83/12/205258312.db2.gz GLTSTIWIKMMFNO-UHFFFAOYSA-N 1 1 389.879 4.250 50 0 GIAAMO O=C(c1ccc(-c2ccccc2)c(F)c1)[C@@H]1CCC[N@@H+](CCN2CCCC2=O)C1 ZINC000071498069 205286346 /nfs/dbraw/zinc/28/63/46/205286346.db2.gz IISFXVYMDORKEJ-HXUWFJFHSA-N 1 1 394.490 4.010 50 0 GIAAMO Cc1ccc(C(=O)N2CCC[N@@H+](Cc3ccc(F)cc3)[C@H](C(C)C)C2)c(O)c1 ZINC000071748958 205290148 /nfs/dbraw/zinc/29/01/48/205290148.db2.gz NWEHBKTXXGMBKO-NRFANRHFSA-N 1 1 384.495 4.212 50 0 GIAAMO COc1ccc(-n2c(C[N@H+]3CCC[C@H](c4cc[nH]n4)C3)nc3ccccc32)cc1 ZINC000071813615 205299733 /nfs/dbraw/zinc/29/97/33/205299733.db2.gz AYSZDQWQKTUUIQ-KRWDZBQOSA-N 1 1 387.487 4.137 50 0 GIAAMO Cc1nc(N(C)C)cc(Nc2ccc(NC(=O)Nc3ccccc3F)cc2)[nH+]1 ZINC000072119336 205304178 /nfs/dbraw/zinc/30/41/78/205304178.db2.gz NBZMBVDLXNHWMC-UHFFFAOYSA-N 1 1 380.427 4.378 50 0 GIAAMO Cc1nc(Nc2ccc(NC(=O)Nc3ccccc3F)cc2)cc(N(C)C)[nH+]1 ZINC000072119336 205304181 /nfs/dbraw/zinc/30/41/81/205304181.db2.gz NBZMBVDLXNHWMC-UHFFFAOYSA-N 1 1 380.427 4.378 50 0 GIAAMO O=C([C@H]1CCC[N@@H+](Cc2cccnc2)C1)N1CCC(CCc2ccccc2)CC1 ZINC000069443200 205276981 /nfs/dbraw/zinc/27/69/81/205276981.db2.gz HGVLHJLNTZUMJY-DEOSSOPVSA-N 1 1 391.559 4.165 50 0 GIAAMO COc1ccc([C@H]2CCCN2C(=O)[C@H]2CC[N@H+](C3CCCCC3)C2)c(OC)c1 ZINC000072312740 205323990 /nfs/dbraw/zinc/32/39/90/205323990.db2.gz PALRWKDXEPKPEB-LAUBAEHRSA-N 1 1 386.536 4.022 50 0 GIAAMO CCS[C@H]1CC[C@@H]([N@@H+](C)CC(=O)Nc2ccc(Br)cc2C)C1 ZINC000072305264 205321679 /nfs/dbraw/zinc/32/16/79/205321679.db2.gz HSJTYKXMCBXAAS-CABCVRRESA-N 1 1 385.371 4.302 50 0 GIAAMO COc1ccccc1-c1nc2cc(Cl)ccc2cc1C[N@H+]1CCC[C@H]1C(N)=O ZINC000072434414 205350682 /nfs/dbraw/zinc/35/06/82/205350682.db2.gz NZZLDENOJKPMJO-IBGZPJMESA-N 1 1 395.890 4.014 50 0 GIAAMO O=C1CC[C@@]2(CCC[N@H+](Cc3ccc(C(F)(F)F)cc3F)C2)CN1C1CC1 ZINC000077408179 205363172 /nfs/dbraw/zinc/36/31/72/205363172.db2.gz QKTBLFVYAAHFGD-LJQANCHMSA-N 1 1 384.417 4.212 50 0 GIAAMO O=C1CC[C@]2(CCC[N@H+](Cc3ccc(C(F)(F)F)cc3F)C2)CN1C1CC1 ZINC000077408178 205363191 /nfs/dbraw/zinc/36/31/91/205363191.db2.gz QKTBLFVYAAHFGD-IBGZPJMESA-N 1 1 384.417 4.212 50 0 GIAAMO C[C@@H]1CN(Cc2cn(-c3ccc(F)cc3)nc2-c2ccccc2Cl)CC[N@H+]1C ZINC000072419945 205346794 /nfs/dbraw/zinc/34/67/94/205346794.db2.gz WEHTVMPGMKJMFE-MRXNPFEDSA-N 1 1 398.913 4.468 50 0 GIAAMO Cc1cccc(-c2nc3cc4c(cc3cc2C[N@H+]2CCC[C@@H](C(N)=O)C2)CCC4)c1 ZINC000072411206 205346941 /nfs/dbraw/zinc/34/69/41/205346941.db2.gz XDXUHFAUAJWKBZ-OAQYLSRUSA-N 1 1 399.538 4.396 50 0 GIAAMO Cc1ccccc1-c1nn(-c2ccc(F)cc2F)cc1CN1CC[N@@H+](C)[C@H](C)C1 ZINC000072425007 205349680 /nfs/dbraw/zinc/34/96/80/205349680.db2.gz TYNZZWLFJTXWGR-QGZVFWFLSA-N 1 1 396.485 4.262 50 0 GIAAMO Fc1cccc2ccc(CN3C[C@H]4CC[C@@H]3C[N@@H+](Cc3ccccc3)C4)nc12 ZINC000095371305 205446509 /nfs/dbraw/zinc/44/65/09/205446509.db2.gz XRULWPFSJLFFMK-SIKLNZKXSA-N 1 1 375.491 4.470 50 0 GIAAMO O=C(Cc1c(F)cccc1Cl)N1CCC([N@H+]2CCc3sccc3C2)CC1 ZINC000225689379 206067483 /nfs/dbraw/zinc/06/74/83/206067483.db2.gz GFDHNHCXJABCGB-UHFFFAOYSA-N 1 1 392.927 4.132 50 0 GIAAMO O=C(c1cc(-c2ccccc2)on1)N1CCC([N@H+]2CCc3sccc3C2)CC1 ZINC000225688778 206067745 /nfs/dbraw/zinc/06/77/45/206067745.db2.gz KHAUCXYRPZQBHI-UHFFFAOYSA-N 1 1 393.512 4.066 50 0 GIAAMO Fc1ccc(Cn2nc(C[NH2+]Cc3cccs3)c(-c3ccccc3)n2)cc1 ZINC000247523889 206132591 /nfs/dbraw/zinc/13/25/91/206132591.db2.gz MJZCZOQOXJHMIL-UHFFFAOYSA-N 1 1 378.476 4.484 50 0 GIAAMO CC(C)n1c(C[NH+]2CCC(C(=O)NC3CCCCC3)CC2)nc2ccccc21 ZINC000248181115 206135581 /nfs/dbraw/zinc/13/55/81/206135581.db2.gz YREIUIBAZXSOHV-UHFFFAOYSA-N 1 1 382.552 4.278 50 0 GIAAMO CCCN(CCC)C(=O)[C@@H]1CCC[N@@H+](Cc2nc3ccccc3n2C(C)C)C1 ZINC000248007094 206136440 /nfs/dbraw/zinc/13/64/40/206136440.db2.gz PTPFOVDUAWOSRJ-LJQANCHMSA-N 1 1 384.568 4.478 50 0 GIAAMO COc1ccc(NC(=O)[C@@H](C)Nc2ccc([NH+]3CCC(C)CC3)cc2)cc1OC ZINC000012551779 221204914 /nfs/dbraw/zinc/20/49/14/221204914.db2.gz RTWCVRRZMRGBOT-QGZVFWFLSA-N 1 1 397.519 4.379 50 0 GIAAMO Cc1ccc2nc(CNc3ccccc3C[N@H+](C)C3CCCCC3)cc(=O)n2c1 ZINC000012554915 221205547 /nfs/dbraw/zinc/20/55/47/221205547.db2.gz FQHMRKLXKLHPBI-UHFFFAOYSA-N 1 1 390.531 4.380 50 0 GIAAMO Cc1ccccc1-c1nn(-c2ccc(F)cc2F)cc1C[N@H+]1CCC[C@@H](O)C1 ZINC000014954066 221320721 /nfs/dbraw/zinc/32/07/21/221320721.db2.gz LNPWVADUQVMUFH-GOSISDBHSA-N 1 1 383.442 4.083 50 0 GIAAMO c1cn(Cc2cscn2)c(C2CCN(c3ccc4ccccc4n3)CC2)[nH+]1 ZINC000091636209 136176900 /nfs/dbraw/zinc/17/69/00/136176900.db2.gz QXRZKQXCEPGMQM-UHFFFAOYSA-N 1 1 375.501 4.320 50 0 GIAAMO c1cn(Cc2ccccn2)c([C@@H]2CCCN(c3nccc(C4CCCC4)n3)C2)[nH+]1 ZINC000095499634 136179721 /nfs/dbraw/zinc/17/97/21/136179721.db2.gz OLVPAYQNVFQXBV-LJQANCHMSA-N 1 1 388.519 4.158 50 0 GIAAMO CC[C@@H]1CCCC[N@H+]1CCNC(=O)c1cc2c(s1)CN(C1CCCC1)C2 ZINC000065239009 222114766 /nfs/dbraw/zinc/11/47/66/222114766.db2.gz CLMMVRRSGIRGGP-QGZVFWFLSA-N 1 1 375.582 4.001 50 0 GIAAMO COc1ccc2cc(C[N@H+](C)Cc3ccncn3)c(-c3cccs3)nc2c1 ZINC000072477565 222264341 /nfs/dbraw/zinc/26/43/41/222264341.db2.gz UVJCPAIGTOOFOI-UHFFFAOYSA-N 1 1 376.485 4.394 50 0 GIAAMO COc1ccc2cc(C[N@@H+](C)Cc3ccncn3)c(-c3cccs3)nc2c1 ZINC000072477565 222264342 /nfs/dbraw/zinc/26/43/42/222264342.db2.gz UVJCPAIGTOOFOI-UHFFFAOYSA-N 1 1 376.485 4.394 50 0 GIAAMO CC(C)c1c(C[N@@H+](C)[C@H](C)Cc2ccccc2)n(C)n(-c2ccccc2)c1=O ZINC000000607861 570210692 /nfs/dbraw/zinc/21/06/92/570210692.db2.gz GNUXVOXXWGNPIV-LJQANCHMSA-N 1 1 377.532 4.362 50 0 world GIAAMO CC[N@H+]1C[C@@H](c2ccccc2)CC2(CCN(C(=O)c3c(C)noc3C)CC2)C1 ZINC000096165455 570217970 /nfs/dbraw/zinc/21/79/70/570217970.db2.gz RPDIRALSNMXZEL-FQEVSTJZSA-N 1 1 381.520 4.023 50 0 GIAAMO CN(C)C(=O)c1ccc([C@H]2CCC[N@H+]2Cc2ccc(-c3cc[nH]n3)s2)s1 ZINC000019789675 570219141 /nfs/dbraw/zinc/21/91/41/570219141.db2.gz LHOSLQJSJHDAHO-OAHLLOKOSA-N 1 1 386.546 4.239 50 0 GIAAMO CN1CC[NH+](CCO[C@H]2c3ccccc3CSc3ccc(Cl)cc32)CC1 ZINC000019802424 570220886 /nfs/dbraw/zinc/22/08/86/570220886.db2.gz HTQNTTWSGOYWOJ-NRFANRHFSA-N 1 1 388.964 4.299 50 0 aggregator GIAAMO COc1ccc(OC)c(CN2CC[NH+](Cc3ccc(C(F)(F)F)cc3)CC2)c1 ZINC000019832113 570223650 /nfs/dbraw/zinc/22/36/50/570223650.db2.gz DNPCBWJISCTROB-UHFFFAOYSA-N 1 1 394.437 4.040 50 0 GIAAMO Cc1ccccc1CN(C)C(=O)C[NH+]1CCC(c2nc3ccccc3s2)CC1 ZINC000012814020 570229298 /nfs/dbraw/zinc/22/92/98/570229298.db2.gz FYJKKHPZJDOGRA-UHFFFAOYSA-N 1 1 393.556 4.443 50 0 GIAAMO O=c1oc2ccc(Cl)cc2n1C[N@@H+]1CCC[C@H](c2nc3ccccc3o2)C1 ZINC000048300530 570234002 /nfs/dbraw/zinc/23/40/02/570234002.db2.gz JUQARQKRIOZGHC-ZDUSSCGKSA-N 1 1 383.835 4.226 50 0 GIAAMO O=c1oc2ccc(Cl)cc2n1C[N@H+]1CCC[C@H](c2nc3ccccc3o2)C1 ZINC000048300530 570234005 /nfs/dbraw/zinc/23/40/05/570234005.db2.gz JUQARQKRIOZGHC-ZDUSSCGKSA-N 1 1 383.835 4.226 50 0 GIAAMO Cc1ccc2nc(C[N@@H+]3CCC[C@H]3c3cccc(Br)c3)cc(=O)n2c1 ZINC000048366418 570246401 /nfs/dbraw/zinc/24/64/01/570246401.db2.gz LUEHKFOUAQQRSP-SFHVURJKSA-N 1 1 398.304 4.103 50 0 GIAAMO Cc1ccc2nc(C[N@H+]3CCC[C@H]3c3cccc(Br)c3)cc(=O)n2c1 ZINC000048366418 570246402 /nfs/dbraw/zinc/24/64/02/570246402.db2.gz LUEHKFOUAQQRSP-SFHVURJKSA-N 1 1 398.304 4.103 50 0 GIAAMO COc1cccc([C@H]2CC[N@@H+](Cc3c[nH]nc3-c3ccc(F)cc3)C2)c1OC ZINC000097773194 570254884 /nfs/dbraw/zinc/25/48/84/570254884.db2.gz IBJXDXHUKPNFTG-INIZCTEOSA-N 1 1 381.451 4.223 50 0 GIAAMO COc1ccc(NC(=O)NCC[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cc1Cl ZINC000097784856 570256027 /nfs/dbraw/zinc/25/60/27/570256027.db2.gz MYGZMSDWJADKAH-QGZVFWFLSA-N 1 1 387.911 4.382 50 0 GIAAMO COc1cc(C[N@H+]2CCC[C@](CO)(Cc3ccccc3C)C2)cc(Cl)c1O ZINC000020451216 570257504 /nfs/dbraw/zinc/25/75/04/570257504.db2.gz GAQVFHXYQSKCJC-QFIPXVFZSA-N 1 1 389.923 4.180 50 0 GIAAMO c1ccc(OCc2noc(C[N@@H+]3CCC[C@H](c4nc5ccccc5o4)C3)n2)cc1 ZINC000020453993 570258257 /nfs/dbraw/zinc/25/82/57/570258257.db2.gz DZOQVORIPZFRCX-INIZCTEOSA-N 1 1 390.443 4.169 50 0 GIAAMO c1ccc(OCc2noc(C[N@H+]3CCC[C@H](c4nc5ccccc5o4)C3)n2)cc1 ZINC000020453993 570258259 /nfs/dbraw/zinc/25/82/59/570258259.db2.gz DZOQVORIPZFRCX-INIZCTEOSA-N 1 1 390.443 4.169 50 0 GIAAMO Brc1cccc(OCCC[NH+]2CCN(Cc3ccccc3)CC2)c1 ZINC000020500074 570264385 /nfs/dbraw/zinc/26/43/85/570264385.db2.gz OJMMIKBSWDFJSK-UHFFFAOYSA-N 1 1 389.337 4.036 50 0 GIAAMO Cc1ccc(C[N@@H+]2CCC[C@@H](c3nnc(SCc4ccccc4)n3C)C2)o1 ZINC000020542216 570267318 /nfs/dbraw/zinc/26/73/18/570267318.db2.gz NWDCSMDOJGYFDY-GOSISDBHSA-N 1 1 382.533 4.388 50 0 GIAAMO C[C@@H]1C[C@H](C)C[N@H+](CCCNc2ncnc3onc(-c4ccc(F)cc4)c32)C1 ZINC000020574445 570268820 /nfs/dbraw/zinc/26/88/20/570268820.db2.gz PGUMRZKLUVQKCP-GASCZTMLSA-N 1 1 383.471 4.204 50 0 GIAAMO CCOc1ccc(NC(=O)C[NH2+][C@H](C)c2ccccc2Br)cc1 ZINC000012864692 570269049 /nfs/dbraw/zinc/26/90/49/570269049.db2.gz WTYZCPXHZNLDEO-CYBMUJFWSA-N 1 1 377.282 4.137 50 0 GIAAMO CCNC(=O)c1ccc([C@H]2CCC[N@H+]2Cc2ccc(-n3ccnc3)cc2)s1 ZINC000020601096 570270123 /nfs/dbraw/zinc/27/01/23/570270123.db2.gz XZMSBZJXWAYRRT-GOSISDBHSA-N 1 1 380.517 4.021 50 0 GIAAMO COc1ccc(C[N@H+](Cc2cc(=O)c3cc(F)ccc3[nH]2)CC(C)C)cc1OC ZINC000015862341 570278871 /nfs/dbraw/zinc/27/88/71/570278871.db2.gz GPBGBHYSRSXREW-UHFFFAOYSA-N 1 1 398.478 4.343 50 0 GIAAMO COc1ccc(N[C@H]2CCC[N@@H+](Cc3cc(OC)c(O)cc3Cl)C2)cc1 ZINC000020855434 570282252 /nfs/dbraw/zinc/28/22/52/570282252.db2.gz SDYZWYMNLQJXRY-INIZCTEOSA-N 1 1 376.884 4.139 50 0 GIAAMO C[C@H]([NH2+]Cc1c(C(=O)N2CCCC2)nc2ccccn21)c1ccccc1Cl ZINC000020920738 570284885 /nfs/dbraw/zinc/28/48/85/570284885.db2.gz STHPCDLVNZKMPP-HNNXBMFYSA-N 1 1 382.895 4.075 50 0 GIAAMO O=C(c1n[nH]c2ccccc21)N1CC[NH+](C(c2ccccc2)c2ccccc2)CC1 ZINC000021004437 570287350 /nfs/dbraw/zinc/28/73/50/570287350.db2.gz DODQURWKJHRDIS-UHFFFAOYSA-N 1 1 396.494 4.110 50 0 GIAAMO Cc1cc(OC[C@H](O)C[NH2+]CCN(C(C)C)C(C)C)c(C(C)C)cc1Cl ZINC000022029585 570302704 /nfs/dbraw/zinc/30/27/04/570302704.db2.gz PVNHDIUSSNGKJM-GOSISDBHSA-N 1 1 384.992 4.220 50 0 GIAAMO C[C@@H]1C[C@H](C)C[N@@H+](Cc2csc(NC(=O)c3ccc(Br)o3)n2)C1 ZINC000022293944 570312708 /nfs/dbraw/zinc/31/27/08/570312708.db2.gz PTRKPFOZBJQFFK-PHIMTYICSA-N 1 1 398.326 4.229 50 0 GIAAMO C[C@@H]1C[C@H](C)C[N@H+](Cc2csc(NC(=O)c3ccc(Br)o3)n2)C1 ZINC000022293944 570312710 /nfs/dbraw/zinc/31/27/10/570312710.db2.gz PTRKPFOZBJQFFK-PHIMTYICSA-N 1 1 398.326 4.229 50 0 GIAAMO O=C1C[C@H]([NH2+]Cc2ccc(Cl)c(Cl)c2)C(=O)N1c1ccc(Cl)cc1 ZINC000002941137 570319067 /nfs/dbraw/zinc/31/90/67/570319067.db2.gz GQPAOKMCZOXHDT-HNNXBMFYSA-N 1 1 383.662 4.069 50 0 GIAAMO COCCNC(=O)[C@H]1CC[C@@H](c2ccccc2)[N@@H+](Cc2cccc(Cl)c2)C1 ZINC000034739881 570327406 /nfs/dbraw/zinc/32/74/06/570327406.db2.gz DTICTTJHWJCJNO-FPOVZHCZSA-N 1 1 386.923 4.056 50 0 GIAAMO Cc1oc(-c2ccccc2)nc1C(=O)NC[C@@H](c1ccco1)[NH+]1CCCCC1 ZINC000022917033 570335211 /nfs/dbraw/zinc/33/52/11/570335211.db2.gz RPAQNJHCNHIHAG-SFHVURJKSA-N 1 1 379.460 4.200 50 0 GIAAMO Cc1ccc(NC(=O)CN2CC[NH+](Cc3csc4ccccc34)CC2)c(F)c1 ZINC000022915899 570335306 /nfs/dbraw/zinc/33/53/06/570335306.db2.gz VBIIOYCLGJVVLE-UHFFFAOYSA-N 1 1 397.519 4.105 50 0 GIAAMO CNC(=O)c1ccc([C@@H]2CCC[N@@H+]2CC2=Cc3cc(Cl)ccc3OC2)s1 ZINC000023340009 570355319 /nfs/dbraw/zinc/35/53/19/570355319.db2.gz YIZMRZKWKPLJAH-INIZCTEOSA-N 1 1 388.920 4.374 50 0 GIAAMO CNC(=O)c1ccc([C@@H]2CCC[N@H+]2CC2=Cc3cc(Cl)ccc3OC2)s1 ZINC000023340009 570355320 /nfs/dbraw/zinc/35/53/20/570355320.db2.gz YIZMRZKWKPLJAH-INIZCTEOSA-N 1 1 388.920 4.374 50 0 GIAAMO CCC(C)(C)c1nc(-c2c(C)ncc3c2CC[N@H+](Cc2ccncc2)C3)no1 ZINC000023506126 570364135 /nfs/dbraw/zinc/36/41/35/570364135.db2.gz BIOYCUQETBPLCE-UHFFFAOYSA-N 1 1 377.492 4.081 50 0 GIAAMO CCC(C)(C)c1nc(-c2c(C)ncc3c2CC[N@@H+](Cc2ccncc2)C3)no1 ZINC000023506126 570364140 /nfs/dbraw/zinc/36/41/40/570364140.db2.gz BIOYCUQETBPLCE-UHFFFAOYSA-N 1 1 377.492 4.081 50 0 GIAAMO Cc1csc2nc(C[NH2+][C@H](c3cccs3)c3ccc(F)cc3)cc(=O)n12 ZINC000023805732 570372616 /nfs/dbraw/zinc/37/26/16/570372616.db2.gz PTDHVDHNKFGISK-SFHVURJKSA-N 1 1 385.489 4.144 50 0 GIAAMO Cc1cccc2nc(C[N@@H+]3CCc4sccc4[C@@H]3c3cccs3)cc(=O)n12 ZINC000023864524 570374158 /nfs/dbraw/zinc/37/41/58/570374158.db2.gz LRXVDWBBPILUEP-OAQYLSRUSA-N 1 1 393.537 4.274 50 0 GIAAMO Cc1cccc2nc(C[N@H+]3CCc4sccc4[C@@H]3c3cccs3)cc(=O)n12 ZINC000023864524 570374163 /nfs/dbraw/zinc/37/41/63/570374163.db2.gz LRXVDWBBPILUEP-OAQYLSRUSA-N 1 1 393.537 4.274 50 0 GIAAMO O[C@H](c1cc2n(n1)CCC[N@H+](Cc1ccccc1OC1CCCC1)C2)C1CC1 ZINC000221414580 570394832 /nfs/dbraw/zinc/39/48/32/570394832.db2.gz KMALPPBDKSHDPH-QHCPKHFHSA-N 1 1 381.520 4.054 50 0 GIAAMO O[C@H](c1cc2n(n1)CCC[N@@H+](Cc1ccccc1OC1CCCC1)C2)C1CC1 ZINC000221414580 570394833 /nfs/dbraw/zinc/39/48/33/570394833.db2.gz KMALPPBDKSHDPH-QHCPKHFHSA-N 1 1 381.520 4.054 50 0 GIAAMO CC(=O)c1ccc(C(=O)NC[C@@H](c2cccs2)[NH+]2CCC(C)CC2)s1 ZINC000024928463 570398721 /nfs/dbraw/zinc/39/87/21/570398721.db2.gz HJDAZSQDUGVNQF-HNNXBMFYSA-N 1 1 376.547 4.215 50 0 GIAAMO CC(C)Cn1ccc2cc(NC(=O)N3C[C@@H]4C[N@H+]5CCCC[C@H]5[C@@H]4C3)ccc21 ZINC000242338966 570432378 /nfs/dbraw/zinc/43/23/78/570432378.db2.gz ZDVRLEZRGXLOBD-DWLFOUALSA-N 1 1 380.536 4.245 50 0 GIAAMO Cc1ccccc1[C@H](C)NC(=O)C[N@@H+]1CCC[C@H]1c1ccc2c(c1)OCCCO2 ZINC000248153938 570444654 /nfs/dbraw/zinc/44/46/54/570444654.db2.gz KWOYVXFZQXERPH-RXVVDRJESA-N 1 1 394.515 4.171 50 0 GIAAMO Cc1ccccc1[C@H](C)NC(=O)C[N@H+]1CCC[C@H]1c1ccc2c(c1)OCCCO2 ZINC000248153938 570444657 /nfs/dbraw/zinc/44/46/57/570444657.db2.gz KWOYVXFZQXERPH-RXVVDRJESA-N 1 1 394.515 4.171 50 0 GIAAMO COc1cccc(C2=NN(C(=O)C[NH+]3CCCCC3)[C@H](c3ccc(C)cc3)C2)c1 ZINC000035783336 570448303 /nfs/dbraw/zinc/44/83/03/570448303.db2.gz BMJZAZIEAWWHHL-QHCPKHFHSA-N 1 1 391.515 4.167 50 0 GIAAMO CN(C)c1ccc([C@@H]2C[C@](C)([NH+]3CCCC3)Oc3cc4c(cc32)OCO4)cc1 ZINC000028617229 570462188 /nfs/dbraw/zinc/46/21/88/570462188.db2.gz MMXOGJYYUBSYLU-WMZHIEFXSA-N 1 1 380.488 4.208 50 0 GIAAMO C[C@@H](C(=O)Nc1cccc2ncccc21)[N@@H+](C)CCCOc1ccc(F)cc1 ZINC000030269055 570487879 /nfs/dbraw/zinc/48/78/79/570487879.db2.gz XHBDRCUEBHOMGZ-INIZCTEOSA-N 1 1 381.451 4.102 50 0 GIAAMO O=C(Nc1ccc(Cl)cc1)C1CC[NH+](Cc2nc(-c3ccccc3)no2)CC1 ZINC000030955126 570502368 /nfs/dbraw/zinc/50/23/68/570502368.db2.gz AZBNWSSXTKIEBM-UHFFFAOYSA-N 1 1 396.878 4.241 50 0 GIAAMO Cc1cc2c(cc1C)[C@H]([N@H+](CC(=O)N(C)c1nccs1)C1CC1)CCCO2 ZINC000072309437 570531999 /nfs/dbraw/zinc/53/19/99/570531999.db2.gz WJSVEKWLWGCAGN-GOSISDBHSA-N 1 1 385.533 4.101 50 0 GIAAMO Cc1cc2c(cc1C)[C@H]([N@@H+](CC(=O)N(C)c1nccs1)C1CC1)CCCO2 ZINC000072309437 570532000 /nfs/dbraw/zinc/53/20/00/570532000.db2.gz WJSVEKWLWGCAGN-GOSISDBHSA-N 1 1 385.533 4.101 50 0 GIAAMO COc1ccc(-c2csc3[nH]c(C[N@@H+](C)C4CCCCC4)nc(=O)c23)cc1 ZINC000036204008 570568509 /nfs/dbraw/zinc/56/85/09/570568509.db2.gz QCGWXELMHXXUEW-UHFFFAOYSA-N 1 1 383.517 4.425 50 0 GIAAMO COc1cc(O)ccc1C[N@H+]1CCC[C@@H](c2n[nH]cc2-c2c(F)cccc2F)C1 ZINC000012151451 570618055 /nfs/dbraw/zinc/61/80/55/570618055.db2.gz IQFXGYQHQOHLJO-OAHLLOKOSA-N 1 1 399.441 4.449 50 0 GIAAMO CN(C[C@@H]1CCC[N@@H+](CCc2cccc(C(F)(F)F)c2)C1)C(=O)c1ccco1 ZINC000012387022 570651885 /nfs/dbraw/zinc/65/18/85/570651885.db2.gz FBSBWAWIISMTQX-KRWDZBQOSA-N 1 1 394.437 4.325 50 0 GIAAMO O=C(c1cnc2ccccc2c1)N1CC[C@@]2(C1)CCC[N@@H+](CCc1ccccc1)C2 ZINC000012443732 570677883 /nfs/dbraw/zinc/67/78/83/570677883.db2.gz DQLZVCNJRLJDAO-SANMLTNESA-N 1 1 399.538 4.406 50 0 GIAAMO CC1CCN(C(=O)c2cc(C[NH+]3CCC(Cc4ccccc4)CC3)on2)CC1 ZINC000012576848 570683016 /nfs/dbraw/zinc/68/30/16/570683016.db2.gz CFFMBNNNXLYMJV-UHFFFAOYSA-N 1 1 381.520 4.001 50 0 GIAAMO Cc1ccsc1C(=O)[C@H]1CCC[N@H+](Cc2ccc(OC(C)C)c(CO)c2)C1 ZINC000012714385 570703925 /nfs/dbraw/zinc/70/39/25/570703925.db2.gz RMSNXSKKEIUGKB-SFHVURJKSA-N 1 1 387.545 4.431 50 0 GIAAMO Cc1cccc(C[N@H+]2CCC[C@@]3(CCN(C(=O)c4ccnc(Cl)c4)C3)C2)c1 ZINC000012715086 570704159 /nfs/dbraw/zinc/70/41/59/570704159.db2.gz RQGJNIZLXRHCNC-JOCHJYFZSA-N 1 1 383.923 4.172 50 0 GIAAMO Oc1cccc(CC[C@H]2CCCC[N@H+]2Cc2nc(Cc3ccccc3)no2)c1 ZINC000012716811 570704866 /nfs/dbraw/zinc/70/48/66/570704866.db2.gz SWJHJZAWDXNYBY-HXUWFJFHSA-N 1 1 377.488 4.353 50 0 GIAAMO Cc1cc(Cl)ccc1C(=O)[C@H]1CCC[N@@H+](Cc2cccc(OCCO)c2)C1 ZINC000012744137 570707621 /nfs/dbraw/zinc/70/76/21/570707621.db2.gz BBNPKIHIVHVPHG-SFHVURJKSA-N 1 1 387.907 4.114 50 0 GIAAMO O[C@H](Cc1ccccc1)C1CC[NH+](Cc2nc(-c3ccc(Cl)cc3)no2)CC1 ZINC000012835783 570723402 /nfs/dbraw/zinc/72/34/02/570723402.db2.gz KSBTVASEMCEOTO-HXUWFJFHSA-N 1 1 397.906 4.206 50 0 GIAAMO COc1ccc([C@@H]2CCCCC[N@H+]2CC(=O)Nc2ccc(NC(C)=O)cc2)cc1 ZINC000012998643 570740169 /nfs/dbraw/zinc/74/01/69/570740169.db2.gz ALHPHZBGMBUFFW-QFIPXVFZSA-N 1 1 395.503 4.209 50 0 GIAAMO COc1ccc(C[N@H+](C)[C@@H](C)C(=O)Nc2cccc(Cl)c2Cl)cc1OC ZINC000013096122 570746122 /nfs/dbraw/zinc/74/61/22/570746122.db2.gz FBUXOUMCAKBHGX-LBPRGKRZSA-N 1 1 397.302 4.470 50 0 GIAAMO COc1ccc(C[N@@H+](C)[C@@H](C)C(=O)Nc2cccc(Cl)c2Cl)cc1OC ZINC000013096122 570746124 /nfs/dbraw/zinc/74/61/24/570746124.db2.gz FBUXOUMCAKBHGX-LBPRGKRZSA-N 1 1 397.302 4.470 50 0 GIAAMO Cc1cccc(C[N@@H+]2CCCN(c3ncccc3-c3nc(C(C)C)no3)CC2)c1 ZINC000065257911 570758962 /nfs/dbraw/zinc/75/89/62/570758962.db2.gz ABWKECODEUBUPU-UHFFFAOYSA-N 1 1 391.519 4.276 50 0 GIAAMO CCOc1ccc(C[N@H+](Cc2cc(=O)n3cc(C)sc3n2)CC(C)C)cc1 ZINC000033069020 570775173 /nfs/dbraw/zinc/77/51/73/570775173.db2.gz PDPAVJADVIRSKO-UHFFFAOYSA-N 1 1 385.533 4.121 50 0 GIAAMO CCN(CC)CC[NH2+]Cc1c(NC(=O)c2ccccc2)sc2c1CCCC2 ZINC000022022887 570777795 /nfs/dbraw/zinc/77/77/95/570777795.db2.gz ZMFXYHSVMMQBED-UHFFFAOYSA-N 1 1 385.577 4.311 50 0 GIAAMO CCN(C(=O)C[N@@H+]1CCC[C@H]1c1ccc2c(c1)OCCCO2)c1ccccc1C ZINC000011287789 570794287 /nfs/dbraw/zinc/79/42/87/570794287.db2.gz ZAOVKVJAARTDLO-NRFANRHFSA-N 1 1 394.515 4.346 50 0 GIAAMO CCN(C(=O)C[N@H+]1CCC[C@H]1c1ccc2c(c1)OCCCO2)c1ccccc1C ZINC000011287789 570794291 /nfs/dbraw/zinc/79/42/91/570794291.db2.gz ZAOVKVJAARTDLO-NRFANRHFSA-N 1 1 394.515 4.346 50 0 GIAAMO O=C(C[NH+]1CCC(c2nc3ccccc3o2)CC1)N1CCC[C@@H]1c1cccs1 ZINC000014197840 570829067 /nfs/dbraw/zinc/82/90/67/570829067.db2.gz QACWSWISTNGOPW-GOSISDBHSA-N 1 1 395.528 4.432 50 0 GIAAMO C[C@H]1C[NH+](Cc2ccc(C(=O)Nc3ccc4ccccc4n3)cc2)C[C@H](C)O1 ZINC000032824661 570838829 /nfs/dbraw/zinc/83/88/29/570838829.db2.gz HVGKRNDSFDDAPP-IRXDYDNUSA-N 1 1 375.472 4.096 50 0 GIAAMO CC1CC[NH+](CC(=O)N2N=C(c3cc4ccccc4o3)C[C@@H]2c2ccco2)CC1 ZINC000007446933 570844356 /nfs/dbraw/zinc/84/43/56/570844356.db2.gz DIVWGKNGYLQQML-LJQANCHMSA-N 1 1 391.471 4.435 50 0 GIAAMO CC(C)CNC(=O)[C@@H]1C[C@H](COc2cccc(F)c2)C[N@@H+](Cc2ccccc2)C1 ZINC000014748983 570859003 /nfs/dbraw/zinc/85/90/03/570859003.db2.gz WDVUSMWLNGJBLR-LEWJYISDSA-N 1 1 398.522 4.115 50 0 GIAAMO O=C(c1ccsc1)N1CC[C@@]2(C1)CCC[N@H+](Cc1ccc(F)c(F)c1)C2 ZINC000014947773 570865108 /nfs/dbraw/zinc/86/51/08/570865108.db2.gz ATWLXBSCVBQDGS-FQEVSTJZSA-N 1 1 376.472 4.155 50 0 GIAAMO Cc1ccccc1CC[N@@H+]1CCC[C@@H](CN(C)C(=O)NCc2ccccc2)C1 ZINC000014974161 570867974 /nfs/dbraw/zinc/86/79/74/570867974.db2.gz BTPAKMJBYHTFNE-QFIPXVFZSA-N 1 1 379.548 4.091 50 0 GIAAMO CC(=O)c1cccc(NC(=O)N2CCC[C@@H]([N@@H+](C)CCc3ccccc3)C2)c1 ZINC000014981693 570869823 /nfs/dbraw/zinc/86/98/23/570869823.db2.gz TZBPNWFGNGCHRX-JOCHJYFZSA-N 1 1 379.504 4.060 50 0 GIAAMO O=C1CC[C@@H]2C[N@H+](Cc3c(F)cccc3F)CC[C@@H]2N1CC1CCCCC1 ZINC000014981087 570869856 /nfs/dbraw/zinc/86/98/56/570869856.db2.gz TWDVXHQILUITLP-UTKZUKDTSA-N 1 1 376.491 4.358 50 0 GIAAMO O=C1CC[C@@H]2C[N@@H+](Cc3c(F)cccc3F)CC[C@@H]2N1CC1CCCCC1 ZINC000014981087 570869858 /nfs/dbraw/zinc/86/98/58/570869858.db2.gz TWDVXHQILUITLP-UTKZUKDTSA-N 1 1 376.491 4.358 50 0 GIAAMO Cc1ccc(C[N@H+]2CCC[C@H](CNC(=O)C3(c4ccc(Cl)cc4)CC3)C2)o1 ZINC000015062711 570874725 /nfs/dbraw/zinc/87/47/25/570874725.db2.gz JQYVQDCNJFGILS-QGZVFWFLSA-N 1 1 386.923 4.301 50 0 GIAAMO CCN(C[C@@H]1CCC[N@@H+](CCc2cccc(OC)c2)C1)C(=O)c1cccs1 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387.593 4.069 50 0 GIAAMO COc1cccc(CN2C[C@@H]3C[C@@H](c4ccccc4Cl)[N@H+]4CCC[C@@]34C2=O)c1 ZINC000012313965 204396485 /nfs/dbraw/zinc/39/64/85/204396485.db2.gz XDBURIAPZRAKRX-HYVJGQCMSA-N 1 1 396.918 4.287 50 0 GIAAMO Cc1cc(NC(=O)C[NH2+][C@H](C)c2ccccc2Cl)n(-c2ccccc2C)n1 ZINC000012800418 204451243 /nfs/dbraw/zinc/45/12/43/204451243.db2.gz DZSAFAFCOCVFFG-MRXNPFEDSA-N 1 1 382.895 4.432 50 0 GIAAMO CCN(C(=O)Cn1c(C[NH+]2CCCCCC2)nc2ccccc21)c1ccccc1 ZINC000015831912 204579371 /nfs/dbraw/zinc/57/93/71/204579371.db2.gz MSGNHYYQIMAUPG-UHFFFAOYSA-N 1 1 390.531 4.465 50 0 GIAAMO CCOc1ccc(C[NH+]2CCN(Cc3ccccc3Br)CC2)cc1 ZINC000019359430 204639436 /nfs/dbraw/zinc/63/94/36/204639436.db2.gz XZUJTNIFKDHVSQ-UHFFFAOYSA-N 1 1 389.337 4.166 50 0 GIAAMO C[C@H]1CCC[N@@H+](CCCNc2ncnc3onc(-c4cccc(Cl)c4)c32)C1 ZINC000021714515 204762755 /nfs/dbraw/zinc/76/27/55/204762755.db2.gz RSHLULLSVAOZIS-AWEZNQCLSA-N 1 1 385.899 4.472 50 0 GIAAMO COc1ccccc1C[N@H+](Cc1ccccc1)C[C@@H](O)COc1ccccc1 ZINC000036031206 205002203 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COc1ccccc1C[N@H+](Cc1ccc(F)cc1)C[C@@H](O)COCc1ccco1 ZINC000036102930 205006478 /nfs/dbraw/zinc/00/64/78/205006478.db2.gz MXVWKJCBAAGITD-OAQYLSRUSA-N 1 1 399.462 4.007 50 0 GIAAMO COc1cccc([C@H]2CC(c3ccc(C)cc3C)=NN2C(=O)C[N@@H+](C)C(C)C)c1 ZINC000036345676 205012557 /nfs/dbraw/zinc/01/25/57/205012557.db2.gz BUORRSSTIMYSLA-HSZRJFAPSA-N 1 1 393.531 4.330 50 0 GIAAMO COc1cc(CN2CC[C@]3(C2)CCC[N@@H+](CC2CCC2)C3)c(Cl)cc1O ZINC000039379541 205040059 /nfs/dbraw/zinc/04/00/59/205040059.db2.gz ZTBZMJCFDUAIRI-OAQYLSRUSA-N 1 1 378.944 4.142 50 0 GIAAMO CC(C)[N@@H+](C)Cc1ccccc1CNC(=O)c1ccc(F)cc1Br ZINC000036393047 205016790 /nfs/dbraw/zinc/01/67/90/205016790.db2.gz HHSJNAKQIJUPHT-UHFFFAOYSA-N 1 1 393.300 4.358 50 0 GIAAMO FC(F)(F)c1cnc(NCc2ccc(C[NH+]3CCOCC3)cc2)c(Cl)c1 ZINC000039982743 205044159 /nfs/dbraw/zinc/04/41/59/205044159.db2.gz QEJVAWZKOKYZPP-UHFFFAOYSA-N 1 1 385.817 4.198 50 0 GIAAMO C[C@H](NC(=O)N1CC[NH+](CCSc2ccccc2)CC1)c1ccc(F)cc1 ZINC000040135603 205056944 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CC[N@H+]1CCC[C@](C(=O)NCc2ccc(SC)cc2)(c2ccccc2)CC1 ZINC000065226079 205219142 /nfs/dbraw/zinc/21/91/42/205219142.db2.gz XHNIOIJNONWTCF-HSZRJFAPSA-N 1 1 382.573 4.469 50 0 GIAAMO CC(=O)c1ccc(NC(=O)c2cc3c(n2C)CC[N@@H+](Cc2ccccc2)C3)cc1 ZINC000065210823 205220126 /nfs/dbraw/zinc/22/01/26/205220126.db2.gz DOFWGOLUCINDOY-UHFFFAOYSA-N 1 1 387.483 4.038 50 0 GIAAMO CC(=O)c1ccc(NC(=O)c2cc3c(n2C)CC[N@H+](Cc2ccccc2)C3)cc1 ZINC000065210823 205220129 /nfs/dbraw/zinc/22/01/29/205220129.db2.gz DOFWGOLUCINDOY-UHFFFAOYSA-N 1 1 387.483 4.038 50 0 GIAAMO CC[C@H]1CCCC[N@H+]1CCNC(=O)c1cc2c(s1)CN(C1CCCC1)C2 ZINC000065239010 205221015 /nfs/dbraw/zinc/22/10/15/205221015.db2.gz CLMMVRRSGIRGGP-KRWDZBQOSA-N 1 1 375.582 4.001 50 0 GIAAMO Cc1nc[nH]c1-c1c(-c2ccccc2)ncn1C1CC[NH+](C2CCOCC2)CC1 ZINC000067562294 205249544 /nfs/dbraw/zinc/24/95/44/205249544.db2.gz JCUACJYGWOYSFT-UHFFFAOYSA-N 1 1 391.519 4.065 50 0 GIAAMO COc1cccc(-c2cc3c(c(OC)c2)OCC[N@H+](Cc2ccc(C)cc2)C3)n1 ZINC000067642055 205252743 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GIAAMO COCc1ncc(C[N@H+]2CCC[C@@H](CCc3cccc(C(F)(F)F)c3)C2)cn1 ZINC000071759202 205293740 /nfs/dbraw/zinc/29/37/40/205293740.db2.gz HBGVYJZKBLXLQJ-KRWDZBQOSA-N 1 1 393.453 4.487 50 0 GIAAMO CC[C@H]1CN(Cc2nc(-c3cc(OC)ccc3F)oc2C)CC[N@H+]1C(C)C ZINC000071764845 205294823 /nfs/dbraw/zinc/29/48/23/205294823.db2.gz UQYGJDDESDRUCW-INIZCTEOSA-N 1 1 375.488 4.102 50 0 GIAAMO COc1c(C)cc(-c2ccc(C(=O)NC[C@@H]3CC[N@@H+](CC(C)C)C3)cn2)cc1C ZINC000071774839 205297547 /nfs/dbraw/zinc/29/75/47/205297547.db2.gz YVABLPQJBHIYQG-IBGZPJMESA-N 1 1 395.547 4.082 50 0 GIAAMO COc1ccc(-c2nnc(C[N@@H+](CCCO)[C@H]3CCCc4ccccc43)o2)cc1 ZINC000072308766 205323483 /nfs/dbraw/zinc/32/34/83/205323483.db2.gz AQIZBZKHEKKKKF-NRFANRHFSA-N 1 1 393.487 4.007 50 0 GIAAMO CC(C)c1nccc(C[NH+]2CCC(O)(c3cccc(C(F)(F)F)c3)CC2)n1 ZINC000072164820 205315316 /nfs/dbraw/zinc/31/53/16/205315316.db2.gz MMTUKFORRROJJQ-UHFFFAOYSA-N 1 1 379.426 4.102 50 0 GIAAMO Cc1ccc(-n2cc(C[N@H+](C)CC3(CO)CC3)c(-c3cccc(C)c3)n2)cc1 ZINC000072436247 205350497 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O=C(COc1ccc(F)cc1)NC[C@@H](c1ccccc1Cl)[NH+]1CCCCC1 ZINC000027664507 570439683 /nfs/dbraw/zinc/43/96/83/570439683.db2.gz WMJNQBDLMFQVEE-FQEVSTJZSA-N 1 1 390.886 4.201 50 0 GIAAMO Cc1ccc2c(C[NH+]3CCN(c4cccc(Cl)c4)CC3)cc(=O)oc2c1C ZINC000054105997 570440939 /nfs/dbraw/zinc/44/09/39/570440939.db2.gz RPXMDALGTZQTKE-UHFFFAOYSA-N 1 1 382.891 4.385 50 0 GIAAMO O=c1cc(C[NH+]2CCN(c3ccccc3F)CC2)c2cc3c(cc2o1)CCCC3 ZINC000054105966 570441019 /nfs/dbraw/zinc/44/10/19/570441019.db2.gz NHJMKULKNFLREN-UHFFFAOYSA-N 1 1 392.474 4.133 50 0 aggregator GIAAMO CC[C@@H](NC(=O)C[N@@H+]1CCC[C@H]1c1ccc2c(c1)OCCO2)c1ccc(C)cc1 ZINC000248152089 570444636 /nfs/dbraw/zinc/44/46/36/570444636.db2.gz KFGFQGSULJITOG-RTWAWAEBSA-N 1 1 394.515 4.171 50 0 GIAAMO CC[C@@H](NC(=O)C[N@H+]1CCC[C@H]1c1ccc2c(c1)OCCO2)c1ccc(C)cc1 ZINC000248152089 570444641 /nfs/dbraw/zinc/44/46/41/570444641.db2.gz KFGFQGSULJITOG-RTWAWAEBSA-N 1 1 394.515 4.171 50 0 GIAAMO CN(C)c1ccc([C@H]2C[C@@](C)([NH+]3CCCC3)Oc3cc4c(cc32)OCO4)cc1 ZINC000028617227 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389.499 4.098 50 0 GIAAMO O=C(C[NH+]1CCCCC1)N1N=C2c3ccccc3CC[C@@H]2[C@H]1c1cccs1 ZINC000006829785 570496133 /nfs/dbraw/zinc/49/61/33/570496133.db2.gz QGFZWIJGDSWWST-AVRDEDQJSA-N 1 1 379.529 4.084 50 0 GIAAMO CCOc1ccc([C@@]2(O)[C@H](C)[N@H+]3CCCC=C3N2c2ccc(OC)cc2)cc1 ZINC000005336519 570556268 /nfs/dbraw/zinc/55/62/68/570556268.db2.gz WIAKONAZEZMVLZ-SBUREZEXSA-N 1 1 380.488 4.085 50 0 GIAAMO O=C(NC[C@H](c1cccs1)[N@@H+]1CCc2ccccc2C1)c1cccc(F)c1 ZINC000022907750 570564002 /nfs/dbraw/zinc/56/40/02/570564002.db2.gz OZPFXVAYVSBTTD-HXUWFJFHSA-N 1 1 380.488 4.417 50 0 GIAAMO O=C(NC[C@H](c1cccs1)[N@H+]1CCc2ccccc2C1)c1cccc(F)c1 ZINC000022907750 570564003 /nfs/dbraw/zinc/56/40/03/570564003.db2.gz OZPFXVAYVSBTTD-HXUWFJFHSA-N 1 1 380.488 4.417 50 0 GIAAMO O=C(COc1ccccc1)NC[C@H](c1cccs1)[N@@H+]1CCc2ccccc2C1 ZINC000022907720 570564130 /nfs/dbraw/zinc/56/41/30/570564130.db2.gz SERBJDHHKYIDIF-OAQYLSRUSA-N 1 1 392.524 4.043 50 0 GIAAMO O=C(COc1ccccc1)NC[C@H](c1cccs1)[N@H+]1CCc2ccccc2C1 ZINC000022907720 570564133 /nfs/dbraw/zinc/56/41/33/570564133.db2.gz SERBJDHHKYIDIF-OAQYLSRUSA-N 1 1 392.524 4.043 50 0 GIAAMO Cc1ccc2c(CN3CC[NH+](C/C=C/c4ccccc4)CC3)cc(=O)oc2c1C ZINC000019371169 570596632 /nfs/dbraw/zinc/59/66/32/570596632.db2.gz IKTNUUFNNFYTJG-RMKNXTFCSA-N 1 1 388.511 4.241 50 0 GIAAMO Cc1ccc(C(=O)N(C)C[C@@H]2CCC[N@@H+](CCc3ccccc3F)C2)c(C)c1 ZINC000012058489 570603548 /nfs/dbraw/zinc/60/35/48/570603548.db2.gz OVWSBPHPKMRBFH-FQEVSTJZSA-N 1 1 382.523 4.469 50 0 GIAAMO Cc1cccc(C[N@H+]2CCC[C@]3(CCN(C(=O)CCOc4ccccc4)C3)C2)c1 ZINC000012091381 570607666 /nfs/dbraw/zinc/60/76/66/570607666.db2.gz HWUWISSUXVFSGT-VWLOTQADSA-N 1 1 392.543 4.279 50 0 GIAAMO COc1cccc(C(=O)[C@H]2CCC[N@H+](Cc3cnn(-c4ccc(F)cc4)c3)C2)c1 ZINC000012091285 570607814 /nfs/dbraw/zinc/60/78/14/570607814.db2.gz ISJDZMHOIZPSCU-IBGZPJMESA-N 1 1 393.462 4.115 50 0 GIAAMO COc1cccc(C(=O)[C@H]2CCC[N@@H+](Cc3cnn(-c4ccc(F)cc4)c3)C2)c1 ZINC000012091285 570607820 /nfs/dbraw/zinc/60/78/20/570607820.db2.gz ISJDZMHOIZPSCU-IBGZPJMESA-N 1 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O=C(Nc1ccc(-c2cscn2)cc1)[C@H]1CCC[N@H+]1Cc1cccc(O)c1 ZINC000015071831 570877323 /nfs/dbraw/zinc/87/73/23/570877323.db2.gz LXBOVMWTNJYOID-HXUWFJFHSA-N 1 1 379.485 4.119 50 0 GIAAMO O=C(Nc1ccc(-c2cscn2)cc1)[C@H]1CCC[N@@H+]1Cc1cccc(O)c1 ZINC000015071831 570877328 /nfs/dbraw/zinc/87/73/28/570877328.db2.gz LXBOVMWTNJYOID-HXUWFJFHSA-N 1 1 379.485 4.119 50 0 GIAAMO C[C@@H](CNC(=O)C1CCCCC1)Oc1cccc(C[N@@H+](C)Cc2ccoc2)c1 ZINC000015072198 570877894 /nfs/dbraw/zinc/87/78/94/570877894.db2.gz AUGPJLGKBFLNHP-SFHVURJKSA-N 1 1 384.520 4.375 50 0 GIAAMO CCCn1cc(CN(C)C[C@H]2CCC[N@@H+](CCc3ccccc3F)C2)c(C)n1 ZINC000015074396 570878374 /nfs/dbraw/zinc/87/83/74/570878374.db2.gz BZXVWNFOSISHOX-HXUWFJFHSA-N 1 1 386.559 4.127 50 0 GIAAMO CCCn1cc(C[N@H+](C)C[C@H]2CCCN(CCc3ccccc3F)C2)c(C)n1 ZINC000015074396 570878375 /nfs/dbraw/zinc/87/83/75/570878375.db2.gz BZXVWNFOSISHOX-HXUWFJFHSA-N 1 1 386.559 4.127 50 0 GIAAMO CCCn1cc(C[N@@H+](C)C[C@H]2CCCN(CCc3ccccc3F)C2)c(C)n1 ZINC000015074396 570878377 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O=C(Nc1ccc(CC[NH+]2CCOCC2)cc1)N[C@H]1CCc2cc(Cl)ccc21 ZINC000056726923 205152445 /nfs/dbraw/zinc/15/24/45/205152445.db2.gz DVRHWQLJJAKAJC-NRFANRHFSA-N 1 1 399.922 4.024 50 0 GIAAMO O=C(C[NH2+]C(c1ccccc1)c1ccccc1)Nc1ccc2c(c1)OCCCO2 ZINC000057449357 205156384 /nfs/dbraw/zinc/15/63/84/205156384.db2.gz NCEOHKZBNSYXHF-UHFFFAOYSA-N 1 1 388.467 4.166 50 0 GIAAMO Cn1cc(C[N@H+](C)Cc2ccncn2)c(-c2ccc(Oc3ccccc3)cc2)n1 ZINC000063855502 205187982 /nfs/dbraw/zinc/18/79/82/205187982.db2.gz BAIMRORJVDUSRU-UHFFFAOYSA-N 1 1 385.471 4.301 50 0 GIAAMO Cn1cc(C[N@@H+](C)Cc2ccncn2)c(-c2ccc(Oc3ccccc3)cc2)n1 ZINC000063855502 205187986 /nfs/dbraw/zinc/18/79/86/205187986.db2.gz BAIMRORJVDUSRU-UHFFFAOYSA-N 1 1 385.471 4.301 50 0 GIAAMO COc1ccccc1C[N@H+](Cc1cccs1)C[C@H](O)c1ccc2c(c1)OCO2 ZINC000058200903 205169128 /nfs/dbraw/zinc/16/91/28/205169128.db2.gz OPJVWKAAIYQPRT-IBGZPJMESA-N 1 1 397.496 4.221 50 0 GIAAMO C[C@H]1CCC[N@@H+](Cc2ccc(CNC(=O)c3coc(Br)c3)cc2)C1 ZINC000058949421 205179063 /nfs/dbraw/zinc/17/90/63/205179063.db2.gz PAUNOIYPURAIQP-AWEZNQCLSA-N 1 1 391.309 4.204 50 0 GIAAMO CCSc1ncc(CN2CC[C@@]3(C2)CCC[N@@H+](Cc2cccc(C)c2)C3)cn1 ZINC000014951037 205180282 /nfs/dbraw/zinc/18/02/82/205180282.db2.gz AUYGRKMUALZSCT-QHCPKHFHSA-N 1 1 396.604 4.385 50 0 GIAAMO Cc1ncc(CN2CC[C@@]3(C2)CCC[N@H+](Cc2ccc(C(C)C)cc2)C3)cn1 ZINC000014959246 205180847 /nfs/dbraw/zinc/18/08/47/205180847.db2.gz PLVBUWMPMYZDOS-DEOSSOPVSA-N 1 1 378.564 4.397 50 0 GIAAMO C[C@@H]1CCCC[N@H+]1CCNC(=O)c1ccc2nc(CCc3ccccc3)oc2c1 ZINC000064968146 205202755 /nfs/dbraw/zinc/20/27/55/205202755.db2.gz OMMVONPRYSQHMU-GOSISDBHSA-N 1 1 391.515 4.217 50 0 GIAAMO Cc1noc(C)c1NC(=O)c1ccc(C[N@H+]2CCC[C@H]2c2ccccn2)cc1 ZINC000065424461 205234499 /nfs/dbraw/zinc/23/44/99/205234499.db2.gz RKULBUFROWKALY-FQEVSTJZSA-N 1 1 376.460 4.276 50 0 GIAAMO Cc1ccsc1-c1c(-c2ccccc2)ncn1CC[N@H+]1CCC[C@@H](CO)C1 ZINC000065502662 205235797 /nfs/dbraw/zinc/23/57/97/205235797.db2.gz UYZQXVZEHJOKPG-GOSISDBHSA-N 1 1 381.545 4.291 50 0 GIAAMO CCN(C)C(=O)[C@H](C)[N@@H+]1CCc2onc(-c3ccc(-c4ccccc4)cc3)c2C1 ZINC000067678036 205255487 /nfs/dbraw/zinc/25/54/87/205255487.db2.gz KBSYKOYYKYHQFL-KRWDZBQOSA-N 1 1 389.499 4.234 50 0 GIAAMO CCN(C)C(=O)[C@H](C)[N@H+]1CCc2onc(-c3ccc(-c4ccccc4)cc3)c2C1 ZINC000067678036 205255491 /nfs/dbraw/zinc/25/54/91/205255491.db2.gz KBSYKOYYKYHQFL-KRWDZBQOSA-N 1 1 389.499 4.234 50 0 GIAAMO Cn1cc(C[N@@H+](C)CCn2ccnc2)c(-c2ccc(C3CCCCC3)cc2)n1 ZINC000067817167 205262783 /nfs/dbraw/zinc/26/27/83/205262783.db2.gz KUZAXIGYKBVDHC-UHFFFAOYSA-N 1 1 377.536 4.463 50 0 GIAAMO COc1ccc(-n2c(C[N@H+]3CCC[C@@H](c4cc[nH]n4)C3)nc3ccccc32)cc1 ZINC000071813616 205298460 /nfs/dbraw/zinc/29/84/60/205298460.db2.gz AYSZDQWQKTUUIQ-QGZVFWFLSA-N 1 1 387.487 4.137 50 0 GIAAMO Cc1nn(Cc2ccccc2)c(Cl)c1CNC[C@@H](c1ccccc1)[NH+](C)C ZINC000071839121 205298519 /nfs/dbraw/zinc/29/85/19/205298519.db2.gz QZXGNYVLWIERFO-NRFANRHFSA-N 1 1 382.939 4.286 50 0 GIAAMO Cc1csc(N2CCC[N@@H+](CCC(=O)Nc3cccc4ccccc43)CC2)n1 ZINC000071824899 205299350 /nfs/dbraw/zinc/29/93/50/205299350.db2.gz GYDNAJABQQYNDF-UHFFFAOYSA-N 1 1 394.544 4.146 50 0 GIAAMO CCOc1ccc2cc(C(=O)N3CCC[N@@H+](CC4CCCCC4)CC3)[nH]c2c1 ZINC000069918818 205276785 /nfs/dbraw/zinc/27/67/85/205276785.db2.gz UWMIXDNGLKDDNW-UHFFFAOYSA-N 1 1 383.536 4.295 50 0 GIAAMO CC(C)[C@@H]1CN(C(=O)c2cncc(Cl)c2)CCC[N@H+]1Cc1ccc(F)cc1 ZINC000072148237 205311659 /nfs/dbraw/zinc/31/16/59/205311659.db2.gz FTODYURYYWRILL-FQEVSTJZSA-N 1 1 389.902 4.247 50 0 GIAAMO COc1ccnc(C[N@H+]2CCC[C@@H](CCc3ccc(F)cc3F)C2)c1OC ZINC000072157452 205312734 /nfs/dbraw/zinc/31/27/34/205312734.db2.gz RBDYWHHZAKBSIE-HNNXBMFYSA-N 1 1 376.447 4.222 50 0 GIAAMO COc1ccc(-c2nc3cc(C)ccc3cc2C[N@@H+]2CC[C@@H](N(C)C)C2)cc1 ZINC000072429057 205350550 /nfs/dbraw/zinc/35/05/50/205350550.db2.gz BDBSOBCJGAGPCL-OAQYLSRUSA-N 1 1 375.516 4.355 50 0 GIAAMO COc1ccc(-c2nc3cc(C)ccc3cc2C[N@H+]2CC[C@@H](N(C)C)C2)cc1 ZINC000072429057 205350552 /nfs/dbraw/zinc/35/05/52/205350552.db2.gz BDBSOBCJGAGPCL-OAQYLSRUSA-N 1 1 375.516 4.355 50 0 GIAAMO Cc1ccc(-n2cc(C[N@H+](C)CC3(CO)CC3)c(-c3ccc(F)cc3)n2)cc1 ZINC000072462814 205353316 /nfs/dbraw/zinc/35/33/16/205353316.db2.gz MPHYNDDYFRHESK-UHFFFAOYSA-N 1 1 379.479 4.191 50 0 GIAAMO Cc1cccc(-c2nc3cc(C)ccc3cc2C[N@@H+]2CCO[C@@H](CCO)C2)c1 ZINC000072410135 205347255 /nfs/dbraw/zinc/34/72/55/205347255.db2.gz IMAFMGPHIMOBPE-QFIPXVFZSA-N 1 1 376.500 4.102 50 0 GIAAMO Cc1cccc(-c2nc3cc(C)ccc3cc2C[N@H+]2CCO[C@@H](CCO)C2)c1 ZINC000072410135 205347256 /nfs/dbraw/zinc/34/72/56/205347256.db2.gz IMAFMGPHIMOBPE-QFIPXVFZSA-N 1 1 376.500 4.102 50 0 GIAAMO COc1cc2[nH+]c(N[C@H](C)c3cccc(C(F)(F)F)c3)nc(N)c2cc1OC ZINC000078874065 205375341 /nfs/dbraw/zinc/37/53/41/205375341.db2.gz GJBLYTPSTBMCSE-SNVBAGLBSA-N 1 1 392.381 4.421 50 0 GIAAMO Cc1c(-c2ccc(Cl)cc2)n[nH]c1C(=O)N[C@H]1CCCC[N@@H+](CC2CC2)C1 ZINC000082099751 205386347 /nfs/dbraw/zinc/38/63/47/205386347.db2.gz BBOJVGYKQFKTJC-SFHVURJKSA-N 1 1 386.927 4.033 50 0 GIAAMO Clc1cc(Br)cnc1NCCc1[nH+]ccn1Cc1ccccc1 ZINC000225419487 206047152 /nfs/dbraw/zinc/04/71/52/206047152.db2.gz WGNOZUIRCKWWKO-UHFFFAOYSA-N 1 1 391.700 4.397 50 0 GIAAMO Cc1cc(C)nc(C2CC[NH+](Cc3ccc(F)c(Br)c3)CC2)n1 ZINC000225571252 206057766 /nfs/dbraw/zinc/05/77/66/206057766.db2.gz GSBSSXAGUFVLEU-UHFFFAOYSA-N 1 1 378.289 4.375 50 0 GIAAMO CC1(C)C[C@]2(CCCN(CC[N@H+]3CCC[C@@]4(CCOC(C)(C)C4)C3)C2)CCO1 ZINC000248340952 206138390 /nfs/dbraw/zinc/13/83/90/206138390.db2.gz VOSHMDSOMREFNT-ZEQRLZLVSA-N 1 1 392.628 4.329 50 0 GIAAMO Cc1cccc2cc(C(=O)N[C@H]3CC[N@H+](C)[C@H]3c3ccccc3)c(Cl)nc12 ZINC000241707035 206127960 /nfs/dbraw/zinc/12/79/60/206127960.db2.gz QMDGUWPWJWLCNX-ICSRJNTNSA-N 1 1 379.891 4.372 50 0 GIAAMO Fc1ccccc1Cn1nc(C[NH2+]Cc2cccs2)c(-c2ccccc2)n1 ZINC000247532257 206134284 /nfs/dbraw/zinc/13/42/84/206134284.db2.gz PBMUFWRLNSCVPJ-UHFFFAOYSA-N 1 1 378.476 4.484 50 0 GIAAMO Cc1cccc(NC(=O)[C@H]2CCC[N@H+](Cc3nc4ccccc4n3C)C2)c1C ZINC000247961370 206136531 /nfs/dbraw/zinc/13/65/31/206136531.db2.gz FGMIPAAFTKFLMS-SFHVURJKSA-N 1 1 376.504 4.041 50 0 GIAAMO COc1ccc(Cc2nc([C@H]3C[C@@H](c4ccccc4)[N@H+]4CCC[C@H]34)no2)cc1 ZINC000299768088 206186730 /nfs/dbraw/zinc/18/67/30/206186730.db2.gz IRIGZAKTAQCVIE-HBMCJLEFSA-N 1 1 375.472 4.362 50 0 GIAAMO Cc1cc(-c2cccc(C(=O)N(C)[C@@H]3CC[N@@H+](C)C3)c2)nc2cc(F)ccc12 ZINC000299780727 206190726 /nfs/dbraw/zinc/19/07/26/206190726.db2.gz BHHSGZIAJBBFPM-LJQANCHMSA-N 1 1 377.463 4.125 50 0 GIAAMO Cc1nc(C(=O)N(Cc2cccc(OCC[C@H]3CCC[N@@H+]3C)c2)C2CC2)cs1 ZINC000299788698 206190770 /nfs/dbraw/zinc/19/07/70/206190770.db2.gz ZOBOGWOAHYTONH-GOSISDBHSA-N 1 1 399.560 4.119 50 0 GIAAMO O=C(Nc1ccccc1)[C@@H](c1ccccc1)[NH+]1CCC(OC2CCOCC2)CC1 ZINC000133652762 206210345 /nfs/dbraw/zinc/21/03/45/206210345.db2.gz PPHKPFRIDLCNHZ-HSZRJFAPSA-N 1 1 394.515 4.026 50 0 GIAAMO CCn1c2ccccc2nc1[C@@H](C)[NH2+][C@@H](C)c1cc(OC)c(OC)c(OC)c1 ZINC000180993802 206210490 /nfs/dbraw/zinc/21/04/90/206210490.db2.gz RAYXQIJAMHWEND-LSDHHAIUSA-N 1 1 383.492 4.494 50 0 GIAAMO Cc1[nH+]c(N)ccc1-c1cccc(C(=O)N2CCCC[C@@H]2c2nccs2)c1 ZINC000426730352 533594910 /nfs/dbraw/zinc/59/49/10/533594910.db2.gz GQVKGSRUBILEHP-GOSISDBHSA-N 1 1 378.501 4.293 50 0 GIAAMO CCOc1ccccc1N1CC[NH+](Cc2cc(=O)oc3cc(C)c(C)cc23)CC1 ZINC000057784991 136153997 /nfs/dbraw/zinc/15/39/97/136153997.db2.gz FIRRZQZKRLTKHK-UHFFFAOYSA-N 1 1 392.499 4.131 50 0 GIAAMO Oc1cccc(C[N@H+]2CCCC23CCN(c2ccc(C(F)(F)F)cn2)CC3)c1 ZINC000072423263 136169805 /nfs/dbraw/zinc/16/98/05/136169805.db2.gz GMPWQHYMHLIPDK-UHFFFAOYSA-N 1 1 391.437 4.441 50 0 GIAAMO C(=C\c1ccccc1)\C[NH+]1CCN(c2ncnc3sc4c(c32)CCCC4)CC1 ZINC000004693076 136194139 /nfs/dbraw/zinc/19/41/39/136194139.db2.gz URSXOZPUDGSUIV-TWGQIWQCSA-N 1 1 390.556 4.406 50 0 GIAAMO Cc1noc(C)c1[C@H]1CCC[N@H+]1Cc1cccc(C(=O)Nc2cccnc2)c1 ZINC000065436163 222130177 /nfs/dbraw/zinc/13/01/77/222130177.db2.gz VNGRHPWCIMHPNF-HXUWFJFHSA-N 1 1 376.460 4.276 50 0 GIAAMO CC(C)N1CC[NH+](CCn2cnc(-c3ccccc3)c2-c2ccsc2)CC1 ZINC000065454464 222130551 /nfs/dbraw/zinc/13/05/51/222130551.db2.gz OFHDTIKKTKKRAI-UHFFFAOYSA-N 1 1 380.561 4.305 50 0 GIAAMO C[C@@H]1C[NH+](Cc2ccccc2CNC(=O)c2cc(Cl)ccc2F)C[C@@H](C)O1 ZINC000048332385 525014391 /nfs/dbraw/zinc/01/43/91/525014391.db2.gz MJHJHECBAQZHCZ-HUUCEWRRSA-N 1 1 390.886 4.018 50 0 GIAAMO CC(C)n1c2ccccc2nc1[C@@H]1CCC[N@@H+](CCC(=O)N2CCC[C@H]2C)C1 ZINC000241515637 528543486 /nfs/dbraw/zinc/54/34/86/528543486.db2.gz OGRKSUSQAHHCPV-RTBURBONSA-N 1 1 382.552 4.198 50 0 GIAAMO CCn1c2ccccc2n(C2=C(CO)C[N@@H+](CC3CCCCCCC3)CC2)c1=O ZINC000013831225 560220670 /nfs/dbraw/zinc/22/06/70/560220670.db2.gz DCRGHMJXEBSRQG-UHFFFAOYSA-N 1 1 397.563 4.093 50 0 in-vitro GIAAMO CC(C)COC1CC[NH+](Cc2cc(=O)n3c(-c4ccccc4)csc3n2)CC1 ZINC000048287940 570227882 /nfs/dbraw/zinc/22/78/82/570227882.db2.gz OHSBHUJGRAAGNA-UHFFFAOYSA-N 1 1 397.544 4.060 50 0 GIAAMO Cc1ccc(NC(=O)NC(=O)C[N@@H+](C2CC2)[C@@H]2CCc3ccccc32)c(C)c1 ZINC000048299340 570233683 /nfs/dbraw/zinc/23/36/83/570233683.db2.gz NYTFVYODRAJSJU-OAQYLSRUSA-N 1 1 377.488 4.103 50 0 GIAAMO Cc1ccc(NC(=O)C(C)C)cc1NC(=O)N1CC[N@H+](C)C[C@@H]1c1ccccc1 ZINC000048344135 570240193 /nfs/dbraw/zinc/24/01/93/570240193.db2.gz WOBLBTHGKIKQTG-OAQYLSRUSA-N 1 1 394.519 4.110 50 0 GIAAMO Cc1ccc(NC(=O)C(C)C)cc1NC(=O)N1CC[N@@H+](C)C[C@@H]1c1ccccc1 ZINC000048344135 570240195 /nfs/dbraw/zinc/24/01/95/570240195.db2.gz WOBLBTHGKIKQTG-OAQYLSRUSA-N 1 1 394.519 4.110 50 0 GIAAMO CC(C)c1cc(C(=O)N2CC[NH+](C(c3ccccc3)c3ccccc3)CC2)no1 ZINC000020137726 570242182 /nfs/dbraw/zinc/24/21/82/570242182.db2.gz CEIKFHYVNNFDLI-UHFFFAOYSA-N 1 1 389.499 4.345 50 0 GIAAMO Cc1[nH]c2c(cccc2F)c1CC(=O)N[C@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000097446850 570243739 /nfs/dbraw/zinc/24/37/39/570243739.db2.gz BUJTUFQNCKFAOX-HNNXBMFYSA-N 1 1 385.508 4.000 50 0 GIAAMO COc1ccc(OC)c(Nc2ncc3c(n2)CC[N@@H+](Cc2ccccc2C)C3)c1 ZINC000015779085 570243822 /nfs/dbraw/zinc/24/38/22/570243822.db2.gz SEBCEBCPRVJMAK-UHFFFAOYSA-N 1 1 390.487 4.104 50 0 GIAAMO COc1ccc(OC)c(Nc2ncc3c(n2)CC[N@H+](Cc2ccccc2C)C3)c1 ZINC000015779085 570243824 /nfs/dbraw/zinc/24/38/24/570243824.db2.gz SEBCEBCPRVJMAK-UHFFFAOYSA-N 1 1 390.487 4.104 50 0 GIAAMO CCNC(=O)c1ccc([C@H]2CCC[N@@H+]2Cc2cccn2-c2nccs2)s1 ZINC000020210445 570248069 /nfs/dbraw/zinc/24/80/69/570248069.db2.gz ZVBMHXRMDDQCPO-OAHLLOKOSA-N 1 1 386.546 4.082 50 0 GIAAMO CCNC(=O)c1ccc([C@H]2CCC[N@H+]2Cc2cccn2-c2nccs2)s1 ZINC000020210445 570248074 /nfs/dbraw/zinc/24/80/74/570248074.db2.gz ZVBMHXRMDDQCPO-OAHLLOKOSA-N 1 1 386.546 4.082 50 0 GIAAMO Cc1cc(-c2nn(C)c(Cl)c2C[N@H+](C)Cc2cccc3cccnc32)no1 ZINC000097813741 570256776 /nfs/dbraw/zinc/25/67/76/570256776.db2.gz MAGODGFHIPYVRF-UHFFFAOYSA-N 1 1 381.867 4.217 50 0 GIAAMO Cc1cc(-c2nn(C)c(Cl)c2C[N@@H+](C)Cc2cccc3cccnc32)no1 ZINC000097813741 570256780 /nfs/dbraw/zinc/25/67/80/570256780.db2.gz MAGODGFHIPYVRF-UHFFFAOYSA-N 1 1 381.867 4.217 50 0 GIAAMO O=C(COc1ccc(-c2ccccc2)cc1)N1CC[NH+](Cc2ccccc2)CC1 ZINC000020512062 570265074 /nfs/dbraw/zinc/26/50/74/570265074.db2.gz SWRHVVQDDAZWEE-UHFFFAOYSA-N 1 1 386.495 4.077 50 0 GIAAMO FC(F)(F)c1cccc(-c2c[nH]nc2[C@@H]2CCC[N@@H+](Cc3cc[nH]n3)C2)c1 ZINC000020540829 570266653 /nfs/dbraw/zinc/26/66/53/570266653.db2.gz QPSCAMWDJWRAMJ-CQSZACIVSA-N 1 1 375.398 4.198 50 0 GIAAMO O=C(c1cccc(C(F)(F)F)c1)[C@H]1CCC[N@H+](C2CSCCSC2)C1 ZINC000020599546 570269689 /nfs/dbraw/zinc/26/96/89/570269689.db2.gz DCCXCQVSFYYOAC-AWEZNQCLSA-N 1 1 389.508 4.449 50 0 GIAAMO Cc1nn(C)c(C)c1NC(=O)c1ccc([C@H]2CCC[N@@H+]2Cc2ccco2)s1 ZINC000020600715 570269960 /nfs/dbraw/zinc/26/99/60/570269960.db2.gz LCFVTTISBWASEV-MRXNPFEDSA-N 1 1 384.505 4.281 50 0 GIAAMO Cc1nn(C)c(C)c1NC(=O)c1ccc([C@H]2CCC[N@H+]2Cc2ccco2)s1 ZINC000020600715 570269961 /nfs/dbraw/zinc/26/99/61/570269961.db2.gz LCFVTTISBWASEV-MRXNPFEDSA-N 1 1 384.505 4.281 50 0 GIAAMO CCC[N@H+](Cc1ccc(OC)c(OC)c1)Cc1cc(=O)c2cc(C)ccc2[nH]1 ZINC000015862333 570278935 /nfs/dbraw/zinc/27/89/35/570278935.db2.gz ZDKNXUACERUYLG-UHFFFAOYSA-N 1 1 380.488 4.266 50 0 GIAAMO C[N@@H+](CCc1ccccn1)[C@H]1CCCN(Cc2nc(-c3ccccc3)cs2)C1 ZINC000020906700 570284224 /nfs/dbraw/zinc/28/42/24/570284224.db2.gz NMZQGWYQYPCJQK-NRFANRHFSA-N 1 1 392.572 4.344 50 0 GIAAMO CCCOc1c(Br)cc(C[NH2+]Cc2ccccn2)cc1OCC ZINC000020932591 570285413 /nfs/dbraw/zinc/28/54/13/570285413.db2.gz UHZCIVFKKHOGGS-UHFFFAOYSA-N 1 1 379.298 4.321 50 0 GIAAMO Cc1ccc(C)c(NC(=O)C[N@@H+](Cc2ccc3c(c2)OCO3)C2CCCC2)c1 ZINC000012896869 570286917 /nfs/dbraw/zinc/28/69/17/570286917.db2.gz FBBHZKXZZJOGJE-UHFFFAOYSA-N 1 1 380.488 4.415 50 0 GIAAMO O=C(c1ccc(Cl)nc1)N1CC[NH+](C(c2ccccc2)c2ccccc2)CC1 ZINC000021004254 570287134 /nfs/dbraw/zinc/28/71/34/570287134.db2.gz BYVHBYAUKFUPGR-UHFFFAOYSA-N 1 1 391.902 4.282 50 0 GIAAMO CNC(=O)[C@H]1CC[N@@H+](Cc2cccc(Oc3cccc(C(F)(F)F)c3)c2)C1 ZINC000215418474 570288693 /nfs/dbraw/zinc/28/86/93/570288693.db2.gz JTPJTZNARPFZIF-HNNXBMFYSA-N 1 1 378.394 4.066 50 0 GIAAMO Cc1ccc([C@H](C)NC(=O)C[N@@H+]2CCC[C@@H]2c2ccc3c(c2)OCCO3)cc1C ZINC000012902074 570288771 /nfs/dbraw/zinc/28/87/71/570288771.db2.gz FBIFVVKCXXEIGT-GHTZIAJQSA-N 1 1 394.515 4.089 50 0 GIAAMO Cc1ccc([C@H](C)NC(=O)C[N@H+]2CCC[C@@H]2c2ccc3c(c2)OCCO3)cc1C ZINC000012902074 570288773 /nfs/dbraw/zinc/28/87/73/570288773.db2.gz FBIFVVKCXXEIGT-GHTZIAJQSA-N 1 1 394.515 4.089 50 0 GIAAMO O=C(c1cccc(C[NH+]2CCSCC2)c1)c1ccc(Br)c(F)c1 ZINC000002515294 570289392 /nfs/dbraw/zinc/28/93/92/570289392.db2.gz KXOQRZSUEICTTF-UHFFFAOYSA-N 1 1 394.309 4.368 50 0 GIAAMO COc1ccc(Nc2ncc3c(n2)CC[N@@H+](Cc2sccc2C)C3)c(OC)c1 ZINC000021261505 570289698 /nfs/dbraw/zinc/28/96/98/570289698.db2.gz MKZPYADNEGMPLK-UHFFFAOYSA-N 1 1 396.516 4.166 50 0 GIAAMO COc1ccc(Nc2ncc3c(n2)CC[N@H+](Cc2sccc2C)C3)c(OC)c1 ZINC000021261505 570289701 /nfs/dbraw/zinc/28/97/01/570289701.db2.gz MKZPYADNEGMPLK-UHFFFAOYSA-N 1 1 396.516 4.166 50 0 GIAAMO Cc1ccc(-c2nc(C(=O)N3CC[NH+](Cc4ccccc4C)CC3)cs2)cc1 ZINC000012914629 570292043 /nfs/dbraw/zinc/29/20/43/570292043.db2.gz RAPVICZCSIVHTJ-UHFFFAOYSA-N 1 1 391.540 4.385 50 0 GIAAMO Cc1ccc(NC(=O)C[N@@H+](Cc2ccc3c(c2)OCO3)C2CCCC2)c(F)c1 ZINC000012915609 570293051 /nfs/dbraw/zinc/29/30/51/570293051.db2.gz VEHMACYNCBYDRG-UHFFFAOYSA-N 1 1 384.451 4.246 50 0 GIAAMO Cc1cc([C@@H]2CCC[N@@H+]2Cc2c[nH]nc2-c2cccc(Br)c2)no1 ZINC000021719970 570294867 /nfs/dbraw/zinc/29/48/67/570294867.db2.gz QSUPJJHYUDIBET-KRWDZBQOSA-N 1 1 387.281 4.473 50 0 GIAAMO Cc1cc([C@@H]2CCC[N@H+]2Cc2c[nH]nc2-c2cccc(Br)c2)no1 ZINC000021719970 570294870 /nfs/dbraw/zinc/29/48/70/570294870.db2.gz QSUPJJHYUDIBET-KRWDZBQOSA-N 1 1 387.281 4.473 50 0 GIAAMO CCCCCCOc1ccc(C[N@H+]2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1 ZINC000022078460 570305280 /nfs/dbraw/zinc/30/52/80/570305280.db2.gz SKOSAPNRLHQYCV-RTWAWAEBSA-N 1 1 380.532 4.427 50 0 GIAAMO Cc1cnccc1C[N@@H+](C)Cc1ccc(-c2nc(C(C)(C)C)cc(=O)[nH]2)cc1 ZINC000023367313 570321612 /nfs/dbraw/zinc/32/16/12/570321612.db2.gz BFKWDGMURRETNA-UHFFFAOYSA-N 1 1 376.504 4.070 50 0 GIAAMO COc1ccccc1C[N@H+]1CCC[C@H](N2CCN(c3cccc(Cl)c3)CC2)C1 ZINC000022913321 570334166 /nfs/dbraw/zinc/33/41/66/570334166.db2.gz AHVXUAHKPLIGIQ-QFIPXVFZSA-N 1 1 399.966 4.135 50 0 GIAAMO COc1ccccc1CN1CCC[C@H]([NH+]2CCN(c3cccc(Cl)c3)CC2)C1 ZINC000022913321 570334168 /nfs/dbraw/zinc/33/41/68/570334168.db2.gz AHVXUAHKPLIGIQ-QFIPXVFZSA-N 1 1 399.966 4.135 50 0 GIAAMO COc1cccc(C[N@@H+]2CCC[C@H]2c2ccc(C(=O)Nc3cc[nH]n3)s2)c1 ZINC000023231859 570351040 /nfs/dbraw/zinc/35/10/40/570351040.db2.gz KQBXYTDTKZANQK-INIZCTEOSA-N 1 1 382.489 4.069 50 0 GIAAMO COc1cccc(C[N@H+]2CCC[C@H]2c2ccc(C(=O)Nc3cc[nH]n3)s2)c1 ZINC000023231859 570351044 /nfs/dbraw/zinc/35/10/44/570351044.db2.gz KQBXYTDTKZANQK-INIZCTEOSA-N 1 1 382.489 4.069 50 0 GIAAMO CCN(Cc1nc2ccccc2[nH]1)C[C@@H]1CCC[N@@H+](CCc2cccc(F)c2)C1 ZINC000023338811 570355220 /nfs/dbraw/zinc/35/52/20/570355220.db2.gz AOZNBJXTGOFGOA-FQEVSTJZSA-N 1 1 394.538 4.479 50 0 GIAAMO CC(C)n1nccc1NC(=O)[C@@H](C)[NH+]1CCC(c2nc3ccccc3s2)CC1 ZINC000023828788 570373188 /nfs/dbraw/zinc/37/31/88/570373188.db2.gz RSRUCDQHADDXMP-OAHLLOKOSA-N 1 1 397.548 4.280 50 0 GIAAMO Cc1ccc2nc(C[N@@H+]3CCc4sccc4[C@@H]3c3cccs3)cc(=O)n2c1 ZINC000023847070 570373767 /nfs/dbraw/zinc/37/37/67/570373767.db2.gz GMKVMRCDDWAUFI-OAQYLSRUSA-N 1 1 393.537 4.274 50 0 GIAAMO Cc1ccc2nc(C[N@H+]3CCc4sccc4[C@@H]3c3cccs3)cc(=O)n2c1 ZINC000023847070 570373771 /nfs/dbraw/zinc/37/37/71/570373771.db2.gz GMKVMRCDDWAUFI-OAQYLSRUSA-N 1 1 393.537 4.274 50 0 GIAAMO CCCc1nn2c(nc(C[N@H+](Cc3ccc(C)cc3)CC(C)C)cc2=O)s1 ZINC000035509806 570382402 /nfs/dbraw/zinc/38/24/02/570382402.db2.gz HCAZCFFEYAYXDT-UHFFFAOYSA-N 1 1 384.549 4.070 50 0 GIAAMO C[C@@H]([NH2+][C@@H](C)CCc1ccc2c(c1)OCO2)c1noc(Cc2ccccc2)n1 ZINC000165385934 570382583 /nfs/dbraw/zinc/38/25/83/570382583.db2.gz VISHCEUPQKJTTJ-JKSUJKDBSA-N 1 1 379.460 4.061 50 0 GIAAMO CC(C)C[N@@H+](Cc1ccc(F)cc1)Cc1cc(=O)n2c3c(sc2n1)CCCC3 ZINC000033068903 570400949 /nfs/dbraw/zinc/40/09/49/570400949.db2.gz OIJKDUOXCQACID-UHFFFAOYSA-N 1 1 399.535 4.432 50 0 GIAAMO Cc1noc([C@@H](C)N2CC[NH+](Cc3ccc(-c4cccc(F)c4)s3)CC2)n1 ZINC000026207543 570423357 /nfs/dbraw/zinc/42/33/57/570423357.db2.gz CONZCHPMQJVOHR-CQSZACIVSA-N 1 1 386.496 4.124 50 0 GIAAMO CC[C@H](NC(=O)C[N@@H+]1CCC[C@H]1c1ccc2c(c1)OCCO2)c1ccc(C)cc1 ZINC000248152094 570444861 /nfs/dbraw/zinc/44/48/61/570444861.db2.gz KFGFQGSULJITOG-SFTDATJTSA-N 1 1 394.515 4.171 50 0 GIAAMO CC[C@H](NC(=O)C[N@H+]1CCC[C@H]1c1ccc2c(c1)OCCO2)c1ccc(C)cc1 ZINC000248152094 570444863 /nfs/dbraw/zinc/44/48/63/570444863.db2.gz KFGFQGSULJITOG-SFTDATJTSA-N 1 1 394.515 4.171 50 0 GIAAMO C[N@@H+]1CC[C@H](NC(=O)Cc2c(F)cccc2Cl)[C@@H]1c1ccc(Cl)cc1 ZINC000089375124 570447366 /nfs/dbraw/zinc/44/73/66/570447366.db2.gz IJHLXQBYWPNKRV-HKUYNNGSSA-N 1 1 381.278 4.237 50 0 GIAAMO C[N@H+]1CC[C@H](NC(=O)Cc2c(F)cccc2Cl)[C@@H]1c1ccc(Cl)cc1 ZINC000089375124 570447369 /nfs/dbraw/zinc/44/73/69/570447369.db2.gz IJHLXQBYWPNKRV-HKUYNNGSSA-N 1 1 381.278 4.237 50 0 GIAAMO O[C@]12CCCC[C@H]1[C@@H](c1ccc3c(c1)OCO3)[N@@H+](Cc1ccccc1F)CC2 ZINC000006576871 570481029 /nfs/dbraw/zinc/48/10/29/570481029.db2.gz QYCGHCGVHINPBT-NMNUPHIUSA-N 1 1 383.463 4.423 50 0 GIAAMO CCC[C@H](C)[N@@H+](C)CC(=O)NC(c1ccc(OC)cc1)c1ccc(OC)cc1 ZINC000030270052 570487982 /nfs/dbraw/zinc/48/79/82/570487982.db2.gz MUZMYGSRQOFRMN-KRWDZBQOSA-N 1 1 384.520 4.030 50 0 GIAAMO COc1cccc(NC(=O)[C@H](C)[N@H+]2CC=C(c3c[nH]c4ccccc43)CC2)c1 ZINC000089573886 570494288 /nfs/dbraw/zinc/49/42/88/570494288.db2.gz JWQWJMCHZPPAIS-INIZCTEOSA-N 1 1 375.472 4.293 50 0 GIAAMO COc1cccc(NC(=O)[C@H](C)[N@@H+]2CC=C(c3c[nH]c4ccccc43)CC2)c1 ZINC000089573886 570494289 /nfs/dbraw/zinc/49/42/89/570494289.db2.gz JWQWJMCHZPPAIS-INIZCTEOSA-N 1 1 375.472 4.293 50 0 GIAAMO CCc1cccc(C)c1NC(=O)C[N@H+](C)Cc1ccc(Br)cc1 ZINC000006638545 570512344 /nfs/dbraw/zinc/51/23/44/570512344.db2.gz FQEZPABSQGXNCR-UHFFFAOYSA-N 1 1 375.310 4.390 50 0 GIAAMO CCc1cccc(C)c1NC(=O)C[N@@H+](C)Cc1ccc(Br)cc1 ZINC000006638545 570512348 /nfs/dbraw/zinc/51/23/48/570512348.db2.gz FQEZPABSQGXNCR-UHFFFAOYSA-N 1 1 375.310 4.390 50 0 GIAAMO CC[N@@H+](CCCc1nc(-c2ccc(C)c(F)c2)no1)C[C@@H](O)c1ccc(C)cc1 ZINC000072305237 570518642 /nfs/dbraw/zinc/51/86/42/570518642.db2.gz RAHCGKLARGBIHS-OAQYLSRUSA-N 1 1 397.494 4.481 50 0 GIAAMO CCOc1cc(C[N@H+]2CCCCC[C@H]2c2cccc(C)c2)ccc1OCC(N)=O ZINC000033087225 570519882 /nfs/dbraw/zinc/51/98/82/570519882.db2.gz NEZQCRZNZGYCOQ-NRFANRHFSA-N 1 1 396.531 4.375 50 0 GIAAMO COc1cc(OC)c(NC(=O)C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cc1Cl ZINC000072306875 570524384 /nfs/dbraw/zinc/52/43/84/570524384.db2.gz NFXGOFXZLAJTCD-INIZCTEOSA-N 1 1 388.895 4.208 50 0 GIAAMO COc1cc(C[NH2+][C@H](C)c2ccccc2Br)cc(OC)c1OC ZINC000022777500 570544887 /nfs/dbraw/zinc/54/48/87/570544887.db2.gz NNICDQMUHIQTJK-GFCCVEGCSA-N 1 1 380.282 4.326 50 0 GIAAMO COc1cccc(C(=O)NC[C@@H](c2cccs2)[N@@H+]2CCc3ccccc3C2)c1 ZINC000022907783 570564079 /nfs/dbraw/zinc/56/40/79/570564079.db2.gz BQEHBUXVVNEIKU-NRFANRHFSA-N 1 1 392.524 4.286 50 0 GIAAMO COc1cccc(C(=O)NC[C@@H](c2cccs2)[N@H+]2CCc3ccccc3C2)c1 ZINC000022907783 570564081 /nfs/dbraw/zinc/56/40/81/570564081.db2.gz BQEHBUXVVNEIKU-NRFANRHFSA-N 1 1 392.524 4.286 50 0 GIAAMO COc1ccc(C(=O)NC[C@H](c2cccs2)[N@@H+]2CCc3ccccc3C2)cc1 ZINC000022907683 570564171 /nfs/dbraw/zinc/56/41/71/570564171.db2.gz FWHGATVURKZBNL-OAQYLSRUSA-N 1 1 392.524 4.286 50 0 GIAAMO COc1ccc(C(=O)NC[C@H](c2cccs2)[N@H+]2CCc3ccccc3C2)cc1 ZINC000022907683 570564176 /nfs/dbraw/zinc/56/41/76/570564176.db2.gz FWHGATVURKZBNL-OAQYLSRUSA-N 1 1 392.524 4.286 50 0 GIAAMO Cc1cccc(C[NH+]2CCN([C@@H](C)c3nnc(-c4ccc(F)cc4)o3)CC2)c1 ZINC000022925461 570580588 /nfs/dbraw/zinc/58/05/88/570580588.db2.gz KSTBRSRHSBFJSQ-KRWDZBQOSA-N 1 1 380.467 4.063 50 0 GIAAMO COc1cc(C[N@@H+]2CCC[C@H](C(=O)c3ccc(Cl)cc3)C2)cc2c1OCO2 ZINC000012058485 570603452 /nfs/dbraw/zinc/60/34/52/570603452.db2.gz GKDJNMKPCKTWKC-INIZCTEOSA-N 1 1 387.863 4.172 50 0 GIAAMO COc1cc(C[N@H+]2CCC[C@H](C(=O)c3ccc(Cl)cc3)C2)cc2c1OCO2 ZINC000012058485 570603454 /nfs/dbraw/zinc/60/34/54/570603454.db2.gz GKDJNMKPCKTWKC-INIZCTEOSA-N 1 1 387.863 4.172 50 0 GIAAMO COc1cccc(CN2CCC[C@@]3(CC[N@@H+](CCCc4ccccc4)C3)C2=O)c1 ZINC000012442697 570665156 /nfs/dbraw/zinc/66/51/56/570665156.db2.gz SWHUJPGPJGWSSR-VWLOTQADSA-N 1 1 392.543 4.143 50 0 GIAAMO COc1ccc(C(=O)[C@@H]2CCC[N@@H+](Cc3ccc(-n4cccn4)cc3)C2)cc1F ZINC000012454523 570668724 /nfs/dbraw/zinc/66/87/24/570668724.db2.gz LZLKWANURAMYFG-LJQANCHMSA-N 1 1 393.462 4.115 50 0 GIAAMO CC[C@@H]1CCCC[N@H+]1Cc1cc2ccc(F)cc2n(Cc2ccncc2)c1=O ZINC000012456007 570669261 /nfs/dbraw/zinc/66/92/61/570669261.db2.gz FDHFUWIKZYYPHC-OAQYLSRUSA-N 1 1 379.479 4.348 50 0 GIAAMO CO[C@@H]1CCC[N@@H+](Cc2cn(C)nc2-c2ccc(Oc3ccccc3)cc2)C1 ZINC000012467500 570671796 /nfs/dbraw/zinc/67/17/96/570671796.db2.gz CIQSNWYSWOLVKR-JOCHJYFZSA-N 1 1 377.488 4.490 50 0 GIAAMO CCc1ocnc1C(=O)N1CC[C@]2(C1)CCC[N@@H+](Cc1ccc(C(C)C)cc1)C2 ZINC000012595897 570688975 /nfs/dbraw/zinc/68/89/75/570688975.db2.gz QJUMUDZYGJUOIR-XMMPIXPASA-N 1 1 395.547 4.489 50 0 GIAAMO CC[N@@H+](Cc1ccc(OC)cc1)C[C@@H]1CCCN(CCc2cccc(OC)c2)C1 ZINC000012744683 570707560 /nfs/dbraw/zinc/70/75/60/570707560.db2.gz CDAIBHINCKYILG-QHCPKHFHSA-N 1 1 396.575 4.480 50 0 GIAAMO CC[N@H+](Cc1ccc(OC)cc1)C[C@@H]1CCCN(CCc2cccc(OC)c2)C1 ZINC000012744683 570707562 /nfs/dbraw/zinc/70/75/62/570707562.db2.gz CDAIBHINCKYILG-QHCPKHFHSA-N 1 1 396.575 4.480 50 0 GIAAMO CC[N@@H+](Cc1ccc(OC)cc1)C[C@H]1CCCN(CCc2cccc(OC)c2)C1 ZINC000012744686 570707645 /nfs/dbraw/zinc/70/76/45/570707645.db2.gz CDAIBHINCKYILG-HSZRJFAPSA-N 1 1 396.575 4.480 50 0 GIAAMO CC[N@H+](Cc1ccc(OC)cc1)C[C@H]1CCCN(CCc2cccc(OC)c2)C1 ZINC000012744686 570707647 /nfs/dbraw/zinc/70/76/47/570707647.db2.gz CDAIBHINCKYILG-HSZRJFAPSA-N 1 1 396.575 4.480 50 0 GIAAMO COc1cccc(OC[C@@H]2CCC[N@H+](Cc3nc(-c4cccs4)no3)C2)c1 ZINC000012745197 570708225 /nfs/dbraw/zinc/70/82/25/570708225.db2.gz HMMFJSDNWNXCLR-OAHLLOKOSA-N 1 1 385.489 4.098 50 0 GIAAMO COc1cccc(OC[C@@H]2CCC[N@@H+](Cc3nc(-c4cccs4)no3)C2)c1 ZINC000012745197 570708231 /nfs/dbraw/zinc/70/82/31/570708231.db2.gz HMMFJSDNWNXCLR-OAHLLOKOSA-N 1 1 385.489 4.098 50 0 GIAAMO O=C(NCc1ccccc1)C1CCN(c2cc[nH+]c3cc(Cl)ccc32)CC1 ZINC000012805310 570718551 /nfs/dbraw/zinc/71/85/51/570718551.db2.gz AKVQKBILSCWCKZ-UHFFFAOYSA-N 1 1 379.891 4.421 50 0 GIAAMO C[C@@H](NC(=O)C[N@@H+]1CCC[C@H]1c1ccc2c(c1)OCCCO2)c1ccc(F)cc1 ZINC000036476311 570720641 /nfs/dbraw/zinc/72/06/41/570720641.db2.gz SAURDOVVGVPZAG-UZLBHIALSA-N 1 1 398.478 4.001 50 0 GIAAMO C[C@@H](NC(=O)C[N@H+]1CCC[C@H]1c1ccc2c(c1)OCCCO2)c1ccc(F)cc1 ZINC000036476311 570720644 /nfs/dbraw/zinc/72/06/44/570720644.db2.gz SAURDOVVGVPZAG-UZLBHIALSA-N 1 1 398.478 4.001 50 0 GIAAMO COc1ccc(OC)c([C@H]2CCC[N@@H+]2CC(=O)N[C@H]2CCCc3ccccc32)c1 ZINC000036479389 570721282 /nfs/dbraw/zinc/72/12/82/570721282.db2.gz AVITWMLWZHBXSF-FCHUYYIVSA-N 1 1 394.515 4.035 50 0 GIAAMO COc1ccc(OC)c([C@H]2CCC[N@H+]2CC(=O)N[C@H]2CCCc3ccccc32)c1 ZINC000036479389 570721285 /nfs/dbraw/zinc/72/12/85/570721285.db2.gz AVITWMLWZHBXSF-FCHUYYIVSA-N 1 1 394.515 4.035 50 0 GIAAMO Fc1ccc([C@@H]2C3=C([NH+]=C4N=CNN42)c2ccccc2O[C@H]3c2ccncc2)cc1 ZINC000013127664 570747957 /nfs/dbraw/zinc/74/79/57/570747957.db2.gz OLKLATOBUFSZII-YADHBBJMSA-N 1 1 397.413 4.025 50 0 GIAAMO O=C(NC[C@H](c1ccco1)[NH+]1CCCCC1)c1ccc(OC(F)(F)F)cc1 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RVNSJRTWUNFISB-IBGZPJMESA-N 1 1 399.498 4.409 50 0 GIAAMO CC(C)Cc1cc(C[N@H+]2CCC[C@](CO)(Cc3cccc(Cl)c3)C2)[nH]n1 ZINC000012301202 204390859 /nfs/dbraw/zinc/39/08/59/204390859.db2.gz GKNIJVSAFJETKG-NRFANRHFSA-N 1 1 375.944 4.079 50 0 GIAAMO Cc1cc(C)c(C(=O)N2CC[C@]3(C2)CCC[N@@H+](Cc2ccc(F)c(F)c2)C3)o1 ZINC000012300502 204391238 /nfs/dbraw/zinc/39/12/38/204391238.db2.gz RGLXRYONGRONIG-JOCHJYFZSA-N 1 1 388.458 4.303 50 0 GIAAMO OC[C@@]1(CCc2ccccc2)CCC[N@@H+](Cc2c[nH]nc2-c2cccc(F)c2)C1 ZINC000012299885 204392084 /nfs/dbraw/zinc/39/20/84/204392084.db2.gz PIYQPVHKWZCDIR-XMMPIXPASA-N 1 1 393.506 4.423 50 0 GIAAMO Cc1ccc(C[NH+]2CCC(CN(C)Cc3nccn3-c3cccc(C)c3)CC2)o1 ZINC000012305499 204393138 /nfs/dbraw/zinc/39/31/38/204393138.db2.gz GFQNDNAKGUVHBE-UHFFFAOYSA-N 1 1 392.547 4.426 50 0 GIAAMO CCOc1cc(C[N@H+]2CCCCC[C@H]2c2ccc(C)cc2)ccc1OCC(N)=O ZINC000033087223 204945576 /nfs/dbraw/zinc/94/55/76/204945576.db2.gz PKANNZXBRFZQLD-NRFANRHFSA-N 1 1 396.531 4.375 50 0 GIAAMO CCOC(=O)[C@H]1CCCN(c2c(C(=O)c3ccccc3)c[nH+]c3ccccc32)C1 ZINC000036058109 205003522 /nfs/dbraw/zinc/00/35/22/205003522.db2.gz AEALXMXNXIICRD-SFHVURJKSA-N 1 1 388.467 4.245 50 0 GIAAMO CCC[N@H+](Cc1cccc(OC)c1OC)C[C@H](O)COc1ccc(Cl)cc1 ZINC000036097260 205005172 /nfs/dbraw/zinc/00/51/72/205005172.db2.gz VACSBJIKEUVPGW-SFHVURJKSA-N 1 1 393.911 4.009 50 0 GIAAMO O[C@H](Cc1ccccc1)C[N@H+](Cc1ccc2c(c1)OCO2)Cc1ccccc1F ZINC000036103151 205006378 /nfs/dbraw/zinc/00/63/78/205006378.db2.gz ZPMZHZFXVDLKRC-OAQYLSRUSA-N 1 1 393.458 4.160 50 0 GIAAMO O[C@H](Cc1ccccc1)C[N@@H+](Cc1ccc2c(c1)OCO2)Cc1ccccc1F ZINC000036103151 205006382 /nfs/dbraw/zinc/00/63/82/205006382.db2.gz ZPMZHZFXVDLKRC-OAQYLSRUSA-N 1 1 393.458 4.160 50 0 GIAAMO COc1cccc([C@H]2CC(c3cc(C)ccc3C)=NN2C(=O)C[N@@H+](C)C(C)C)c1 ZINC000036345700 205012518 /nfs/dbraw/zinc/01/25/18/205012518.db2.gz CXEZCHYOSNKOLS-HSZRJFAPSA-N 1 1 393.531 4.330 50 0 GIAAMO Cc1cccc(C2=NN(C(=O)C[NH+]3CCCCC3)[C@@H](c3ccccc3F)C2)c1 ZINC000036345446 205013317 /nfs/dbraw/zinc/01/33/17/205013317.db2.gz YNTNTUSPPQQTMG-JOCHJYFZSA-N 1 1 379.479 4.298 50 0 GIAAMO C[C@@H](C(=O)NCc1cccs1)[NH+]1CCC(c2nc3ccccc3s2)CC1 ZINC000040001154 205045140 /nfs/dbraw/zinc/04/51/40/205045140.db2.gz AVBGGOFVASKFFN-AWEZNQCLSA-N 1 1 385.558 4.242 50 0 GIAAMO C[C@@H](C(=O)NC1CC[NH+](Cc2ccccc2)CC1)N1CCC[C@@H]1c1ccsc1 ZINC000052804076 205135511 /nfs/dbraw/zinc/13/55/11/205135511.db2.gz WKBHDOVBMYDMIV-PGRDOPGGSA-N 1 1 397.588 4.054 50 0 GIAAMO O=C(c1cccc(C(F)(F)F)c1)[C@H]1CCC[N@@H+](Cc2cccc3nonc32)C1 ZINC000055054748 205142241 /nfs/dbraw/zinc/14/22/41/205142241.db2.gz ICHGLWRIHILTNB-HNNXBMFYSA-N 1 1 389.377 4.337 50 0 GIAAMO CCOc1cc2c(cc1OCC)-n1cccc1[C@H](c1ccc(OC)c(O)c1)[NH2+]C2 ZINC000055214731 205144681 /nfs/dbraw/zinc/14/46/81/205144681.db2.gz NJPVIOQQGAERBP-QHCPKHFHSA-N 1 1 394.471 4.182 50 0 GIAAMO C[C@H]([NH2+]Cc1c(C(=O)N2CCCC2)nc2sccn12)c1ccccc1Cl ZINC000055200021 205145768 /nfs/dbraw/zinc/14/57/68/205145768.db2.gz WRAOXMNVRHQLKW-ZDUSSCGKSA-N 1 1 388.924 4.136 50 0 GIAAMO C[C@@H]1CCCC[N@H+]1CCCCNC(=O)N[C@@H]1CCOc2c(Cl)cccc21 ZINC000056805640 205151672 /nfs/dbraw/zinc/15/16/72/205151672.db2.gz HZDIRMRLWZSYKE-CRAIPNDOSA-N 1 1 379.932 4.117 50 0 GIAAMO CCc1ccc2c(C[N@H+]3CCC[C@H]3c3ccc4c(c3)OCCO4)cc(=O)oc2c1 ZINC000057457210 205158248 /nfs/dbraw/zinc/15/82/48/205158248.db2.gz FMOYXLYYMDPDTG-FQEVSTJZSA-N 1 1 391.467 4.464 50 0 GIAAMO COc1ccccc1[C@@H](CNC(=O)Nc1ccc(-c2nccs2)cc1)[NH+](C)C ZINC000058174743 205166964 /nfs/dbraw/zinc/16/69/64/205166964.db2.gz GKVCUSIUGQRJIY-GOSISDBHSA-N 1 1 396.516 4.243 50 0 GIAAMO Cc1ccccc1[C@H]1CC(=O)N(C[N@@H+]2CCC[C@H](c3nc4ccccc4o3)C2)C1 ZINC000058175415 205168130 /nfs/dbraw/zinc/16/81/30/205168130.db2.gz OBOFGLUVINSUBG-OALUTQOASA-N 1 1 389.499 4.289 50 0 GIAAMO Cc1ccccc1[C@H]1CC(=O)N(C[N@H+]2CCC[C@H](c3nc4ccccc4o3)C2)C1 ZINC000058175415 205168131 /nfs/dbraw/zinc/16/81/31/205168131.db2.gz OBOFGLUVINSUBG-OALUTQOASA-N 1 1 389.499 4.289 50 0 GIAAMO C[C@@H]1CCC[N@@H+](Cc2ccc(CNC(=O)c3coc(Br)c3)cc2)C1 ZINC000058949417 205179021 /nfs/dbraw/zinc/17/90/21/205179021.db2.gz PAUNOIYPURAIQP-CQSZACIVSA-N 1 1 391.309 4.204 50 0 GIAAMO CCc1ccccc1NC(=O)C[NH+]1CCC(c2nc(-c3ccccc3)no2)CC1 ZINC000065184099 205215425 /nfs/dbraw/zinc/21/54/25/205215425.db2.gz NBXFAVWYGDEDQC-UHFFFAOYSA-N 1 1 390.487 4.117 50 0 GIAAMO CC[C@@H](NC(=O)C1=CC[N@@H+](Cc2ccc(F)cc2)CC1)c1ccc(OC)cc1 ZINC000064818067 205196710 /nfs/dbraw/zinc/19/67/10/205196710.db2.gz SESOWYYHEUYOAK-JOCHJYFZSA-N 1 1 382.479 4.234 50 0 GIAAMO CC[C@@H](C(=O)N1CC[NH+]=C1N1CCC(Cc2ccccc2)CC1)c1ccccc1 ZINC000065306485 205227308 /nfs/dbraw/zinc/22/73/08/205227308.db2.gz WVZSISQZSPMELX-HSZRJFAPSA-N 1 1 389.543 4.333 50 0 GIAAMO Cc1ccc(-c2cc([C@H]3CC[N@@H+](Cc4cncnc4)C3)ccn2)c2cccnc12 ZINC000065530593 205238599 /nfs/dbraw/zinc/23/85/99/205238599.db2.gz PYFMAMAHMOIXIC-FQEVSTJZSA-N 1 1 381.483 4.385 50 0 GIAAMO c1cnn(Cc2cccc(-c3c(-c4ccccc4)ncn3Cc3[nH]cc[nH+]3)c2)c1 ZINC000067459562 205248900 /nfs/dbraw/zinc/24/89/00/205248900.db2.gz KTEOSTWQFMGMCL-UHFFFAOYSA-N 1 1 380.455 4.233 50 0 GIAAMO Cc1ccc([C@H](Cn2cnc(-c3ccccc3)c2-c2[nH]cnc2C)[NH+](C)C)o1 ZINC000067820493 205262908 /nfs/dbraw/zinc/26/29/08/205262908.db2.gz DKKCQJAJLPKUGB-SFHVURJKSA-N 1 1 375.476 4.453 50 0 GIAAMO COc1ccc(-c2ncc(C[NH2+][C@H](C)c3cnn(-c4ccccc4)c3C)cn2)cc1 ZINC000067431708 205247189 /nfs/dbraw/zinc/24/71/89/205247189.db2.gz YVWKDHZDRFKSBE-QGZVFWFLSA-N 1 1 399.498 4.497 50 0 GIAAMO COc1ccc2cc([C@@H]3CN(Cc4[nH+]cc(C)c(OC)c4C)CCO3)ccc2c1 ZINC000071748597 205289438 /nfs/dbraw/zinc/28/94/38/205289438.db2.gz DTBATCJZYGRBHJ-QHCPKHFHSA-N 1 1 392.499 4.442 50 0 GIAAMO CN(C)C(=O)c1cccc(CN2CCC[C@@H]2[C@@H]2CCC[N@H+]2Cc2ccccc2)c1 ZINC000071792458 205296776 /nfs/dbraw/zinc/29/67/76/205296776.db2.gz UVYRWEOXXMGJIK-BJKOFHAPSA-N 1 1 391.559 4.017 50 0 GIAAMO CCS[C@H]1CC[C@H]([N@@H+](C)CC(=O)Nc2ccc(Br)cc2C)C1 ZINC000072305262 205322521 /nfs/dbraw/zinc/32/25/21/205322521.db2.gz HSJTYKXMCBXAAS-GJZGRUSLSA-N 1 1 385.371 4.302 50 0 GIAAMO C/C(=C\c1ccccc1)C[N@H+]1CCCn2nc(CN3CCC(F)CC3)cc2C1 ZINC000072168607 205315975 /nfs/dbraw/zinc/31/59/75/205315975.db2.gz OPWGYZSTJGUZDG-XMHGGMMESA-N 1 1 382.527 4.126 50 0 GIAAMO CC(C)[C@@H]1CN(C(=O)c2cc(C3CC3)on2)CCC[N@H+]1Cc1ccc(F)cc1 ZINC000072164564 205316466 /nfs/dbraw/zinc/31/64/66/205316466.db2.gz KTTOSOWRQPYNLA-FQEVSTJZSA-N 1 1 385.483 4.064 50 0 GIAAMO COc1cccc([C@H](C)[N@H+](C)CC(=O)Nc2ccc(Br)cc2C)c1 ZINC000072276970 205320441 /nfs/dbraw/zinc/32/04/41/205320441.db2.gz UWGUKMUYBURXGS-AWEZNQCLSA-N 1 1 391.309 4.398 50 0 GIAAMO COc1cccc([C@H](C)[N@@H+](C)CC(=O)Nc2ccc(Br)cc2C)c1 ZINC000072276970 205320445 /nfs/dbraw/zinc/32/04/45/205320445.db2.gz UWGUKMUYBURXGS-AWEZNQCLSA-N 1 1 391.309 4.398 50 0 GIAAMO Cc1ccc2nc(-c3ccc(F)cc3)c(C[N@H+]3CCC[C@@H](C(N)=O)C3)cc2c1 ZINC000072463865 205353779 /nfs/dbraw/zinc/35/37/79/205353779.db2.gz VJUCCCFWFQYZHX-QGZVFWFLSA-N 1 1 377.463 4.047 50 0 GIAAMO COCCN(CCc1ccccc1)C[C@@H]1CCC[N@@H+](C2Cc3ccccc3C2)C1 ZINC000015076690 205356639 /nfs/dbraw/zinc/35/66/39/205356639.db2.gz DJTUYQGHBQFPFG-QHCPKHFHSA-N 1 1 392.587 4.057 50 0 GIAAMO COCCN(CCc1ccccc1)C[C@@H]1CCC[N@H+](C2Cc3ccccc3C2)C1 ZINC000015076690 205356643 /nfs/dbraw/zinc/35/66/43/205356643.db2.gz DJTUYQGHBQFPFG-QHCPKHFHSA-N 1 1 392.587 4.057 50 0 GIAAMO COc1ccc(-c2nc3c(C)cccc3cc2C[N@H+]2CCC[C@H](O)C2)cc1OC ZINC000072407858 205345009 /nfs/dbraw/zinc/34/50/09/205345009.db2.gz MHCQDKFDEIQXLU-FQEVSTJZSA-N 1 1 392.499 4.184 50 0 GIAAMO Cc1cccc(-c2nc3cc(C)ccc3cc2C[N@H+]2C[C@@H]3C(=O)NC(=O)[C@@H]3C2)c1 ZINC000072421739 205348609 /nfs/dbraw/zinc/34/86/09/205348609.db2.gz DXKQGJZGNMYPCR-BGYRXZFFSA-N 1 1 385.467 4.063 50 0 GIAAMO CC[C@H]1C[N@H+](Cc2cn(C)nc2-c2ccc(Oc3ccccc3)cc2)CCO1 ZINC000072423623 205349470 /nfs/dbraw/zinc/34/94/70/205349470.db2.gz CIFUBZCNTZMOAU-FQEVSTJZSA-N 1 1 377.488 4.490 50 0 GIAAMO CC[C@H]1C[N@@H+](Cc2cn(C)nc2-c2ccc(Oc3ccccc3)cc2)CCO1 ZINC000072423623 205349474 /nfs/dbraw/zinc/34/94/74/205349474.db2.gz CIFUBZCNTZMOAU-FQEVSTJZSA-N 1 1 377.488 4.490 50 0 GIAAMO Cc1c(-c2ccc(Cl)cc2)n[nH]c1C(=O)N[C@@H]1CCCC[N@@H+](CC2CC2)C1 ZINC000082099749 205385058 /nfs/dbraw/zinc/38/50/58/205385058.db2.gz BBOJVGYKQFKTJC-GOSISDBHSA-N 1 1 386.927 4.033 50 0 GIAAMO Cn1cc(Cl)cc1C(=O)N1CC[NH+](C(c2ccccc2)c2ccccc2)CC1 ZINC000027027454 206008721 /nfs/dbraw/zinc/00/87/21/206008721.db2.gz YVGNVTLERUTVMA-UHFFFAOYSA-N 1 1 393.918 4.226 50 0 GIAAMO OCCC[N@H+](Cc1cn(-c2ccccc2)nc1-c1ccccc1)Cc1ccccn1 ZINC000225519602 206056041 /nfs/dbraw/zinc/05/60/41/206056041.db2.gz XVGFAUVTQPBHGS-UHFFFAOYSA-N 1 1 398.510 4.319 50 0 GIAAMO OCCC[N@@H+](Cc1cn(-c2ccccc2)nc1-c1ccccc1)Cc1ccccn1 ZINC000225519602 206056047 /nfs/dbraw/zinc/05/60/47/206056047.db2.gz XVGFAUVTQPBHGS-UHFFFAOYSA-N 1 1 398.510 4.319 50 0 GIAAMO O=C(c1csc(-c2ccccc2)n1)N1CC[C@H]([N@H+]2CCc3ccccc3C2)C1 ZINC000225687590 206068239 /nfs/dbraw/zinc/06/82/39/206068239.db2.gz DCYCHXZSKZEIKQ-FQEVSTJZSA-N 1 1 389.524 4.083 50 0 GIAAMO C[NH+](C)[C@H](CNC(=O)c1ccc(OC(F)(F)F)cc1)c1ccccc1Cl ZINC000032988578 206098106 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GIAAMO C[N@@H+](CCSc1nnc(C2CC2)n1Cc1ccccc1)Cc1ccccc1 ZINC000241435190 206126197 /nfs/dbraw/zinc/12/61/97/206126197.db2.gz NLMXTHIOZUWCOF-UHFFFAOYSA-N 1 1 378.545 4.428 50 0 GIAAMO CCn1c(C[N@@H+]2CCC[C@H](C(=O)Nc3ccccc3F)C2)nc2ccccc21 ZINC000249698260 206138093 /nfs/dbraw/zinc/13/80/93/206138093.db2.gz VTCICIQRIFUFEX-INIZCTEOSA-N 1 1 380.467 4.046 50 0 GIAAMO CCn1c(C[N@H+]2CCC[C@H](C(=O)Nc3ccccc3F)C2)nc2ccccc21 ZINC000249698260 206138098 /nfs/dbraw/zinc/13/80/98/206138098.db2.gz VTCICIQRIFUFEX-INIZCTEOSA-N 1 1 380.467 4.046 50 0 GIAAMO COc1cccc(OC[C@@H]2CCC[N@H+](Cc3nnc(-c4ccccc4)o3)C2)c1 ZINC000244678980 206130344 /nfs/dbraw/zinc/13/03/44/206130344.db2.gz INJHBRKWFAELKX-QGZVFWFLSA-N 1 1 379.460 4.036 50 0 GIAAMO COc1cccc(OC[C@@H]2CCC[N@@H+](Cc3nnc(-c4ccccc4)o3)C2)c1 ZINC000244678980 206130349 /nfs/dbraw/zinc/13/03/49/206130349.db2.gz INJHBRKWFAELKX-QGZVFWFLSA-N 1 1 379.460 4.036 50 0 GIAAMO O=C([C@H]1C[C@@H](c2ccccc2)[N@H+]2CCC[C@H]12)N1CCC(Cc2cccnc2)CC1 ZINC000299798464 206191480 /nfs/dbraw/zinc/19/14/80/206191480.db2.gz SKMOLOZVWPKLGX-VXNXHJTFSA-N 1 1 389.543 4.088 50 0 GIAAMO c1ccc([C@@H]2C[C@H](c3noc(-c4ccc5c(c4)OCO5)n3)[C@H]3CCC[N@@H+]32)cc1 ZINC000299803189 206193062 /nfs/dbraw/zinc/19/30/62/206193062.db2.gz ZPTAKKXFECAZAH-KSZLIROESA-N 1 1 375.428 4.158 50 0 GIAAMO COc1ccc(-c2nc(C[N@@H+](CC3CC3)C[C@H]3CCCO3)c(C)o2)c(OC)c1 ZINC000039429904 206193742 /nfs/dbraw/zinc/19/37/42/206193742.db2.gz PLHBQRDYHJOIEO-GOSISDBHSA-N 1 1 386.492 4.058 50 0 GIAAMO COc1ccc(NC(=O)[C@@H](c2ccccc2)N2CCC(CC[NH+](C)C)CC2)cc1 ZINC000124150849 206209249 /nfs/dbraw/zinc/20/92/49/206209249.db2.gz ODLJPHKPEOOBID-HSZRJFAPSA-N 1 1 395.547 4.039 50 0 GIAAMO COc1ccc(C[N@H+]2CCC[C@H](C(=O)c3cc(C)c(OC)c(C)c3)C2)cc1O ZINC000012075033 221148260 /nfs/dbraw/zinc/14/82/60/221148260.db2.gz HZSBECXDIMUALM-SFHVURJKSA-N 1 1 383.488 4.121 50 0 GIAAMO Cc1nc(C[N@@H+](C)C2CCN(c3cccc(-c4ccnc(C)n4)c3)CC2)cs1 ZINC000063834002 136156535 /nfs/dbraw/zinc/15/65/35/136156535.db2.gz RJKMKSPGLHRHIT-UHFFFAOYSA-N 1 1 393.560 4.318 50 0 GIAAMO Cc1nc(C[N@H+](C)C2CCN(c3cccc(-c4ccnc(C)n4)c3)CC2)cs1 ZINC000063834002 136156536 /nfs/dbraw/zinc/15/65/36/136156536.db2.gz RJKMKSPGLHRHIT-UHFFFAOYSA-N 1 1 393.560 4.318 50 0 GIAAMO CC(C)c1cccc(N2CCC[C@]3(CCC(=O)N(Cc4cccnc4)C3)C2)[nH+]1 ZINC000072409000 136169709 /nfs/dbraw/zinc/16/97/09/136169709.db2.gz PORFVEDZNBUFBT-QHCPKHFHSA-N 1 1 378.520 4.009 50 0 GIAAMO c1[nH]nc(C2CCCCC2)c1C[N@H+]1CCCC12CCN(c1ccccn1)CC2 ZINC000072425609 136169891 /nfs/dbraw/zinc/16/98/91/136169891.db2.gz UXUMOOUAPGDKMT-UHFFFAOYSA-N 1 1 379.552 4.487 50 0 GIAAMO c1cn(Cc2cscn2)c(C2CCN(c3nccc4ccccc43)CC2)[nH+]1 ZINC000095499175 136179669 /nfs/dbraw/zinc/17/96/69/136179669.db2.gz DCKFZNFRZCVTPT-UHFFFAOYSA-N 1 1 375.501 4.320 50 0 GIAAMO CCCc1cnc(C)nc1N1CCC([NH2+][C@H](C)c2nc3ccc(C)cc3[nH]2)CC1 ZINC000095388906 535437005 /nfs/dbraw/zinc/43/70/05/535437005.db2.gz AYBWPNXBDSKQEV-MRXNPFEDSA-N 1 1 392.551 4.242 50 0 GIAAMO COc1ccc(-c2nc3c([nH]2)C[N@H+](CCCC(=O)c2ccccc2)CC3)cc1 ZINC000096164403 570217725 /nfs/dbraw/zinc/21/77/25/570217725.db2.gz SDEWGWVYHNLMCR-UHFFFAOYSA-N 1 1 375.472 4.107 50 0 GIAAMO COc1ccc(-c2nc3c([nH]2)C[N@@H+](CCCC(=O)c2ccccc2)CC3)cc1 ZINC000096164403 570217728 /nfs/dbraw/zinc/21/77/28/570217728.db2.gz SDEWGWVYHNLMCR-UHFFFAOYSA-N 1 1 375.472 4.107 50 0 GIAAMO FC(F)(F)c1cccc(N2CCN([C@@H]3CCC[N@H+](C4CCCC4)C3)CC2)c1 ZINC000019774349 570218010 /nfs/dbraw/zinc/21/80/10/570218010.db2.gz AOGKAOUCTAPNMX-HXUWFJFHSA-N 1 1 381.486 4.234 50 0 GIAAMO Cc1cc(C)n(-c2ccc(NC(=O)NCCCn3cc[nH+]c3C(C)C)cc2)n1 ZINC000096166724 570218358 /nfs/dbraw/zinc/21/83/58/570218358.db2.gz JLTLNOBJOFJOFS-UHFFFAOYSA-N 1 1 380.496 4.021 50 0 GIAAMO CC[N@H+]1C[C@@H](c2ccccc2)CC2(CCN(C(=O)c3cnc(C)cc3C)CC2)C1 ZINC000096180507 570218820 /nfs/dbraw/zinc/21/88/20/570218820.db2.gz RGKFSJQWOMHLDI-QFIPXVFZSA-N 1 1 391.559 4.430 50 0 GIAAMO O=C(c1ccc(C[N@H+]2CCc3ccccc3C2)cc1)N1CCc2ccccc2C1 ZINC000019812053 570221096 /nfs/dbraw/zinc/22/10/96/570221096.db2.gz PRRMPCMPCZIXTN-UHFFFAOYSA-N 1 1 382.507 4.443 50 0 GIAAMO FC(F)(F)Oc1ccc(C[NH+]2CCN(C/C=C/c3ccccc3)CC2)cc1 ZINC000019809317 570221310 /nfs/dbraw/zinc/22/13/10/570221310.db2.gz IACSMTJRCAGQAZ-QPJJXVBHSA-N 1 1 376.422 4.416 50 0 GIAAMO FC(F)(F)Oc1ccc(CN2CC[NH+](C/C=C/c3ccccc3)CC2)cc1 ZINC000019809317 570221314 /nfs/dbraw/zinc/22/13/14/570221314.db2.gz IACSMTJRCAGQAZ-QPJJXVBHSA-N 1 1 376.422 4.416 50 0 GIAAMO C[C@@H]1CCC[N@@H+](CCCNC(=O)c2ccc(N3CCc4ccccc43)s2)C1 ZINC000015732278 570223439 /nfs/dbraw/zinc/22/34/39/570223439.db2.gz WQTFUNSXKDMFPS-QGZVFWFLSA-N 1 1 383.561 4.294 50 0 GIAAMO O=C(c1ccc2c(c1)CCO2)N1CC[NH+](C(c2ccccc2)c2ccccc2)CC1 ZINC000019834805 570223795 /nfs/dbraw/zinc/22/37/95/570223795.db2.gz NMVXUZKMNVRNTP-UHFFFAOYSA-N 1 1 398.506 4.169 50 0 GIAAMO Cc1cccn2c(=O)cc(C[N@@H+]3CCC[C@@H]3c3cccc(Br)c3)nc12 ZINC000048355425 570244044 /nfs/dbraw/zinc/24/40/44/570244044.db2.gz DEHCGMYNICNMDJ-GOSISDBHSA-N 1 1 398.304 4.103 50 0 GIAAMO Cc1cccn2c(=O)cc(C[N@H+]3CCC[C@@H]3c3cccc(Br)c3)nc12 ZINC000048355425 570244045 /nfs/dbraw/zinc/24/40/45/570244045.db2.gz DEHCGMYNICNMDJ-GOSISDBHSA-N 1 1 398.304 4.103 50 0 GIAAMO COc1ccccc1N1CCN([C@H]2CCC[N@H+](Cc3ccc(Cl)cc3)C2)CC1 ZINC000020212096 570248663 /nfs/dbraw/zinc/24/86/63/570248663.db2.gz FUYNFWCQALOYBN-NRFANRHFSA-N 1 1 399.966 4.135 50 0 GIAAMO COc1ccccc1N1CCN([C@H]2CCC[N@@H+](Cc3ccc(Cl)cc3)C2)CC1 ZINC000020212096 570248664 /nfs/dbraw/zinc/24/86/64/570248664.db2.gz FUYNFWCQALOYBN-NRFANRHFSA-N 1 1 399.966 4.135 50 0 GIAAMO O=C1CC[N@@H+](Cc2nc(-c3ccccc3)cs2)CCN1Cc1ccc(F)cc1 ZINC000020363670 570253426 /nfs/dbraw/zinc/25/34/26/570253426.db2.gz PEHUESXZEYRVCE-UHFFFAOYSA-N 1 1 395.503 4.184 50 0 GIAAMO O=C1CC[N@H+](Cc2nc(-c3ccccc3)cs2)CCN1Cc1ccc(F)cc1 ZINC000020363670 570253428 /nfs/dbraw/zinc/25/34/28/570253428.db2.gz PEHUESXZEYRVCE-UHFFFAOYSA-N 1 1 395.503 4.184 50 0 GIAAMO C/C=C/c1ccc(OCCC[NH+]2CCN(Cc3ccccc3)CC2)c(OC)c1 ZINC000020482210 570261853 /nfs/dbraw/zinc/26/18/53/570261853.db2.gz RVWGEPAKEOPMKL-FPYGCLRLSA-N 1 1 380.532 4.315 50 0 GIAAMO CC(C)N1CCC([N@H+]2CCC[C@H](C(=O)c3ccc(C(F)(F)F)cc3)C2)CC1 ZINC000020514659 570264847 /nfs/dbraw/zinc/26/48/47/570264847.db2.gz GCGLEWATFRVLAL-KRWDZBQOSA-N 1 1 382.470 4.473 50 0 GIAAMO CC(C)[NH+]1CCC(N2CCC[C@H](C(=O)c3ccc(C(F)(F)F)cc3)C2)CC1 ZINC000020514659 570264850 /nfs/dbraw/zinc/26/48/50/570264850.db2.gz GCGLEWATFRVLAL-KRWDZBQOSA-N 1 1 382.470 4.473 50 0 GIAAMO CCc1cc(C[NH2+]Cc2cn(-c3cccc(F)c3)nc2-c2ccc(C)o2)on1 ZINC000020599006 570269621 /nfs/dbraw/zinc/26/96/21/570269621.db2.gz RWARYCJGQSPIRA-UHFFFAOYSA-N 1 1 380.423 4.420 50 0 GIAAMO C[C@@H](C[N@@H+](C)Cc1ccccc1)OC(=O)COc1ccc(Cl)cc1Cl ZINC000002180657 570277447 /nfs/dbraw/zinc/27/74/47/570277447.db2.gz WXMUZYHQKYNBOO-AWEZNQCLSA-N 1 1 382.287 4.436 50 0 GIAAMO C[N@@H+](CC[C@@H]1CCCCO1)Cc1cccc(-c2nc(C(F)(F)F)cc(=O)[nH]2)c1 ZINC000020774465 570279883 /nfs/dbraw/zinc/27/98/83/570279883.db2.gz GZJNKRHIPQQPLI-INIZCTEOSA-N 1 1 395.425 4.259 50 0 GIAAMO Cc1ccccc1-c1cccc(C[N@@H+]2CCc3nnc([C@@H]4CCCO4)n3CC2)c1 ZINC000020920466 570284860 /nfs/dbraw/zinc/28/48/60/570284860.db2.gz SGJHOCWINAWNOD-QFIPXVFZSA-N 1 1 388.515 4.163 50 0 GIAAMO COc1ccc(-c2n[nH]cc2C[N@H+]2CCC[C@H]2c2c(C)noc2C)cc1OC ZINC000021719935 570294876 /nfs/dbraw/zinc/29/48/76/570294876.db2.gz VOCJPGXBMUBZCN-KRWDZBQOSA-N 1 1 382.464 4.036 50 0 GIAAMO COc1ccccc1[C@H](CNC(=O)c1cc(-c2ccc(Cl)cc2)on1)[NH+](C)C ZINC000021805462 570296711 /nfs/dbraw/zinc/29/67/11/570296711.db2.gz GLSCMCFYVXHRFO-SFHVURJKSA-N 1 1 399.878 4.036 50 0 GIAAMO CC[C@@H](C)NC(=O)c1cccc(C[NH+]2CCN(c3ccc(Cl)cc3)CC2)c1 ZINC000034684582 570301904 /nfs/dbraw/zinc/30/19/04/570301904.db2.gz YSYIGGIXQYLELP-QGZVFWFLSA-N 1 1 385.939 4.191 50 0 GIAAMO COc1cc(CN2CC[NH+](Cc3ccc(C(F)(F)F)cc3)CC2)cc(OC)c1 ZINC000022035619 570302525 /nfs/dbraw/zinc/30/25/25/570302525.db2.gz NQNSVHIOBJBNKW-UHFFFAOYSA-N 1 1 394.437 4.040 50 0 GIAAMO Cc1ccc(C)c(-c2n[nH]cc2C[N@H+]2CCC[C@@H](OCc3ccccn3)C2)c1 ZINC000216530752 570303073 /nfs/dbraw/zinc/30/30/73/570303073.db2.gz IDNXWKQSHHOUAU-OAQYLSRUSA-N 1 1 376.504 4.270 50 0 GIAAMO COc1cc(C[NH2+]CCCN(C)C)ccc1OCc1ccc(F)cc1Cl ZINC000002874811 570314506 /nfs/dbraw/zinc/31/45/06/570314506.db2.gz ISJAYBNGYSGENB-UHFFFAOYSA-N 1 1 380.891 4.108 50 0 GIAAMO O=C(CN1CC[NH+](Cc2cccs2)CC1)Nc1ccccc1-c1ccccc1 ZINC000022784196 570327442 /nfs/dbraw/zinc/32/74/42/570327442.db2.gz SYWHTNOUBGVBOI-UHFFFAOYSA-N 1 1 391.540 4.171 50 0 GIAAMO CCOc1cccc(CNC[C@@H]2CCC[N@H+]2CC)c1OCc1ccccc1F ZINC000022936973 570338561 /nfs/dbraw/zinc/33/85/61/570338561.db2.gz YPSKILPOOMOMSE-FQEVSTJZSA-N 1 1 386.511 4.377 50 0 GIAAMO CCOc1cccc(C[NH2+]C[C@@H]2CCCN2CC)c1OCc1ccccc1F ZINC000022936973 570338563 /nfs/dbraw/zinc/33/85/63/570338563.db2.gz YPSKILPOOMOMSE-FQEVSTJZSA-N 1 1 386.511 4.377 50 0 GIAAMO CCC(=O)N[C@@H](C)[C@@H]1c2cc(OC)c(OC)cc2CC[N@H+]1Cc1ccc(C)cc1 ZINC000034855497 570341525 /nfs/dbraw/zinc/34/15/25/570341525.db2.gz RDNCJWOKSNUJBH-BXKMTCNYSA-N 1 1 396.531 4.026 50 0 GIAAMO CCC(=O)N[C@@H](C)[C@@H]1c2cc(OC)c(OC)cc2CC[N@@H+]1Cc1ccc(C)cc1 ZINC000034855497 570341527 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GIAAMO CCOc1cc(CNCC[NH+](C)C)cc(Cl)c1OCc1ccccc1F ZINC000022075707 207246894 /nfs/dbraw/zinc/24/68/94/207246894.db2.gz AVWOJSVJBRPZDQ-UHFFFAOYSA-N 1 1 380.891 4.108 50 0 GIAAMO CC[N@@H+](Cc1ccncc1)[C@H]1CCCN(Cc2ccc(OC(F)F)cc2)C1 ZINC000022913023 207263425 /nfs/dbraw/zinc/26/34/25/207263425.db2.gz FOOFNFMNWSUOMZ-IBGZPJMESA-N 1 1 375.463 4.170 50 0 GIAAMO CCN(Cc1ccncc1)[C@H]1CCC[N@H+](Cc2ccc(OC(F)F)cc2)C1 ZINC000022913023 207263428 /nfs/dbraw/zinc/26/34/28/207263428.db2.gz FOOFNFMNWSUOMZ-IBGZPJMESA-N 1 1 375.463 4.170 50 0 GIAAMO CCN(Cc1ccncc1)[C@H]1CCC[N@@H+](Cc2ccc(OC(F)F)cc2)C1 ZINC000022913023 207263430 /nfs/dbraw/zinc/26/34/30/207263430.db2.gz FOOFNFMNWSUOMZ-IBGZPJMESA-N 1 1 375.463 4.170 50 0 GIAAMO CC[C@@H](C)c1ccccc1NC(=O)[C@@H](C)N1CC[NH+](Cc2ccccc2)CC1 ZINC000022773287 207261564 /nfs/dbraw/zinc/26/15/64/207261564.db2.gz DTKHTJQCLLDDIE-WOJBJXKFSA-N 1 1 379.548 4.345 50 0 GIAAMO Fc1ccc(N2CCN([C@H]3CCC[N@H+](Cc4cccc(Cl)c4)C3)CC2)cc1 ZINC000023373579 207276620 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O[C@@H](C[N@H+]1CCCN(Cc2ccc(C(F)(F)F)cc2)CC1)c1ccc(F)cc1 ZINC000028260654 207338790 /nfs/dbraw/zinc/33/87/90/207338790.db2.gz JBHHHGAIYZWTAK-FQEVSTJZSA-N 1 1 396.428 4.086 50 0 GIAAMO O[C@@H](CN1CCC[N@H+](Cc2ccc(C(F)(F)F)cc2)CC1)c1ccc(F)cc1 ZINC000028260654 207338793 /nfs/dbraw/zinc/33/87/93/207338793.db2.gz JBHHHGAIYZWTAK-FQEVSTJZSA-N 1 1 396.428 4.086 50 0 GIAAMO O[C@@H](CN1CCC[N@@H+](Cc2ccc(C(F)(F)F)cc2)CC1)c1ccc(F)cc1 ZINC000028260654 207338798 /nfs/dbraw/zinc/33/87/98/207338798.db2.gz JBHHHGAIYZWTAK-FQEVSTJZSA-N 1 1 396.428 4.086 50 0 GIAAMO Cc1ccccc1-c1nn(-c2ccc(F)cc2F)cc1C[N@H+](C)CC1(CO)CC1 ZINC000072410478 208018081 /nfs/dbraw/zinc/01/80/81/208018081.db2.gz KRTCXBJDPWJIHM-UHFFFAOYSA-N 1 1 397.469 4.330 50 0 GIAAMO Cc1nnc2n1CC[N@H+](Cc1cc3ccc(C)cc3nc1-c1cccs1)CC2 ZINC000072410095 208018835 /nfs/dbraw/zinc/01/88/35/208018835.db2.gz RUSFDKYBABJPQY-UHFFFAOYSA-N 1 1 389.528 4.230 50 0 GIAAMO COc1ccc2cc(C[N@@H+]3CC[C@@H](N(C)C)C3)c(-c3cccc(C)c3)nc2c1 ZINC000072419866 208019061 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CCc1cccc2c(C(=O)C[NH+]3CCC(C(=O)N4CCCCCC4)CC3)c[nH]c21 ZINC000057312648 823278875 /nfs/dbraw/zinc/27/88/75/823278875.db2.gz DHAKZBGZTUICME-UHFFFAOYSA-N 1 1 395.547 4.028 50 0 GIAAMO CCOC(=O)[C@@H]1CCC[N@@H+]([C@H](C(=O)Nc2cc(C)ccc2C)c2ccccc2)C1 ZINC000057315438 823279119 /nfs/dbraw/zinc/27/91/19/823279119.db2.gz YBFSBXNITICVDK-IRLDBZIGSA-N 1 1 394.515 4.258 50 0 GIAAMO CCOC(=O)[C@@H]1CCC[N@H+]([C@H](C(=O)Nc2cc(C)ccc2C)c2ccccc2)C1 ZINC000057315438 823279122 /nfs/dbraw/zinc/27/91/22/823279122.db2.gz YBFSBXNITICVDK-IRLDBZIGSA-N 1 1 394.515 4.258 50 0 GIAAMO COc1ccc(C[NH2+][C@@H]2C3=C(CCCC3)C(=O)N2Cc2ccc(F)cc2)cc1 ZINC000057466648 823300418 /nfs/dbraw/zinc/30/04/18/823300418.db2.gz XPGGCYMVFSDWPK-QFIPXVFZSA-N 1 1 380.463 4.163 50 0 GIAAMO Cc1nn(-c2ccccc2)c(C)c1NC(=O)C[N@@H+](C)Cc1ccc(C)cc1C ZINC000007920821 817958645 /nfs/dbraw/zinc/95/86/45/817958645.db2.gz QKFIETSPYNNQHY-UHFFFAOYSA-N 1 1 376.504 4.176 50 0 GIAAMO Cc1nn(-c2ccccc2)c(C)c1NC(=O)C[N@H+](C)Cc1ccc(C)cc1C ZINC000007920821 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389.923 4.174 50 0 GIAAMO COc1ccc(-c2n[nH]cc2C[N@H+]2CCCC[C@@H]2c2cccnc2)c(OC)c1 ZINC000012299804 818153043 /nfs/dbraw/zinc/15/30/43/818153043.db2.gz KDWVGWIYDWJKDQ-HXUWFJFHSA-N 1 1 378.476 4.216 50 0 GIAAMO COc1ccc(NC(=O)N[C@@H]2CCC[N@H+](C3CCCCCC3)C2)cc1OC ZINC000012300552 818153175 /nfs/dbraw/zinc/15/31/75/818153175.db2.gz SJAKMYALMVGWDA-QGZVFWFLSA-N 1 1 375.513 4.013 50 0 GIAAMO O=C(NC[C@H]1CCC[N@@H+](Cc2cccc(OC3CCCC3)c2)C1)c1cccnc1 ZINC000012440368 818160100 /nfs/dbraw/zinc/16/01/00/818160100.db2.gz VLPLTQOSFSBCGM-HXUWFJFHSA-N 1 1 393.531 4.045 50 0 GIAAMO CCOCc1cc(C[N@H+]2CCC[C@@](CO)(Cc3ccccc3)C2)ccc1OC ZINC000012593967 818169328 /nfs/dbraw/zinc/16/93/28/818169328.db2.gz NOYWGRMNWLPARU-XMMPIXPASA-N 1 1 383.532 4.049 50 0 GIAAMO Cc1nc(C[N@H+](C)[C@H]2CCC(=O)N(Cc3ccc(Cl)cc3)CC2)cs1 ZINC000014994623 818281548 /nfs/dbraw/zinc/28/15/48/818281548.db2.gz IVTKKRMQHXAANW-SFHVURJKSA-N 1 1 377.941 4.118 50 0 GIAAMO Cc1[nH]c2c(C)c(Cl)ccc2c(=O)c1CN1CC[NH+](Cc2ccccc2)CC1 ZINC000019793265 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380.444 4.144 50 0 GIAAMO CC[C@@](C)(CNC(=O)Nc1ccc(SC2CCCC2)cc1)[NH+]1CCOCC1 ZINC000040105008 821138299 /nfs/dbraw/zinc/13/82/99/821138299.db2.gz DEMPLNRYRONKPT-NRFANRHFSA-N 1 1 391.581 4.344 50 0 GIAAMO C[N@@H+](Cc1cccs1)Cc1ccc(-c2nc(-c3cccnc3)cc(=O)[nH]2)cc1 ZINC000048170804 822642001 /nfs/dbraw/zinc/64/20/01/822642001.db2.gz XVDISPLVSGUPBA-UHFFFAOYSA-N 1 1 388.496 4.192 50 0 GIAAMO CC[NH+]1CCN(C(=O)c2cc(-c3ccccn3)nc3c(C)c(Cl)ccc23)CC1 ZINC000055058887 822935927 /nfs/dbraw/zinc/93/59/27/822935927.db2.gz QEDGSKXHCZECQR-UHFFFAOYSA-N 1 1 394.906 4.036 50 0 GIAAMO O=C(CC[C@H]1CCCOC1)NC1CC[NH+](Cc2ccc(Cl)c(Cl)c2)CC1 ZINC000175609537 823006061 /nfs/dbraw/zinc/00/60/61/823006061.db2.gz IBXYEQUGIXLSQM-OAHLLOKOSA-N 1 1 399.362 4.281 50 0 GIAAMO CC(C)NC(=O)c1ccccc1OC[C@@H]1CCC[N@@H+](Cc2ccc(F)cc2)C1 ZINC000169765060 823914051 /nfs/dbraw/zinc/91/40/51/823914051.db2.gz MOPOAMXFRDTPKX-LJQANCHMSA-N 1 1 384.495 4.255 50 0 GIAAMO c1ccc(-c2nc(-c3ccc(O[C@H]4CC[N@H+](Cc5ccncc5)C4)cc3)no2)cc1 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O=C(C[N@@H+]1CCC[C@H]1c1cccs1)N1c2ccccc2NC(=O)C12CCCC2 ZINC000008937106 206768914 /nfs/dbraw/zinc/76/89/14/206768914.db2.gz QUERBRVKZGMMMA-SFHVURJKSA-N 1 1 395.528 4.183 50 0 GIAAMO O=C(C[N@H+]1CCC[C@H]1c1cccs1)N1c2ccccc2NC(=O)C12CCCC2 ZINC000008937106 206768920 /nfs/dbraw/zinc/76/89/20/206768920.db2.gz QUERBRVKZGMMMA-SFHVURJKSA-N 1 1 395.528 4.183 50 0 GIAAMO COc1cc(NC(=O)CC[C@@H]2CCC[N@H+](C3CCSCC3)C2)cc(OC)c1 ZINC000011947512 206844589 /nfs/dbraw/zinc/84/45/89/206844589.db2.gz UZLSVYIFTCEYFB-INIZCTEOSA-N 1 1 392.565 4.030 50 0 GIAAMO COc1ccc(-c2noc(C[NH+]3CCC(Cc4ccccc4F)CC3)n2)cc1 ZINC000012208064 206871928 /nfs/dbraw/zinc/87/19/28/206871928.db2.gz TYSAJGIZPSVKJV-UHFFFAOYSA-N 1 1 381.451 4.339 50 0 GIAAMO O=C(/C=C/c1ccncc1)N1CC[C@]2(C1)CCC[N@@H+](CCCc1ccccc1)C2 ZINC000012449493 206899926 /nfs/dbraw/zinc/89/99/26/206899926.db2.gz PUJVJZKNFRXGIX-YHZGQTRVSA-N 1 1 389.543 4.042 50 0 GIAAMO COc1ccc(-c2cc(C[NH+]3CCN(c4cccc(Cl)c4)CC3)on2)cc1 ZINC000012556343 206912862 /nfs/dbraw/zinc/91/28/62/206912862.db2.gz DQYXQKFHGSCFBS-UHFFFAOYSA-N 1 1 383.879 4.326 50 0 GIAAMO Cc1onc(-c2ccccc2Cl)c1C(=O)NC[C@@H](c1ccco1)[NH+]1CCCC1 ZINC000014251085 207019117 /nfs/dbraw/zinc/01/91/17/207019117.db2.gz ZODPCTCAGWOKGZ-KRWDZBQOSA-N 1 1 399.878 4.463 50 0 GIAAMO Cc1onc(-c2ccccc2Cl)c1C(=O)NC[C@H](c1ccco1)[NH+]1CCCC1 ZINC000014251083 207019829 /nfs/dbraw/zinc/01/98/29/207019829.db2.gz ZODPCTCAGWOKGZ-QGZVFWFLSA-N 1 1 399.878 4.463 50 0 GIAAMO CCCC[C@H]1C[N@H+](CCNC(=O)c2c(F)cccc2F)Cc2ccccc2O1 ZINC000014953357 207033702 /nfs/dbraw/zinc/03/37/02/207033702.db2.gz CXMLPFFFDKQUCE-KRWDZBQOSA-N 1 1 388.458 4.148 50 0 GIAAMO CCCC[C@H]1C[N@@H+](CCNC(=O)c2c(F)cccc2F)Cc2ccccc2O1 ZINC000014953357 207033705 /nfs/dbraw/zinc/03/37/05/207033705.db2.gz CXMLPFFFDKQUCE-KRWDZBQOSA-N 1 1 388.458 4.148 50 0 GIAAMO Cc1cnc(C(=O)N2CC[C@@]3(C2)CCC[N@H+](Cc2ccc(C(C)C)cc2)C3)cn1 ZINC000014959890 207035203 /nfs/dbraw/zinc/03/52/03/207035203.db2.gz LPLBZPBPLXIHJE-DEOSSOPVSA-N 1 1 392.547 4.037 50 0 GIAAMO CCN(C[C@@H]1CCC[N@@H+](CCc2cccc(OC)c2)C1)C(=O)c1ccccc1F ZINC000014965878 207035614 /nfs/dbraw/zinc/03/56/14/207035614.db2.gz OXPXXWSXUYABOX-HXUWFJFHSA-N 1 1 398.522 4.251 50 0 GIAAMO Cl/C(=C\c1ccccc1)C[N@@H+]1CCc2nnc(Cc3ccccc3)n2CC1 ZINC000014975075 207036299 /nfs/dbraw/zinc/03/62/99/207036299.db2.gz BRDXIJOHKGCNJS-HKWRFOASSA-N 1 1 378.907 4.007 50 0 GIAAMO C[N@H+]1CCC[C@@H](COc2cccc(CN(C(=O)C3CCCCC3)C3CC3)c2)C1 ZINC000014984962 207039608 /nfs/dbraw/zinc/03/96/08/207039608.db2.gz DRLXSSSNSMJJCD-HXUWFJFHSA-N 1 1 384.564 4.479 50 0 GIAAMO Cc1ccc(C[N@@H+]2CCC(=O)N(Cc3ccccc3C(F)(F)F)CC2)s1 ZINC000014881824 207030665 /nfs/dbraw/zinc/03/06/65/207030665.db2.gz ZHWPBIPJACAXOK-UHFFFAOYSA-N 1 1 382.451 4.310 50 0 GIAAMO COc1ccc(CC[N@H+]2CCC[C@H](CN(C)C(=O)Nc3ccccc3F)C2)cc1 ZINC000015076801 207046197 /nfs/dbraw/zinc/04/61/97/207046197.db2.gz XOKIGICAHNMAMV-LJQANCHMSA-N 1 1 399.510 4.253 50 0 GIAAMO O=C(c1ccnc(Cl)c1)N1CC[C@]2(C1)CCC[N@H+](Cc1ccc(F)cc1)C2 ZINC000015066301 207041773 /nfs/dbraw/zinc/04/17/73/207041773.db2.gz YNILWQLUZREWEI-OAQYLSRUSA-N 1 1 387.886 4.002 50 0 GIAAMO CCOC(=O)[C@]1(Cc2ccccc2)CCC[N@@H+](Cc2c(C)nc3sccn23)C1 ZINC000015074247 207044405 /nfs/dbraw/zinc/04/44/05/207044405.db2.gz DEHPLDBUVATIAC-QFIPXVFZSA-N 1 1 397.544 4.092 50 0 GIAAMO Cc1cc2oc(=O)cc(C[N@@H+](C)CCOc3ccc(F)cc3)c2cc1Cl ZINC000015101484 207048398 /nfs/dbraw/zinc/04/83/98/207048398.db2.gz QADFRRMTRRDVJT-UHFFFAOYSA-N 1 1 375.827 4.405 50 0 GIAAMO CCCn1c(Cn2cc[nH+]c2C)nc2cc(NC(=O)c3cccs3)ccc21 ZINC000015669146 207053635 /nfs/dbraw/zinc/05/36/35/207053635.db2.gz IDHCEFVCAUGWCD-UHFFFAOYSA-N 1 1 379.489 4.313 50 0 GIAAMO Cc1ccc(C)c(C[N@@H+]2CCc3nc(Nc4ccc5c(c4)OCO5)ncc3C2)c1 ZINC000015779174 207061080 /nfs/dbraw/zinc/06/10/80/207061080.db2.gz QLZDYKGJTWISJU-UHFFFAOYSA-N 1 1 388.471 4.124 50 0 GIAAMO Cc1ccc(C)c(C[N@H+]2CCc3nc(Nc4ccc5c(c4)OCO5)ncc3C2)c1 ZINC000015779174 207061084 /nfs/dbraw/zinc/06/10/84/207061084.db2.gz QLZDYKGJTWISJU-UHFFFAOYSA-N 1 1 388.471 4.124 50 0 GIAAMO Fc1cccc(-c2c[nH]nc2[C@@H]2CCC[N@@H+](Cc3cccc4c3OCO4)C2)c1 ZINC000019774463 207161074 /nfs/dbraw/zinc/16/10/74/207161074.db2.gz HQBSCYXQTZRBRR-MRXNPFEDSA-N 1 1 379.435 4.324 50 0 GIAAMO O=C1C[C@@H]([NH2+]Cc2ccc(Cl)c(Cl)c2)C(=O)N1c1ccc(Cl)cc1 ZINC000019790741 207161990 /nfs/dbraw/zinc/16/19/90/207161990.db2.gz GQPAOKMCZOXHDT-OAHLLOKOSA-N 1 1 383.662 4.069 50 0 GIAAMO Cc1ccccc1C[NH+]1CCN(C(=O)C(c2ccccc2)c2ccccc2)CC1 ZINC000019823658 207164214 /nfs/dbraw/zinc/16/42/14/207164214.db2.gz LGLZJIJFDSBMON-UHFFFAOYSA-N 1 1 384.523 4.471 50 0 GIAAMO CCOC(=O)N1CC[NH+]([C@@H](c2cccs2)c2c(C)[nH]c3ccccc32)CC1 ZINC000020191932 207181434 /nfs/dbraw/zinc/18/14/34/207181434.db2.gz RNUAYIUMCVOJLD-FQEVSTJZSA-N 1 1 383.517 4.401 50 0 GIAAMO c1ccc(N2CCN([C@@H]3CCC[N@H+](Cc4cccc5cccnc54)C3)CC2)cc1 ZINC000020204764 207182518 /nfs/dbraw/zinc/18/25/18/207182518.db2.gz DFANKQKBGLXRFS-XMMPIXPASA-N 1 1 386.543 4.021 50 0 GIAAMO O[C@@H](C[NH+]1CCN(c2cccc(C(F)(F)F)c2)CC1)c1cccc(Cl)c1 ZINC000020218828 207184939 /nfs/dbraw/zinc/18/49/39/207184939.db2.gz LHYOMQJJVQWXBT-SFHVURJKSA-N 1 1 384.829 4.214 50 0 GIAAMO OCC[C@H]1C[N@@H+](Cc2ccc(-c3ccco3)cc2)CCN1Cc1ccsc1 ZINC000020294204 207185796 /nfs/dbraw/zinc/18/57/96/207185796.db2.gz JHSBSXIBFOKABW-NRFANRHFSA-N 1 1 382.529 4.077 50 0 GIAAMO Cc1ccccc1-c1cccc(C[N@@H+]2CCC[C@H](N3CCC(CO)CC3)C2)c1 ZINC000020294929 207185930 /nfs/dbraw/zinc/18/59/30/207185930.db2.gz TVKJAKQEIOLNND-DEOSSOPVSA-N 1 1 378.560 4.331 50 0 GIAAMO Cc1ccccc1-c1cccc(C[N@H+]2CCC[C@H](N3CCC(CO)CC3)C2)c1 ZINC000020294929 207185935 /nfs/dbraw/zinc/18/59/35/207185935.db2.gz TVKJAKQEIOLNND-DEOSSOPVSA-N 1 1 378.560 4.331 50 0 GIAAMO Cc1cccc(N2CC[N@H+](Cc3cc(=O)oc4cc(C)cc(C)c34)C[C@H]2C)c1 ZINC000020408183 207191965 /nfs/dbraw/zinc/19/19/65/207191965.db2.gz YFUZCABQQDJMCB-LJQANCHMSA-N 1 1 376.500 4.429 50 0 biogenic,in-vitro GIAAMO Fc1ccc(-c2csc(N3CC[NH+](Cc4ccc5c(c4)OCO5)CC3)n2)cc1 ZINC000020479084 207195746 /nfs/dbraw/zinc/19/57/46/207195746.db2.gz KMXYCFWKWIOAFI-UHFFFAOYSA-N 1 1 397.475 4.000 50 0 GIAAMO O=C(Nc1ccccc1)N(CCC[NH+]1CCOCC1)Cc1ccccc1Cl ZINC000020523286 207200666 /nfs/dbraw/zinc/20/06/66/207200666.db2.gz PWVMRMZKYKZRBK-UHFFFAOYSA-N 1 1 387.911 4.096 50 0 GIAAMO Clc1cccc(C[N@H+]2CCC[C@H](c3nc4c5ccccc5ncn4n3)C2)c1 ZINC000020613946 207207071 /nfs/dbraw/zinc/20/70/71/207207071.db2.gz ATILTUOVPOZEQR-INIZCTEOSA-N 1 1 377.879 4.311 50 0 GIAAMO CCN(C[C@H]1CCC[N@@H+](CCc2cccc(OC)c2)C1)C(=O)CC1CCCC1 ZINC000020919174 207220169 /nfs/dbraw/zinc/22/01/69/207220169.db2.gz LHDBKRWWGHMFQP-QFIPXVFZSA-N 1 1 386.580 4.379 50 0 GIAAMO Cc1nc(N2CCCC2)cc(Nc2ccc(NC(=O)c3cccs3)cc2)[nH+]1 ZINC000021794227 207237522 /nfs/dbraw/zinc/23/75/22/207237522.db2.gz UHOFCGOKBFIEPR-UHFFFAOYSA-N 1 1 379.489 4.443 50 0 GIAAMO Cc1nc(Nc2ccc(NC(=O)c3cccs3)cc2)cc(N2CCCC2)[nH+]1 ZINC000021794227 207237526 /nfs/dbraw/zinc/23/75/26/207237526.db2.gz UHOFCGOKBFIEPR-UHFFFAOYSA-N 1 1 379.489 4.443 50 0 GIAAMO C[NH+](C)CCNCc1cc(Br)ccc1OCc1ccccc1Cl ZINC000022075491 207246615 /nfs/dbraw/zinc/24/66/15/207246615.db2.gz IZLAPQKPXILJHA-UHFFFAOYSA-N 1 1 397.744 4.333 50 0 GIAAMO COc1cccc(NC(=O)c2ccc([C@H]3CCC[N@@H+]3Cc3cnn(C)c3)s2)c1 ZINC000023129934 207269900 /nfs/dbraw/zinc/26/99/00/207269900.db2.gz XTSYTARLJNJIBF-GOSISDBHSA-N 1 1 396.516 4.080 50 0 GIAAMO COc1cccc(NC(=O)c2ccc([C@H]3CCC[N@H+]3Cc3cnn(C)c3)s2)c1 ZINC000023129934 207269905 /nfs/dbraw/zinc/26/99/05/207269905.db2.gz XTSYTARLJNJIBF-GOSISDBHSA-N 1 1 396.516 4.080 50 0 GIAAMO C[N@@H+](CCc1ccccn1)Cc1cccc(-c2nc(C3CCCC3)cc(=O)[nH]2)c1 ZINC000023146141 207270574 /nfs/dbraw/zinc/27/05/74/207270574.db2.gz VVRJWLBKRBPPTQ-UHFFFAOYSA-N 1 1 388.515 4.164 50 0 GIAAMO CCOc1cc2c(cc1CNC[C@@H](c1cccs1)[NH+]1CCCC1)O[C@H](C)C2 ZINC000023257846 207272692 /nfs/dbraw/zinc/27/26/92/207272692.db2.gz YDXKPWSNXKLSLD-APWZRJJASA-N 1 1 386.561 4.397 50 0 GIAAMO Cc1sc2nc(C[NH+]3CCC(C)CC3)nc(NC3CCC(O)CC3)c2c1C ZINC000023709339 207281596 /nfs/dbraw/zinc/28/15/96/207281596.db2.gz YOUYQPFVZURXLO-UHFFFAOYSA-N 1 1 388.581 4.255 50 0 GIAAMO CSc1ccccc1NC(=O)C[N@@H+]1CCC[C@H](c2nc3ccccc3o2)C1 ZINC000024662966 207293842 /nfs/dbraw/zinc/29/38/42/207293842.db2.gz UZJYRSIEUMUKRW-HNNXBMFYSA-N 1 1 381.501 4.368 50 0 GIAAMO CSc1ccccc1NC(=O)C[N@H+]1CCC[C@H](c2nc3ccccc3o2)C1 ZINC000024662966 207293845 /nfs/dbraw/zinc/29/38/45/207293845.db2.gz UZJYRSIEUMUKRW-HNNXBMFYSA-N 1 1 381.501 4.368 50 0 GIAAMO CCn1c(C[NH+]2CCCCC2)nc2cc(NC(=O)COc3ccccc3)ccc21 ZINC000026121142 207310538 /nfs/dbraw/zinc/31/05/38/207310538.db2.gz NXYXOUJJXQDQGG-UHFFFAOYSA-N 1 1 392.503 4.060 50 0 GIAAMO O=C(Nc1ccccc1O)C1CC[NH+](Cc2ncc(-c3ccc(F)cc3)o2)CC1 ZINC000025050730 207301170 /nfs/dbraw/zinc/30/11/70/207301170.db2.gz ZWMYXOIKGNBVJO-UHFFFAOYSA-N 1 1 395.434 4.037 50 0 GIAAMO Cc1ccc([C@@H]2CCC[N@H+]2CCC(=O)N2CCN(c3ccc(F)cc3)CC2)cc1 ZINC000026924707 207320748 /nfs/dbraw/zinc/32/07/48/207320748.db2.gz QNTMTAXREUYAJH-QHCPKHFHSA-N 1 1 395.522 4.010 50 0 GIAAMO CC(=O)c1ccccc1OCC[N@@H+](Cc1ccc2c(c1)OCO2)C1CCCC1 ZINC000027956820 207332765 /nfs/dbraw/zinc/33/27/65/207332765.db2.gz IGIQAUTWRJGKMH-UHFFFAOYSA-N 1 1 381.472 4.442 50 0 GIAAMO Cc1cc2oc(=O)cc(C[N@@H+](CCC(N)=O)Cc3ccccc3)c2cc1C(C)C ZINC000027547469 207327223 /nfs/dbraw/zinc/32/72/23/207327223.db2.gz HQUUAKFANSFASA-UHFFFAOYSA-N 1 1 392.499 4.102 50 0 GIAAMO O=C(C[N@@H+]1CCC[C@H](C(=O)Nc2ccccc2)C1)C12CC3CC(CC(C3)C1)C2 ZINC000027571424 207327518 /nfs/dbraw/zinc/32/75/18/207327518.db2.gz JORCBJVBHOXNDR-WNZYQOIOSA-N 1 1 380.532 4.123 50 0 GIAAMO C[C@H](C(=O)Nc1cc(F)ccc1F)[N@H+](C)Cc1ccccc1N1CCCCC1 ZINC000029155344 207357300 /nfs/dbraw/zinc/35/73/00/207357300.db2.gz JOWVBFKDUJLLAF-MRXNPFEDSA-N 1 1 387.474 4.414 50 0 GIAAMO C[C@H](C(=O)Nc1cc(F)ccc1F)[N@@H+](C)Cc1ccccc1N1CCCCC1 ZINC000029155344 207357303 /nfs/dbraw/zinc/35/73/03/207357303.db2.gz JOWVBFKDUJLLAF-MRXNPFEDSA-N 1 1 387.474 4.414 50 0 GIAAMO C[N@@H+]1CCN(C(=O)c2ccc(-n3cnc4ccccc43)cc2)[C@@H](c2ccccc2)C1 ZINC000030029870 207368603 /nfs/dbraw/zinc/36/86/03/207368603.db2.gz SBLUQPQYZRVYJP-XMMPIXPASA-N 1 1 396.494 4.154 50 0 GIAAMO C[N@H+]1CCN(C(=O)c2ccc(-n3cnc4ccccc43)cc2)[C@@H](c2ccccc2)C1 ZINC000030029870 207368613 /nfs/dbraw/zinc/36/86/13/207368613.db2.gz SBLUQPQYZRVYJP-XMMPIXPASA-N 1 1 396.494 4.154 50 0 GIAAMO Cc1ccc(NC(=O)C2CC[NH+](Cc3nc(-c4ccccc4)no3)CC2)c(C)c1 ZINC000030955109 207378037 /nfs/dbraw/zinc/37/80/37/207378037.db2.gz ZVROVCXBIJUAJT-UHFFFAOYSA-N 1 1 390.487 4.204 50 0 GIAAMO Cc1ccc(NC(=O)N2CC[NH+](Cc3cn(C)c4ccccc34)CC2)c(C)c1 ZINC000065330059 207862189 /nfs/dbraw/zinc/86/21/89/207862189.db2.gz JHEUSTMVGJYZGQ-UHFFFAOYSA-N 1 1 376.504 4.145 50 0 GIAAMO COc1ccc(-n2cc(C[N@H+]3C[C@@H](C)O[C@@H](C)C3)c(-c3cccc(F)c3)n2)cc1 ZINC000072407381 208017050 /nfs/dbraw/zinc/01/70/50/208017050.db2.gz YNVYSAKGIJSBEG-CALCHBBNSA-N 1 1 395.478 4.296 50 0 GIAAMO COc1ccc(-n2cc(C[N@@H+]3C[C@@H](C)O[C@@H](C)C3)c(-c3cccc(F)c3)n2)cc1 ZINC000072407381 208017056 /nfs/dbraw/zinc/01/70/56/208017056.db2.gz YNVYSAKGIJSBEG-CALCHBBNSA-N 1 1 395.478 4.296 50 0 GIAAMO Cc1ccccc1-c1nn(-c2ccc(F)cc2F)cc1C[N@H+]1CCC[C@@H]1CCO ZINC000072410791 208019682 /nfs/dbraw/zinc/01/96/82/208019682.db2.gz DWUYCVQMZVYQEJ-LJQANCHMSA-N 1 1 397.469 4.473 50 0 GIAAMO Cn1cc(C[N@@H+]2CCc3n[nH]cc3C2)c(-c2ccc(Oc3ccccc3)cc2)n1 ZINC000072425454 208022034 /nfs/dbraw/zinc/02/20/34/208022034.db2.gz VCVWJIXONWKDKX-UHFFFAOYSA-N 1 1 385.471 4.161 50 0 GIAAMO Cn1cc(C[N@H+]2CCc3n[nH]cc3C2)c(-c2ccc(Oc3ccccc3)cc2)n1 ZINC000072425454 208022039 /nfs/dbraw/zinc/02/20/39/208022039.db2.gz VCVWJIXONWKDKX-UHFFFAOYSA-N 1 1 385.471 4.161 50 0 GIAAMO CC[N@@H+](CCO)Cc1cn(-c2ccc(OC)cc2)nc1-c1ccccc1Cl ZINC000072422750 208022902 /nfs/dbraw/zinc/02/29/02/208022902.db2.gz JPBFOPDANINOEC-UHFFFAOYSA-N 1 1 385.895 4.016 50 0 GIAAMO Cc1oc(-c2ccccc2Cl)nc1C[N@H+]1CCc2nnc(C(C)C)n2CC1 ZINC000072432863 208025663 /nfs/dbraw/zinc/02/56/63/208025663.db2.gz FXBSGDXKYHKDJP-UHFFFAOYSA-N 1 1 385.899 4.077 50 0 GIAAMO Cc1oc(-c2ccccc2Cl)nc1C[N@@H+]1CCc2nnc(C(C)C)n2CC1 ZINC000072432863 208025670 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C[C@@H]1C[C@@H](C)C[NH+](Cc2csc(NC(=O)c3ccc(Br)o3)n2)C1 ZINC000022293943 207251554 /nfs/dbraw/zinc/25/15/54/207251554.db2.gz PTRKPFOZBJQFFK-GHMZBOCLSA-N 1 1 398.326 4.229 50 0 GIAAMO COc1cccc([C@H]2CC[N@H+]2Cc2ccc(-c3nc(C4CC4)cc(=O)[nH]3)cc2)c1 ZINC000023153601 207271073 /nfs/dbraw/zinc/27/10/73/207271073.db2.gz WYKUBRCLXUGOQX-JOCHJYFZSA-N 1 1 387.483 4.270 50 0 GIAAMO CSc1cccc(C[N@H+]2CCC[C@H](N3CCN(c4ccc(F)cc4)CC3)C2)c1 ZINC000022914653 207266140 /nfs/dbraw/zinc/26/61/40/207266140.db2.gz UZKBCLCWWDLMNR-QFIPXVFZSA-N 1 1 399.579 4.334 50 0 GIAAMO CSc1cccc(CN2CCC[C@H]([NH+]3CCN(c4ccc(F)cc4)CC3)C2)c1 ZINC000022914653 207266145 /nfs/dbraw/zinc/26/61/45/207266145.db2.gz UZKBCLCWWDLMNR-QFIPXVFZSA-N 1 1 399.579 4.334 50 0 GIAAMO COc1ccc(-c2noc(C[N@H+]3CCC[C@H](c4nc5ccccc5o4)C3)n2)cc1 ZINC000024666587 207292769 /nfs/dbraw/zinc/29/27/69/207292769.db2.gz IOOAEGUWDYFVMM-INIZCTEOSA-N 1 1 390.443 4.266 50 0 GIAAMO O=C(CC[N@@H+]1CCCN(Cc2ccc(F)cc2)CC1)Nc1ccccc1Cl ZINC000025934804 207307441 /nfs/dbraw/zinc/30/74/41/207307441.db2.gz XPFPWZBXOPMSSI-UHFFFAOYSA-N 1 1 389.902 4.016 50 0 GIAAMO CCn1c(C[NH+]2CCCCC2)nc2cc(NC(=O)c3ccc(F)cc3)ccc21 ZINC000026121135 207309770 /nfs/dbraw/zinc/30/97/70/207309770.db2.gz SXXSJISQIAQQOU-UHFFFAOYSA-N 1 1 380.467 4.434 50 0 GIAAMO Cc1ccc([C@H]2CCC[N@H+]2CCC(=O)N2CCN(c3ccc(F)cc3)CC2)cc1 ZINC000026924710 207320655 /nfs/dbraw/zinc/32/06/55/207320655.db2.gz QNTMTAXREUYAJH-HSZRJFAPSA-N 1 1 395.522 4.010 50 0 GIAAMO O=C(C[N@@H+](Cc1ccc2c(c1)OCO2)C1CCCC1)NCCC1=CCCCC1 ZINC000027235880 207324550 /nfs/dbraw/zinc/32/45/50/207324550.db2.gz QMBNUTKJDAOQNB-UHFFFAOYSA-N 1 1 384.520 4.167 50 0 GIAAMO OC[C@@]1(Cc2ccccc2)CCC[N@@H+](Cc2ccc(Oc3ncccn3)cc2)C1 ZINC000012575795 207324640 /nfs/dbraw/zinc/32/46/40/207324640.db2.gz WKQMVSYIXXUOOF-XMMPIXPASA-N 1 1 389.499 4.086 50 0 GIAAMO CN(C)c1ccc([C@H]2C[C@](C)([NH+]3CCCC3)Oc3cc4c(cc32)OCO4)cc1 ZINC000028617231 207345331 /nfs/dbraw/zinc/34/53/31/207345331.db2.gz MMXOGJYYUBSYLU-AUSIDOKSSA-N 1 1 380.488 4.208 50 0 GIAAMO Cc1cc2oc(C(=O)NC[C@@H](c3cccs3)[NH+]3CCCC3)cc(=O)c2cc1C ZINC000028289528 207338887 /nfs/dbraw/zinc/33/88/87/207338887.db2.gz PZFDZGYHDJMZCH-KRWDZBQOSA-N 1 1 396.512 4.038 50 0 GIAAMO Cc1ccc(C)c(NC(=O)C2CC[NH+](Cc3nc(-c4ccccc4)no3)CC2)c1 ZINC000030955111 207378204 /nfs/dbraw/zinc/37/82/04/207378204.db2.gz BJDCUTCUJAKWNZ-UHFFFAOYSA-N 1 1 390.487 4.204 50 0 GIAAMO CSc1ccc(Cl)c(C(=O)NC[C@@H](C)[N@@H+]2CCc3sccc3C2)c1 ZINC000031964607 207389199 /nfs/dbraw/zinc/38/91/99/207389199.db2.gz AZFURECVGHNJIO-GFCCVEGCSA-N 1 1 380.966 4.300 50 0 GIAAMO CSc1ccc(Cl)c(C(=O)NC[C@@H](C)[N@H+]2CCc3sccc3C2)c1 ZINC000031964607 207389204 /nfs/dbraw/zinc/38/92/04/207389204.db2.gz AZFURECVGHNJIO-GFCCVEGCSA-N 1 1 380.966 4.300 50 0 GIAAMO COc1cccc(C[N@@H+](CC(C)C)C[C@H](O)COc2ccc(Cl)cc2)c1 ZINC000036031419 207507864 /nfs/dbraw/zinc/50/78/64/207507864.db2.gz QKNQGQWGVUTNJZ-IBGZPJMESA-N 1 1 377.912 4.247 50 0 GIAAMO Cc1nc(-c2ccc(CC(=O)N[C@H]3CC[N@@H+](Cc4ccccc4)C3)cc2)cs1 ZINC000040073699 207573980 /nfs/dbraw/zinc/57/39/80/207573980.db2.gz QMFUKAPLKUJMPZ-NRFANRHFSA-N 1 1 391.540 4.052 50 0 GIAAMO Cc1ccc(-n2cc(CN3CC[N@@H+](C)[C@H](C)C3)c(-c3ccc(F)cc3)n2)cc1 ZINC000072407896 208015362 /nfs/dbraw/zinc/01/53/62/208015362.db2.gz BVZILWMMTCOXFM-GOSISDBHSA-N 1 1 378.495 4.123 50 0 GIAAMO Cn1cc(CN2CC[N@H+]3CCC[C@@H]3C2)c(-c2ccc(C3CCCCC3)cc2)n1 ZINC000072422252 208022992 /nfs/dbraw/zinc/02/29/92/208022992.db2.gz RAKZBNWMXMGCTE-HSZRJFAPSA-N 1 1 378.564 4.415 50 0 GIAAMO OC[C@@H]1C=CC[N@H+]1Cc1cc2cc3c(cc2nc1-c1ccc(Cl)cc1)OCO3 ZINC000072478826 208032864 /nfs/dbraw/zinc/03/28/64/208032864.db2.gz VLTNTYCMHVQKDT-SFHVURJKSA-N 1 1 394.858 4.017 50 0 GIAAMO C[N@@H+]1CC[C@@H](NC(=O)Cc2c(F)cccc2Cl)[C@@H]1c1ccc(Cl)cc1 ZINC000089375125 208104511 /nfs/dbraw/zinc/10/45/11/208104511.db2.gz IJHLXQBYWPNKRV-MJGOQNOKSA-N 1 1 381.278 4.237 50 0 GIAAMO C[N@H+]1CC[C@@H](NC(=O)Cc2c(F)cccc2Cl)[C@@H]1c1ccc(Cl)cc1 ZINC000089375125 208104517 /nfs/dbraw/zinc/10/45/17/208104517.db2.gz IJHLXQBYWPNKRV-MJGOQNOKSA-N 1 1 381.278 4.237 50 0 GIAAMO C[N@H+]1C[C@@H](c2ccccc2)CC2(CCN(C(=O)c3cccn3C3CC3)CC2)C1 ZINC000095362632 208165074 /nfs/dbraw/zinc/16/50/74/208165074.db2.gz OUEVLYLBDWQRTE-FQEVSTJZSA-N 1 1 377.532 4.165 50 0 GIAAMO O=C(Nc1ccccc1)N1C[C@@H](c2cccc(F)c2F)[C@@H]2[C@H]1C1CC[NH+]2CC1 ZINC000095373930 208169322 /nfs/dbraw/zinc/16/93/22/208169322.db2.gz BZWYNCHOEFKEHM-IOMROCGXSA-N 1 1 383.442 4.059 50 0 GIAAMO CC(C)=CC[C@@]1(CO)CCC[N@H+](Cc2sc(N3CCCC3)nc2Cl)C1 ZINC000091986686 208143141 /nfs/dbraw/zinc/14/31/41/208143141.db2.gz NWRCVIPDWBJVOT-IBGZPJMESA-N 1 1 383.989 4.328 50 0 GIAAMO CC(C)=CC[C@@]1(CO)CCC[N@@H+](Cc2sc(N3CCCC3)nc2Cl)C1 ZINC000091986686 208143143 /nfs/dbraw/zinc/14/31/43/208143143.db2.gz NWRCVIPDWBJVOT-IBGZPJMESA-N 1 1 383.989 4.328 50 0 GIAAMO CC(C)n1cccc1C(=O)N1CCC2(CC1)C[C@@H](c1ccccc1)C[N@@H+](C)C2 ZINC000095389559 208174715 /nfs/dbraw/zinc/17/47/15/208174715.db2.gz IVGOFMBFLOEWRP-OAQYLSRUSA-N 1 1 379.548 4.411 50 0 GIAAMO Cc1ccc2oc(N3CCC[C@H](c4[nH+]ccn4Cc4cscn4)C3)nc2c1 ZINC000095508437 208209259 /nfs/dbraw/zinc/20/92/59/208209259.db2.gz MSMDSHAECKFOEX-HNNXBMFYSA-N 1 1 379.489 4.222 50 0 GIAAMO CC(C)(C)OC(=O)C1CCC([N@H+]2CCCC[C@H]2c2nnc3n2CCCC3)CC1 ZINC000095457085 208186255 /nfs/dbraw/zinc/18/62/55/208186255.db2.gz JMSFUKUTWUYMPM-ABHNRTSZSA-N 1 1 388.556 4.042 50 0 GIAAMO Cc1nc(CC(C)C)sc1C(=O)N[C@@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000095466143 208188290 /nfs/dbraw/zinc/18/82/90/208188290.db2.gz WUAHZZAYHJMNGF-QFBILLFUSA-N 1 1 385.577 4.290 50 0 GIAAMO CC(C)c1ncc(CN(C)C[C@@H]2CCC[N@@H+](CCc3ccc(F)cc3)C2)cn1 ZINC000095513287 208212797 /nfs/dbraw/zinc/21/27/97/208212797.db2.gz MRGFGWVDJFZNSO-FQEVSTJZSA-N 1 1 384.543 4.126 50 0 GIAAMO COCC[N@H+]1CCC[C@H](C(=O)Nc2cccc(-c3cc4ccccc4[nH]3)c2)C1 ZINC000095511404 208214642 /nfs/dbraw/zinc/21/46/42/208214642.db2.gz CLSDALUQKNANJU-IBGZPJMESA-N 1 1 377.488 4.132 50 0 GIAAMO O=C(Nc1cccc(-c2ccc(F)cc2)c1)[C@H]1CCC[N@@H+](CCc2ncc[nH]2)C1 ZINC000095519245 208215953 /nfs/dbraw/zinc/21/59/53/208215953.db2.gz PKFOHCZYRXSQKX-IBGZPJMESA-N 1 1 392.478 4.109 50 0 GIAAMO COc1ccc2[nH]cc(C3=CC[N@@H+](Cc4cc5ccccc5[nH]c4=O)CC3)c2c1 ZINC000095957531 208244497 /nfs/dbraw/zinc/24/44/97/208244497.db2.gz YRVYXUBYWIQRGC-UHFFFAOYSA-N 1 1 385.467 4.307 50 0 GIAAMO Cc1[nH+]ccn1CC1(CNC(=O)C[C@@H](c2ccccc2)c2ccccc2F)CC1 ZINC000095524027 208222855 /nfs/dbraw/zinc/22/28/55/208222855.db2.gz DNWIAISUAKLCEG-NRFANRHFSA-N 1 1 391.490 4.449 50 0 GIAAMO CC1(C)C[C@H]([N@@H+](Cc2ccccc2)Cc2cc(=O)n3ccccc3n2)C(C)(C)O1 ZINC000095992736 208250710 /nfs/dbraw/zinc/25/07/10/208250710.db2.gz WWFABCKCCQREMI-FQEVSTJZSA-N 1 1 391.515 4.043 50 0 GIAAMO COc1ccc(NC(=O)N2CCC[N@@H+](CCCc3ccccc3)CC2)c(F)c1 ZINC000096138007 208267746 /nfs/dbraw/zinc/26/77/46/208267746.db2.gz LFHGWTXRSYWRPM-UHFFFAOYSA-N 1 1 385.483 4.007 50 0 GIAAMO Cc1cc2[nH]c(C(=O)Nc3ccc(F)c(C)c3)c(C[NH+]3CCOCC3)c2s1 ZINC000096363814 208310363 /nfs/dbraw/zinc/31/03/63/208310363.db2.gz ZKNHBRAWDKUVLT-UHFFFAOYSA-N 1 1 387.480 4.070 50 0 GIAAMO Cc1cc2[nH]c(C(=O)Nc3cc(F)ccc3C)c(C[NH+]3CCOCC3)c2s1 ZINC000096363818 208310659 /nfs/dbraw/zinc/31/06/59/208310659.db2.gz PSXPQFVHRPDFBD-UHFFFAOYSA-N 1 1 387.480 4.070 50 0 GIAAMO COc1ccc([C@H](CC[NH+]2CCOCC2)Oc2ccc(F)c(Cl)c2)cc1 ZINC000096281674 208302363 /nfs/dbraw/zinc/30/23/63/208302363.db2.gz ZMKGNPIRPZGEFF-FQEVSTJZSA-N 1 1 379.859 4.330 50 0 GIAAMO CC(C)c1ccc(NC(=O)[C@H]2C[C@H]3CCC[N@H+]3[C@]23c2ccccc2NC3=O)cc1 ZINC000096286768 208302669 /nfs/dbraw/zinc/30/26/69/208302669.db2.gz KNLAEBGKXUCZJK-DRMXPCRNSA-N 1 1 389.499 4.080 50 0 GIAAMO Cc1cccc(NC(=O)C[NH+]2CCC(c3nnc(-c4ccsc4)o3)CC2)c1C ZINC000096024365 209007331 /nfs/dbraw/zinc/00/73/31/209007331.db2.gz NMJQMQPRAGSKLZ-UHFFFAOYSA-N 1 1 396.516 4.233 50 0 GIAAMO Cc1cccc2cc(C(=O)N[C@@H]3CC[N@H+](C)[C@@H]3c3ccccc3)c(Cl)nc12 ZINC000241707037 209020089 /nfs/dbraw/zinc/02/00/89/209020089.db2.gz QMDGUWPWJWLCNX-UYAOXDASSA-N 1 1 379.891 4.372 50 0 GIAAMO Cc1cccc2cc(C(=O)N[C@H]3CC[N@H+](C)[C@@H]3c3ccccc3)c(Cl)nc12 ZINC000241707034 209020398 /nfs/dbraw/zinc/02/03/98/209020398.db2.gz QMDGUWPWJWLCNX-AZUAARDMSA-N 1 1 379.891 4.372 50 0 GIAAMO Fc1ccc2nc(C3CC[NH+](Cc4cc(-c5ccncc5)no4)CC3)[nH]c2c1 ZINC000243956971 209021853 /nfs/dbraw/zinc/02/18/53/209021853.db2.gz CFAOFMGMHPSOIT-UHFFFAOYSA-N 1 1 377.423 4.132 50 0 GIAAMO Cc1ccc(NC(=O)C2CC[NH+](Cc3nc4ccccc4n3C)CC2)c(C)c1 ZINC000247721554 209026246 /nfs/dbraw/zinc/02/62/46/209026246.db2.gz AXBZTLMQCJAXJM-UHFFFAOYSA-N 1 1 376.504 4.041 50 0 GIAAMO CCCN(C(=O)C1CC[NH+](Cc2nc3ccccc3n2C(C)C)CC1)C(C)C ZINC000248009895 209028973 /nfs/dbraw/zinc/02/89/73/209028973.db2.gz QPIWOWVPCQJUOW-UHFFFAOYSA-N 1 1 384.568 4.476 50 0 GIAAMO Cc1ccc(C)c(NC(=O)C2CC[NH+](Cc3nc4ccccc4n3C)CC2)c1 ZINC000248099605 209029524 /nfs/dbraw/zinc/02/95/24/209029524.db2.gz ZWZIYIMYIUMHTE-UHFFFAOYSA-N 1 1 376.504 4.041 50 0 GIAAMO Cn1c(C[NH+]2CCC(C(=O)Nc3ccccc3Cl)CC2)nc2ccccc21 ZINC000253612917 209043804 /nfs/dbraw/zinc/04/38/04/209043804.db2.gz OKINLBNWMNBORB-UHFFFAOYSA-N 1 1 382.895 4.077 50 0 GIAAMO CC(=O)Nc1ccccc1NC(=O)C[N@@H+]1CCCCC[C@@H]1c1cccc(F)c1 ZINC000252480626 209032703 /nfs/dbraw/zinc/03/27/03/209032703.db2.gz CBNBZLQWQXCRST-OAQYLSRUSA-N 1 1 383.467 4.340 50 0 GIAAMO CC(=O)Nc1ccccc1NC(=O)C[N@H+]1CCCCC[C@@H]1c1cccc(F)c1 ZINC000252480626 209032708 /nfs/dbraw/zinc/03/27/08/209032708.db2.gz CBNBZLQWQXCRST-OAQYLSRUSA-N 1 1 383.467 4.340 50 0 GIAAMO CC[N@@H+]1CCc2nc(NC(=O)c3cccnc3Sc3ccccc3)sc2C1 ZINC000012856371 221238383 /nfs/dbraw/zinc/23/83/83/221238383.db2.gz GQTRAYNLLPKSCR-UHFFFAOYSA-N 1 1 396.541 4.320 50 0 GIAAMO CC[N@H+]1CCc2nc(NC(=O)c3cccnc3Sc3ccccc3)sc2C1 ZINC000012856371 221238388 /nfs/dbraw/zinc/23/83/88/221238388.db2.gz GQTRAYNLLPKSCR-UHFFFAOYSA-N 1 1 396.541 4.320 50 0 GIAAMO Cc1ccc(-c2cc(C(=O)NC[C@@H](c3ccco3)[NH+]3CCCCC3)no2)cc1 ZINC000015859708 221349377 /nfs/dbraw/zinc/34/93/77/221349377.db2.gz PBZIQCPSTQJYEG-IBGZPJMESA-N 1 1 379.460 4.200 50 0 GIAAMO COc1ccc(C[N@H+]2CC[C@]3(OC)CC[C@@H](OCC4CC4)C[C@H]23)cc1Cl ZINC000426471575 533569886 /nfs/dbraw/zinc/56/98/86/533569886.db2.gz NXRKNIXFUGTWTB-JRGCBEDISA-N 1 1 379.928 4.287 50 0 GIAAMO Cc1cc(C)nc(C[N@H+](C)C2CCN(c3ccc(C(F)(F)F)cn3)CC2)c1 ZINC000095373154 136178562 /nfs/dbraw/zinc/17/85/62/136178562.db2.gz LUUNLGFIUUBMNH-UHFFFAOYSA-N 1 1 378.442 4.213 50 0 GIAAMO Cc1oc(-c2ccc(C)cc2)nc1C[NH+]1CCC(O)(c2ccc(C)cn2)CC1 ZINC000299777699 209085954 /nfs/dbraw/zinc/08/59/54/209085954.db2.gz LOKSFNGGTDLCJW-UHFFFAOYSA-N 1 1 377.488 4.145 50 0 GIAAMO CN(C[C@H]1CCC[N@@H+](CCc2ccc(Cl)cc2)C1)C(=O)/C=C/c1ccco1 ZINC000012763067 523117192 /nfs/dbraw/zinc/11/71/92/523117192.db2.gz GIQRYUFCCRLANK-GNISGLHKSA-N 1 1 386.923 4.359 50 0 GIAAMO Fc1ccccc1CN1CCC(C[N@@H+](Cc2ccccn2)C[C@@H]2CCCO2)CC1 ZINC000023153285 526411121 /nfs/dbraw/zinc/41/11/21/526411121.db2.gz YYHOCWSFGWTSMB-QHCPKHFHSA-N 1 1 397.538 4.114 50 0 GIAAMO Fc1ccccc1CN1CCC(C[N@H+](Cc2ccccn2)C[C@@H]2CCCO2)CC1 ZINC000023153285 526411125 /nfs/dbraw/zinc/41/11/25/526411125.db2.gz YYHOCWSFGWTSMB-QHCPKHFHSA-N 1 1 397.538 4.114 50 0 GIAAMO CC(C)c1ccc(CN2CCC[C@@]3(CC[N@@H+](CCc4ccccn4)C3)C2=O)cc1 ZINC000426382617 528093106 /nfs/dbraw/zinc/09/31/06/528093106.db2.gz GYRHYDVQJVYPDH-VWLOTQADSA-N 1 1 391.559 4.262 50 0 GIAAMO CCCc1cnc(C)nc1N1CCC([NH2+][C@@H](C)c2nc3ccc(C)cc3[nH]2)CC1 ZINC000095388905 535436275 /nfs/dbraw/zinc/43/62/75/535436275.db2.gz AYBWPNXBDSKQEV-INIZCTEOSA-N 1 1 392.551 4.242 50 0 GIAAMO Cc1noc(C)c1CCC(=O)NCc1ccccc1C[N@@H+]1C[C@H](C)C[C@H](C)C1 ZINC000048333534 570237723 /nfs/dbraw/zinc/23/77/23/570237723.db2.gz TZMFKMZIBDQWDY-CALCHBBNSA-N 1 1 383.536 4.018 50 0 GIAAMO Cc1cccc(-c2noc(C3CC[NH+](CC(=O)Nc4ccccc4C)CC3)n2)c1 ZINC000049403192 570264298 /nfs/dbraw/zinc/26/42/98/570264298.db2.gz KPVYZKDWSSCIAD-UHFFFAOYSA-N 1 1 390.487 4.172 50 0 GIAAMO Cc1[nH+]ccn1-c1ccc(CNC(=O)c2cc3ccccc3cc2O)cc1F ZINC000072032869 570289646 /nfs/dbraw/zinc/28/96/46/570289646.db2.gz FDDHUMWMNHMTQQ-UHFFFAOYSA-N 1 1 375.403 4.109 50 0 GIAAMO O=C(c1cc2cc(Cl)ccc2[nH]1)N1CCC[N@@H+](Cc2ccc(F)cc2)CC1 ZINC000012944928 570316567 /nfs/dbraw/zinc/31/65/67/570316567.db2.gz QPKZHMMEJWSOJN-UHFFFAOYSA-N 1 1 385.870 4.309 50 0 GIAAMO O=C(c1cc2cc(Cl)ccc2[nH]1)N1CCC[N@H+](Cc2ccc(F)cc2)CC1 ZINC000012944928 570316571 /nfs/dbraw/zinc/31/65/71/570316571.db2.gz QPKZHMMEJWSOJN-UHFFFAOYSA-N 1 1 385.870 4.309 50 0 GIAAMO Cc1cccc([C@H]2C[C@H](C(=O)N3CCSCC3)C[N@@H+](Cc3ccccc3)C2)c1 ZINC000034733615 570325813 /nfs/dbraw/zinc/32/58/13/570325813.db2.gz BPEQZQSWFLUXPW-GOTSBHOMSA-N 1 1 394.584 4.176 50 0 GIAAMO CCCCCNC(=O)C1CC[NH+](Cc2csc(-c3cccs3)n2)CC1 ZINC000051800457 570364049 /nfs/dbraw/zinc/36/40/49/570364049.db2.gz UFQQGDPTMUZBJW-UHFFFAOYSA-N 1 1 377.579 4.390 50 0 GIAAMO Cc1ccc2oc(=O)c3cc(C(=O)NCCC[N@@H+]4CCC[C@H](C)C4)sc3c2c1 ZINC000004939786 570376168 /nfs/dbraw/zinc/37/61/68/570376168.db2.gz VOVXSEIMRWTTCL-HNNXBMFYSA-N 1 1 398.528 4.168 50 0 GIAAMO COc1ccc(Cl)cc1C(=O)Nc1nc(C[NH+]2CCCCCC2)cs1 ZINC000013012303 570417533 /nfs/dbraw/zinc/41/75/33/570417533.db2.gz CNWRKMSDQPFGPJ-UHFFFAOYSA-N 1 1 379.913 4.433 50 0 GIAAMO C[C@@H](C(=O)Nc1nc2ccc(F)cc2s1)[NH+]1CCC(c2ccncc2)CC1 ZINC000191667986 570421552 /nfs/dbraw/zinc/42/15/52/570421552.db2.gz IPBKPDGJSOMOLX-ZDUSSCGKSA-N 1 1 384.480 4.037 50 0 GIAAMO CN(C)CCC[NH2+]CC[C@@]1(c2cccc(C(F)(F)F)c2)CCOC(C)(C)C1 ZINC000006754882 570492096 /nfs/dbraw/zinc/49/20/96/570492096.db2.gz OJCYXHBQKMVYAZ-HXUWFJFHSA-N 1 1 386.502 4.464 50 0 GIAAMO Cc1ccc(-c2cnn3c2nc(C)cc3N2CCN(c3cccc(C)[nH+]3)CC2)cc1 ZINC000007636215 570510523 /nfs/dbraw/zinc/51/05/23/570510523.db2.gz WOGHWWGHWGVEAT-UHFFFAOYSA-N 1 1 398.514 4.043 50 0 GIAAMO COc1cc(C[N@@H+](C)Cc2cc(=O)oc3c(C)cc(C)cc23)cc(OC)c1OC ZINC000033018772 570518525 /nfs/dbraw/zinc/51/85/25/570518525.db2.gz ZASUGCPUFDZDJK-UHFFFAOYSA-N 1 1 397.471 4.068 50 0 GIAAMO Cc1[nH+]ccn1CCc1nc2cc(NC(=O)c3ccc(Cl)cc3)ccc2n1C ZINC000006665046 570526707 /nfs/dbraw/zinc/52/67/07/570526707.db2.gz DAHJWDWAMVMHTK-UHFFFAOYSA-N 1 1 393.878 4.227 50 0 GIAAMO COc1ccccc1C[N@@H+](Cc1ccc(F)cc1)C[C@@H](O)COc1ccccc1 ZINC000036102919 570539496 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GIAAMO CN(C(=O)c1cc2ccccc2[nH]1)[C@H]1CCC[N@@H+](CCCc2ccccc2)C1 ZINC000012752072 818180738 /nfs/dbraw/zinc/18/07/38/818180738.db2.gz GJKKVNBXLBVJHU-NRFANRHFSA-N 1 1 375.516 4.337 50 0 GIAAMO COC[C@H]1CC[N@@H+](Cc2cn(C)nc2-c2ccc(Oc3ccccc3)cc2)C1 ZINC000014980640 818279968 /nfs/dbraw/zinc/27/99/68/818279968.db2.gz LBOSHYSJNCFQDE-SFHVURJKSA-N 1 1 377.488 4.348 50 0 GIAAMO Cc1cccc(-c2c[nH]nc2[C@H]2CCC[N@@H+](Cc3cccc4c3OCO4)C2)c1 ZINC000019772145 818605230 /nfs/dbraw/zinc/60/52/30/818605230.db2.gz STJJMRGHVVVTAJ-SFHVURJKSA-N 1 1 375.472 4.493 50 0 GIAAMO Fc1cccc2ccc(CN3CCC[C@H]([N@H+]4CCc5ccccc5C4)C3)nc12 ZINC000023374018 818928923 /nfs/dbraw/zinc/92/89/23/818928923.db2.gz NRJKANQPUVAGHU-QFIPXVFZSA-N 1 1 375.491 4.397 50 0 GIAAMO Cn1cc(C[N@H+](C)Cc2[nH]nc3c2CCCCC3)c(-c2cccc(Cl)c2)n1 ZINC000023431256 818940368 /nfs/dbraw/zinc/94/03/68/818940368.db2.gz GSRZOKALPWENOA-UHFFFAOYSA-N 1 1 383.927 4.365 50 0 GIAAMO Cn1cc(C[N@@H+](C)Cc2[nH]nc3c2CCCCC3)c(-c2cccc(Cl)c2)n1 ZINC000023431256 818940378 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NC(=O)c1cccc(C[N@@H+](CCOc2ccccc2F)Cc2ccccc2)c1 ZINC000040149550 821149545 /nfs/dbraw/zinc/14/95/45/821149545.db2.gz IHHKHDBDZMNWJA-UHFFFAOYSA-N 1 1 378.447 4.006 50 0 GIAAMO Cc1nn(-c2ccccc2)cc1NC(=O)N1CCC[N@@H+](CC2CCCCC2)CC1 ZINC000183723519 822517102 /nfs/dbraw/zinc/51/71/02/822517102.db2.gz ZSERTHXMBGHRKX-UHFFFAOYSA-N 1 1 395.551 4.301 50 0 GIAAMO CC(=O)Nc1ccc(CN2CC[C@]3(C2)CCC[N@@H+](Cc2cccc(C)c2)C3)cc1 ZINC000055053644 822935268 /nfs/dbraw/zinc/93/52/68/822935268.db2.gz YGPXMTOMLLOODW-RUZDIDTESA-N 1 1 391.559 4.442 50 0 GIAAMO CCOc1cc2c(cc1OCC)-n1cccc1[C@@H](c1ccc(OC)c(O)c1)[NH2+]C2 ZINC000055214732 822946270 /nfs/dbraw/zinc/94/62/70/822946270.db2.gz NJPVIOQQGAERBP-HSZRJFAPSA-N 1 1 394.471 4.182 50 0 GIAAMO CC(=O)Nc1ccc(CN2CC[C@@]3(C2)CCC[N@@H+](CCc2ccccc2)C3)cc1 ZINC000055226575 822946894 /nfs/dbraw/zinc/94/68/94/822946894.db2.gz HIXGEQYBXFJUQN-VWLOTQADSA-N 1 1 391.559 4.176 50 0 GIAAMO Cc1cccc(-c2ncc(C[NH2+]CCCc3nc4ccc(F)cc4[nH]3)cn2)c1 ZINC000055401084 822957836 /nfs/dbraw/zinc/95/78/36/822957836.db2.gz RATBEDCJWHTWDK-UHFFFAOYSA-N 1 1 375.451 4.190 50 0 GIAAMO C[N@@H+](CCCc1cc(-c2ccccc2)no1)[C@@H]1CCc2ccccc2NC1=O ZINC000191980639 823830633 /nfs/dbraw/zinc/83/06/33/823830633.db2.gz PCKGFHFALCZYEC-JOCHJYFZSA-N 1 1 375.472 4.160 50 0 GIAAMO O=C(c1ccccc1OC[C@@H]1CCC[N@@H+](Cc2ccsc2)C1)N1CCCC1 ZINC000169765166 823913912 /nfs/dbraw/zinc/91/39/12/823913912.db2.gz QABKVIYMRXARJI-GOSISDBHSA-N 1 1 384.545 4.275 50 0 GIAAMO Cc1c[nH+]c(C[C@@H]2CCCN(C(=O)Cc3c[nH]c4ccccc34)C2)n1C(C)C ZINC000575317712 823953684 /nfs/dbraw/zinc/95/36/84/823953684.db2.gz XWQCQCNUIRRGHU-SFHVURJKSA-N 1 1 378.520 4.278 50 0 GIAAMO Cc1cnc(C[C@H]2CCC[N@@H+](Cc3cccnc3)C2)n1Cc1ccc(F)cc1 ZINC000575317212 823953724 /nfs/dbraw/zinc/95/37/24/823953724.db2.gz DQUMNNZRTFLPLR-HXUWFJFHSA-N 1 1 378.495 4.229 50 0 GIAAMO Cc1cnc(C2CCOCC2)n1C[C@@H]1CCC[N@@H+](Cc2ccc(F)cc2F)C1 ZINC000575547738 823976268 /nfs/dbraw/zinc/97/62/68/823976268.db2.gz UERZRGDMWINYHY-QGZVFWFLSA-N 1 1 389.490 4.276 50 0 GIAAMO O=C(Nc1ccccc1)[C@H](c1ccccc1)[NH+]1CCC(OC2CCOCC2)CC1 ZINC000133652544 209112217 /nfs/dbraw/zinc/11/22/17/209112217.db2.gz PPHKPFRIDLCNHZ-QHCPKHFHSA-N 1 1 394.515 4.026 50 0 GIAAMO COc1ccc([C@@H]2CCC[N@@H+]2CC(=O)N2CCC[C@@H]3CCCC[C@@H]32)cc1OC ZINC000229694480 206260974 /nfs/dbraw/zinc/26/09/74/206260974.db2.gz ZUQOJHTXIMMSKN-IHPCNDPISA-N 1 1 386.536 4.022 50 0 GIAAMO COc1ccc([C@@H]2CCC[N@H+]2CC(=O)N2CCC[C@@H]3CCCC[C@@H]32)cc1OC ZINC000229694480 206260979 /nfs/dbraw/zinc/26/09/79/206260979.db2.gz ZUQOJHTXIMMSKN-IHPCNDPISA-N 1 1 386.536 4.022 50 0 GIAAMO COc1ccc(-c2noc(C[NH+]3CCC(Cc4ccccc4)CC3)n2)cc1OC ZINC000001070454 206348381 /nfs/dbraw/zinc/34/83/81/206348381.db2.gz OKWMFMSHGGWNBQ-UHFFFAOYSA-N 1 1 393.487 4.209 50 0 GIAAMO COC(CNc1[nH+]cnc2c1c(-c1ccccc1)cn2-c1ccc(F)cc1)OC ZINC000001447527 206382044 /nfs/dbraw/zinc/38/20/44/206382044.db2.gz RDZZRJGNPQVZDZ-UHFFFAOYSA-N 1 1 392.434 4.257 50 0 GIAAMO COc1ccc([C@@H]2[NH2+][C@@H](C(=O)Nc3ccccc3)Cc3c4ccccc4[nH]c32)cc1 ZINC000036367817 206797506 /nfs/dbraw/zinc/79/75/06/206797506.db2.gz NBQRFAPKEVRLBD-PKTZIBPZSA-N 1 1 397.478 4.419 50 0 GIAAMO COc1cccc(-c2ccc(NC(=O)[C@H]3CCC[N@H+](C4CCOCC4)C3)cc2)c1 ZINC000012464397 206902042 /nfs/dbraw/zinc/90/20/42/206902042.db2.gz SDPLRSZNZURNKE-FQEVSTJZSA-N 1 1 394.515 4.192 50 0 GIAAMO Cc1nc(-c2ccccc2)sc1C(=O)NC[C@H](c1ccco1)[NH+]1CCCC1 ZINC000014235360 207017018 /nfs/dbraw/zinc/01/70/18/207017018.db2.gz NQFBGKDRVRSVDX-QGZVFWFLSA-N 1 1 381.501 4.278 50 0 GIAAMO CCOC(=O)C1(Cc2ccccc2)CC[NH+](Cc2nc3c(s2)CCCC3)CC1 ZINC000014968631 207035326 /nfs/dbraw/zinc/03/53/26/207035326.db2.gz KVNFLDOGYRJOCA-UHFFFAOYSA-N 1 1 398.572 4.410 50 0 GIAAMO CCOCCCN1C(=O)CC[C@@H]2C[N@H+](C/C(Cl)=C/c3ccccc3)CC[C@@H]21 ZINC000014987461 207038051 /nfs/dbraw/zinc/03/80/51/207038051.db2.gz NPEWBJLVBIXSHI-VWOSWCIOSA-N 1 1 390.955 4.006 50 0 GIAAMO Cc1ccc(-c2n[nH]cc2C[NH+]2CCN(c3ccc(Cl)cn3)CC2)cc1C ZINC000015064924 207042639 /nfs/dbraw/zinc/04/26/39/207042639.db2.gz QMLDTKPTZLUZKE-UHFFFAOYSA-N 1 1 381.911 4.064 50 0 GIAAMO CCN(C[C@@H]1CCC[N@@H+](CCc2cccc(OC)c2)C1)C(=O)c1ccoc1C ZINC000015070134 207044254 /nfs/dbraw/zinc/04/42/54/207044254.db2.gz JFAJGGGZNCOLQX-HXUWFJFHSA-N 1 1 384.520 4.013 50 0 GIAAMO CC[C@H](NC(=O)C[N@@H+]1CCC[C@@H]1c1ccc2c(c1)OCCO2)c1ccc(C)cc1 ZINC000015301175 207049412 /nfs/dbraw/zinc/04/94/12/207049412.db2.gz KFGFQGSULJITOG-LEWJYISDSA-N 1 1 394.515 4.171 50 0 GIAAMO CC[C@H](NC(=O)C[N@H+]1CCC[C@@H]1c1ccc2c(c1)OCCO2)c1ccc(C)cc1 ZINC000015301175 207049416 /nfs/dbraw/zinc/04/94/16/207049416.db2.gz KFGFQGSULJITOG-LEWJYISDSA-N 1 1 394.515 4.171 50 0 GIAAMO O=C(Nc1cccc(Cl)c1)N(CCC[NH+]1CCOCC1)C[C@@H]1CC=CCC1 ZINC000017080055 207084194 /nfs/dbraw/zinc/08/41/94/207084194.db2.gz JRKLOCPWWFYXIC-GOSISDBHSA-N 1 1 391.943 4.253 50 0 GIAAMO Fc1ccc(N2CCN([C@@H]3CCC[N@@H+](C/C=C/c4ccccc4)C3)CC2)cc1 ZINC000019639609 207143832 /nfs/dbraw/zinc/14/38/32/207143832.db2.gz SAYGQUOQNOHPAG-CZDPRXMLSA-N 1 1 379.523 4.126 50 0 GIAAMO Fc1ccc(N2CC[NH+]([C@@H]3CCCN(C/C=C/c4ccccc4)C3)CC2)cc1 ZINC000019639609 207143840 /nfs/dbraw/zinc/14/38/40/207143840.db2.gz SAYGQUOQNOHPAG-CZDPRXMLSA-N 1 1 379.523 4.126 50 0 GIAAMO CSc1ccc(C[NH+]2CCN(Cc3ccc(Br)cc3)CC2)cc1 ZINC000019781969 207161886 /nfs/dbraw/zinc/16/18/86/207161886.db2.gz TWGLOYJDAWWNJI-UHFFFAOYSA-N 1 1 391.378 4.489 50 0 GIAAMO Fc1ccc(N2CCN([C@H]3CCC[N@@H+](CCCc4ccccc4)C3)CC2)cc1 ZINC000019836009 207164066 /nfs/dbraw/zinc/16/40/66/207164066.db2.gz YIRVPHWXQIYZAT-DEOSSOPVSA-N 1 1 381.539 4.045 50 0 GIAAMO Clc1cccc(CN2CC[NH+](C3CCN(Cc4ccccc4)CC3)CC2)c1 ZINC000019831717 207164383 /nfs/dbraw/zinc/16/43/83/207164383.db2.gz WQKORBCRRHOCDB-UHFFFAOYSA-N 1 1 383.967 4.122 50 0 GIAAMO CNC(=O)c1ccc([C@@H]2CCC[N@H+]2Cc2cc(C)n(-c3cccnc3)c2C)s1 ZINC000020203484 207181649 /nfs/dbraw/zinc/18/16/49/207181649.db2.gz WRNXTSBSTFUCDK-IBGZPJMESA-N 1 1 394.544 4.247 50 0 GIAAMO c1csc(Cc2n[nH]c3c2C[N@H+](C2CCN(c4ccccc4)CC2)CC3)c1 ZINC000020202474 207182256 /nfs/dbraw/zinc/18/22/56/207182256.db2.gz DNUQYCGDZYKFFB-UHFFFAOYSA-N 1 1 378.545 4.089 50 0 GIAAMO c1csc(Cc2[nH]nc3c2C[N@@H+](C2CCN(c4ccccc4)CC2)CC3)c1 ZINC000020202474 207182262 /nfs/dbraw/zinc/18/22/62/207182262.db2.gz DNUQYCGDZYKFFB-UHFFFAOYSA-N 1 1 378.545 4.089 50 0 GIAAMO c1csc(Cc2[nH]nc3c2C[N@H+](C2CCN(c4ccccc4)CC2)CC3)c1 ZINC000020202474 207182266 /nfs/dbraw/zinc/18/22/66/207182266.db2.gz DNUQYCGDZYKFFB-UHFFFAOYSA-N 1 1 378.545 4.089 50 0 GIAAMO COCc1cc(=O)[nH]c(-c2cccc(C[N@@H+](C)[C@@H]3CCCc4ccccc43)c2)n1 ZINC000020235948 207183751 /nfs/dbraw/zinc/18/37/51/207183751.db2.gz WHLMLCCYCDJMDH-JOCHJYFZSA-N 1 1 389.499 4.093 50 0 GIAAMO CCOc1ccc2oc(=O)cc(C[NH+]3CCN(c4cccc(Cl)c4)CC3)c2c1 ZINC000020352965 207187787 /nfs/dbraw/zinc/18/77/87/207187787.db2.gz VVUZBRUNESHIHO-UHFFFAOYSA-N 1 1 398.890 4.167 50 0 GIAAMO CC[C@H]1CCCC[N@H+]1CCCNC(=O)c1nn(C)c2c1CSc1ccccc1-2 ZINC000020485016 207197665 /nfs/dbraw/zinc/19/76/65/207197665.db2.gz LZZOBNPCXLBZMY-INIZCTEOSA-N 1 1 398.576 4.077 50 0 GIAAMO OCC[C@@H]1C[N@@H+](Cc2cccc(-c3ccco3)c2)CCN1Cc1ccsc1 ZINC000020534767 207201160 /nfs/dbraw/zinc/20/11/60/207201160.db2.gz RWTUMMZKIFWLHV-OAQYLSRUSA-N 1 1 382.529 4.077 50 0 GIAAMO CCCCSc1nc2sc3c(c2c(=O)n1Cc1ccccc1)CC[N@@H+](C)C3 ZINC000020813197 207214762 /nfs/dbraw/zinc/21/47/62/207214762.db2.gz VPJDWIIKMUFOIC-UHFFFAOYSA-N 1 1 399.585 4.386 50 0 GIAAMO CCCCSc1nc2sc3c(c2c(=O)n1Cc1ccccc1)CC[N@H+](C)C3 ZINC000020813197 207214766 /nfs/dbraw/zinc/21/47/66/207214766.db2.gz VPJDWIIKMUFOIC-UHFFFAOYSA-N 1 1 399.585 4.386 50 0 GIAAMO Cc1oc(-c2cccc(F)c2)nc1C[NH+]1CCC(C(=O)N2CCCCC2)CC1 ZINC000020782433 207214996 /nfs/dbraw/zinc/21/49/96/207214996.db2.gz QUIMNJHYYMMFAQ-UHFFFAOYSA-N 1 1 385.483 4.014 50 0 GIAAMO Clc1cccc(-c2n[nH]c3c2C[N@H+]([C@@H]2CCN(c4ccccc4)C2)CC3)c1 ZINC000020855202 207216082 /nfs/dbraw/zinc/21/60/82/207216082.db2.gz IYLUEXCMQOKFFV-LJQANCHMSA-N 1 1 378.907 4.367 50 0 GIAAMO CC[C@@](O)(c1ccc(OC)cc1)[C@H](C[NH+]1CCOCC1)c1ccc(Cl)cc1 ZINC000020868262 207216733 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O=C(CCCc1c[nH]c2ccccc12)N1CCC[N@@H+](Cc2ccccc2)CC1 ZINC000022610896 207258266 /nfs/dbraw/zinc/25/82/66/207258266.db2.gz SZHBPHBODITBIX-UHFFFAOYSA-N 1 1 375.516 4.225 50 0 GIAAMO Cn1cc(C[N@@H+](C)[C@@H]2CCCN(Cc3ccccc3F)C2)c(-c2ccccc2)n1 ZINC000023358951 207274618 /nfs/dbraw/zinc/27/46/18/207274618.db2.gz JCCUHWNEAQBIAH-JOCHJYFZSA-N 1 1 392.522 4.323 50 0 GIAAMO c1cc(CN2CC[NH+](Cc3c(-c4ccccc4)nc4ccccn43)CC2)cs1 ZINC000022927086 207266269 /nfs/dbraw/zinc/26/62/69/207266269.db2.gz QLOQPBUILLVSBR-UHFFFAOYSA-N 1 1 388.540 4.381 50 0 GIAAMO c1cc(C[NH+]2CCN(Cc3c(-c4ccccc4)nc4ccccn43)CC2)cs1 ZINC000022927086 207266273 /nfs/dbraw/zinc/26/62/73/207266273.db2.gz QLOQPBUILLVSBR-UHFFFAOYSA-N 1 1 388.540 4.381 50 0 GIAAMO O=C(CCc1ccsc1)N1CCN(c2cc[nH+]c3cc(Cl)ccc32)CC1 ZINC000023875632 207284742 /nfs/dbraw/zinc/28/47/42/207284742.db2.gz PTGCHIOQCCPDHL-UHFFFAOYSA-N 1 1 385.920 4.231 50 0 GIAAMO O=C1c2ccccc2C(=O)N1CCCC[N@@H+](Cc1ccco1)Cc1cccs1 ZINC000024540606 207292117 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GIAAMO COc1ccc2cc(C[N@@H+](C)CC(=O)N[C@H](C)c3ccccc3C)ccc2c1 ZINC000012784504 571038064 /nfs/dbraw/zinc/03/80/64/571038064.db2.gz VABKFJAFSMEILT-GOSISDBHSA-N 1 1 376.500 4.466 50 0 GIAAMO COc1ccc(Cl)cc1NC(=S)N1CCC([N@@H+](C)C2CCCC2)CC1 ZINC000003058443 817416187 /nfs/dbraw/zinc/41/61/87/817416187.db2.gz WKKSBUGQLOMYGC-UHFFFAOYSA-N 1 1 381.973 4.384 50 0 GIAAMO COc1cccc(NC(=S)N2CCC([N@@H+](C)[C@@H]3CCCC[C@H]3C)CC2)c1 ZINC000003058555 817416286 /nfs/dbraw/zinc/41/62/86/817416286.db2.gz FOGLTNKIXDBLGA-OXQOHEQNSA-N 1 1 375.582 4.367 50 0 GIAAMO CC1(C)C(=O)Nc2ccccc2N1C(=O)C[NH2+]C(c1ccccc1)c1ccccc1 ZINC000057312705 823278804 /nfs/dbraw/zinc/27/88/04/823278804.db2.gz JEBLEGCLWBSFOP-UHFFFAOYSA-N 1 1 399.494 4.130 50 0 GIAAMO Cc1nn(-c2ccccc2)c(C)c1NC(=O)C[NH2+][C@H](C)c1ccccc1Cl ZINC000057303840 823277471 /nfs/dbraw/zinc/27/74/71/823277471.db2.gz WRLQLLAIWRQPHN-CQSZACIVSA-N 1 1 382.895 4.432 50 0 GIAAMO CCCN1CCC([NH2+][C@H]2CC(C)(C)Cc3c2cnn3-c2ccc(F)cc2)CC1 ZINC000011663000 818106773 /nfs/dbraw/zinc/10/67/73/818106773.db2.gz FYVJTLWNCWLZCQ-NRFANRHFSA-N 1 1 384.543 4.489 50 0 GIAAMO COCc1ccc(C(=O)N2CC[C@@]3(C2)CCC[N@@H+](CCc2ccccc2)C3)s1 ZINC000011700459 818110188 /nfs/dbraw/zinc/11/01/88/818110188.db2.gz YSTGCMKGEHYLSZ-QHCPKHFHSA-N 1 1 398.572 4.065 50 0 GIAAMO Cc1nc2sccn2c1C[N@H+]1CCC[C@@](CO)(Cc2cccc(Cl)c2)C1 ZINC000012444651 818160153 /nfs/dbraw/zinc/16/01/53/818160153.db2.gz MEFBLEYOTYGHOM-HXUWFJFHSA-N 1 1 389.952 4.175 50 0 GIAAMO CCCn1ncc(C[N@H+]2CCC[C@H](C(=O)c3cccc(OC(C)C)c3)C2)c1C ZINC000013595451 818213931 /nfs/dbraw/zinc/21/39/31/818213931.db2.gz TXMPMEQLXDHGQS-FQEVSTJZSA-N 1 1 383.536 4.484 50 0 GIAAMO C[N@@H+](Cc1nccs1)[C@H]1CCC(=O)N(Cc2ccc3ccccc3c2)CC1 ZINC000014879682 818273914 /nfs/dbraw/zinc/27/39/14/818273914.db2.gz FZQBYFYJYVHCMI-FQEVSTJZSA-N 1 1 379.529 4.309 50 0 GIAAMO Cc1ncc(CN2CC[C@]3(C2)CCC[N@H+](Cc2ccc(C(C)C)cc2)C3)cn1 ZINC000014959242 818279208 /nfs/dbraw/zinc/27/92/08/818279208.db2.gz PLVBUWMPMYZDOS-XMMPIXPASA-N 1 1 378.564 4.397 50 0 GIAAMO O=C(Cc1ccccc1F)Nc1ccc2c(c1)C[N@H+](Cc1cccc(O)c1)CC2 ZINC000014980894 818280582 /nfs/dbraw/zinc/28/05/82/818280582.db2.gz NEIOPNSLKKLVPP-UHFFFAOYSA-N 1 1 390.458 4.271 50 0 GIAAMO O=C(Cc1ccccc1F)Nc1ccc2c(c1)C[N@@H+](Cc1cccc(O)c1)CC2 ZINC000014980894 818280587 /nfs/dbraw/zinc/28/05/87/818280587.db2.gz NEIOPNSLKKLVPP-UHFFFAOYSA-N 1 1 390.458 4.271 50 0 GIAAMO Cc1ccc(-n2cccn2)c(C[N@H+]2CCC[C@@](CO)(CCc3ccccc3)C2)c1 ZINC000015078323 818288229 /nfs/dbraw/zinc/28/82/29/818288229.db2.gz DEYGXKYVGMOGQL-RUZDIDTESA-N 1 1 389.543 4.388 50 0 GIAAMO O=C(C1CCOCC1)N1CC[C@H]2[C@H](CCC[N@H+]2Cc2cc3ccccc3s2)C1 ZINC000020600078 818626480 /nfs/dbraw/zinc/62/64/80/818626480.db2.gz WIXSBHAUEBDPPM-CTNGQTDRSA-N 1 1 398.572 4.141 50 0 GIAAMO O=c1cc(C2CCC2)nc(-c2cccc(C[N@@H+]3CCC[C@@H](C(F)(F)F)C3)c2)[nH]1 ZINC000023398781 818933761 /nfs/dbraw/zinc/93/37/61/818933761.db2.gz FKXHHLBTZFHYRI-QGZVFWFLSA-N 1 1 391.437 4.479 50 0 GIAAMO Cc1[nH+]ccn1-c1ccc(CNC(=O)c2nc(-c3cccs3)oc2C)cc1F ZINC000058412431 823387402 /nfs/dbraw/zinc/38/74/02/823387402.db2.gz XFHYXSZWMFIBPM-UHFFFAOYSA-N 1 1 396.447 4.275 50 0 GIAAMO O=C(NCC[N@H+]1CCc2ccccc2C1)C1c2ccccc2Oc2ccccc21 ZINC000031338027 820795297 /nfs/dbraw/zinc/79/52/97/820795297.db2.gz LBWZBQAXLLAZJS-UHFFFAOYSA-N 1 1 384.479 4.099 50 0 GIAAMO Cc1ccc(C(=O)CCC(=O)NC[C@@H](c2ccco2)[NH+]2CCCCC2)cc1C ZINC000039984937 821124585 /nfs/dbraw/zinc/12/45/85/821124585.db2.gz XKYQZHGHFRSDQK-FQEVSTJZSA-N 1 1 382.504 4.203 50 0 GIAAMO O=C(C[N@H+]1CCC[C@@H](c2cc3ccccc3[nH]2)C1)NCCCc1ccccc1 ZINC000040135394 821146468 /nfs/dbraw/zinc/14/64/68/821146468.db2.gz UGOFCYAQTNCDBG-OAQYLSRUSA-N 1 1 375.516 4.096 50 0 GIAAMO CC(C)Oc1cccc(C(=O)[C@@H]2CCC[N@H+](C3CSCCSC3)C2)c1 ZINC000055120045 822939725 /nfs/dbraw/zinc/93/97/25/822939725.db2.gz OEZZBJFYPXYSNW-QGZVFWFLSA-N 1 1 379.591 4.217 50 0 GIAAMO Fc1ccc(N[C@@H]2CCC[N@@H+](Cc3cnc(N4CCCC4)s3)C2)cc1F ZINC000055183008 822944139 /nfs/dbraw/zinc/94/41/39/822944139.db2.gz CBVAAAFWOWRKCG-OAHLLOKOSA-N 1 1 378.492 4.098 50 0 GIAAMO CC(=O)Nc1ccc(CN2CC[C@]3(C2)CCC[N@@H+](CCc2ccccc2)C3)cc1 ZINC000055226582 822946951 /nfs/dbraw/zinc/94/69/51/822946951.db2.gz HIXGEQYBXFJUQN-RUZDIDTESA-N 1 1 391.559 4.176 50 0 GIAAMO O=C(c1ccccc1OC[C@H]1CCC[N@@H+](Cc2ccsc2)C1)N1CCCC1 ZINC000169765168 823913968 /nfs/dbraw/zinc/91/39/68/823913968.db2.gz QABKVIYMRXARJI-SFHVURJKSA-N 1 1 384.545 4.275 50 0 GIAAMO COc1ccccc1-c1ccc(-c2ccc([C@H](C)[NH+]3CCOCC3)cc2)nn1 ZINC000426563150 231241424 /nfs/dbraw/zinc/24/14/24/231241424.db2.gz DFIGLPQEFWGGAI-KRWDZBQOSA-N 1 1 375.472 4.212 50 0 GIAAMO C[C@@H](c1ccc(-c2ccc(OCC[NH+]3CCCC3)cc2)cc1)N1CCOCC1 ZINC000426689134 231252772 /nfs/dbraw/zinc/25/27/72/231252772.db2.gz HTQDRGWJUCJZEH-FQEVSTJZSA-N 1 1 380.532 4.221 50 0 GIAAMO O=C(N[C@H]1CCc2ccccc21)[C@@]1(C(F)(F)F)CC[N@@H+](Cc2ccccc2)C1 ZINC000229729933 206260320 /nfs/dbraw/zinc/26/03/20/206260320.db2.gz XSBXZBORHPOUBY-PZJWPPBQSA-N 1 1 388.433 4.245 50 0 GIAAMO Cc1ccc2c(c1)C1=C([C@@H](c3ccccc3)O2)[C@H](c2cccnc2)N2NC=NC2=[NH+]1 ZINC000005489910 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GIAAMO COc1cccc(C[N@@H+]2CCC[C@]3(CCN(Cc4ccc(C)o4)C3)C2)c1OC ZINC000014981489 207038310 /nfs/dbraw/zinc/03/83/10/207038310.db2.gz MKRQXDJUTDXHHF-QHCPKHFHSA-N 1 1 384.520 4.093 50 0 GIAAMO COc1cccc(C[N@H+]2CCC[C@]3(CCN(Cc4ccc(C)o4)C3)C2)c1OC ZINC000014981489 207038313 /nfs/dbraw/zinc/03/83/13/207038313.db2.gz MKRQXDJUTDXHHF-QHCPKHFHSA-N 1 1 384.520 4.093 50 0 GIAAMO Cc1cccc(-c2c[nH]nc2[C@@H]2CCC[N@@H+](Cc3ccc4c(c3)OCO4)C2)c1 ZINC000014986475 207039497 /nfs/dbraw/zinc/03/94/97/207039497.db2.gz COUWCGVTYWITPG-LJQANCHMSA-N 1 1 375.472 4.493 50 0 GIAAMO CC(C)NC(=O)[C@@H]1C[C@@H](Sc2ccc(F)cc2)C[N@H+]1C1Cc2ccccc2C1 ZINC000014999659 207039861 /nfs/dbraw/zinc/03/98/61/207039861.db2.gz VMPDTRPFXPCOFJ-YADHBBJMSA-N 1 1 398.547 4.053 50 0 GIAAMO O=C(NC[C@@H]1CCC[N@H+](Cc2ccc(C(F)(F)F)cc2)C1)c1cccs1 ZINC000015077041 207045947 /nfs/dbraw/zinc/04/59/47/207045947.db2.gz NVXJFVZAIJHIDG-HNNXBMFYSA-N 1 1 382.451 4.409 50 0 GIAAMO CCCn1cc(CN(C)C[C@@H]2CCC[N@@H+](CCc3ccccc3F)C2)c(C)n1 ZINC000015074395 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394.540 4.273 50 0 GIAAMO Cc1ccc([C@H](NC(=O)C[N@@H+](C)CCOc2ccccc2)c2cccs2)cc1 ZINC000016694955 207076711 /nfs/dbraw/zinc/07/67/11/207076711.db2.gz COVNKMIEXZIRGF-QHCPKHFHSA-N 1 1 394.540 4.273 50 0 GIAAMO CCOc1ccccc1-c1nc(C[N@H+]2CCC[C@@H](C(=O)N(CC)CC)C2)c(C)o1 ZINC000019111959 207102922 /nfs/dbraw/zinc/10/29/22/207102922.db2.gz XVISCZZQDSZHCO-GOSISDBHSA-N 1 1 399.535 4.129 50 0 GIAAMO Fc1ccccc1N1CCN([C@@H]2CCC[N@@H+](Cc3c[nH]c4ccccc34)C2)CC1 ZINC000019740920 207157092 /nfs/dbraw/zinc/15/70/92/207157092.db2.gz UKEAKKWVVWWOMX-HXUWFJFHSA-N 1 1 392.522 4.094 50 0 GIAAMO CSc1ccc(CN2CCC([NH+]3CCN(Cc4ccccc4)CC3)CC2)cc1 ZINC000019885508 207167561 /nfs/dbraw/zinc/16/75/61/207167561.db2.gz LNDFKUDZKHXSHK-UHFFFAOYSA-N 1 1 395.616 4.191 50 0 GIAAMO O=C(C1c2ccccc2Oc2ccccc21)N1CC[NH+](Cc2ccccc2)CC1 ZINC000019781774 207161639 /nfs/dbraw/zinc/16/16/39/207161639.db2.gz DMQPQTPJIIDGMN-UHFFFAOYSA-N 1 1 384.479 4.269 50 0 GIAAMO c1ccc(N2CCN([C@H]3CCC[N@H+](Cc4cccc5cccnc54)C3)CC2)cc1 ZINC000020204767 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399.535 4.207 50 0 GIAAMO Cc1cnc(C2CCOCC2)n1[C@H]1CC[N@H+](Cc2cn(C)c3ccccc23)C1 ZINC000575550866 823976137 /nfs/dbraw/zinc/97/61/37/823976137.db2.gz YXLDCNJMSWCNOW-FQEVSTJZSA-N 1 1 378.520 4.024 50 0 GIAAMO O=C(Nc1ccc(F)cc1)[C@H](c1ccccc1)[NH+]1CCC(n2cccn2)CC1 ZINC000328589924 206229716 /nfs/dbraw/zinc/22/97/16/206229716.db2.gz SHRGIISNSSACRJ-NRFANRHFSA-N 1 1 378.451 4.039 50 0 GIAAMO Cc1cc2oc(=O)cc(C[NH+]3CCN(c4ccccc4)CC3)c2c(C)c1Cl ZINC000054220040 206278766 /nfs/dbraw/zinc/27/87/66/206278766.db2.gz XKUDLTYHHWOMSH-UHFFFAOYSA-N 1 1 382.891 4.385 50 0 GIAAMO Cn1ccc2cc(C(=O)N3CCCC4=C[C@H]5C[C@H](C[N@H+]6CCCC[C@H]56)[C@@H]43)ccc21 ZINC000257198575 206287842 /nfs/dbraw/zinc/28/78/42/206287842.db2.gz CNRGJYDKCFDOQL-XWVZOOPGSA-N 1 1 389.543 4.214 50 0 GIAAMO C(=C/c1ccccc1)\C[NH+]1CCN(c2ncnc3sc4c(c32)CCCC4)CC1 ZINC000000894549 206332363 /nfs/dbraw/zinc/33/23/63/206332363.db2.gz URSXOZPUDGSUIV-RMKNXTFCSA-N 1 1 390.556 4.406 50 0 GIAAMO Fc1ccccc1N1CCN(C2CC[NH+](Cc3ccccc3Cl)CC2)CC1 ZINC000001165887 206361636 /nfs/dbraw/zinc/36/16/36/206361636.db2.gz NUFQCIZPULNKKT-UHFFFAOYSA-N 1 1 387.930 4.266 50 0 GIAAMO CCCC[N@@H+](CC)CC(=O)Nc1sc2c(c1C(=O)OCC)CC[C@H](C)C2 ZINC000001778602 206391579 /nfs/dbraw/zinc/39/15/79/206391579.db2.gz QLOVZEHMDFBBJS-AWEZNQCLSA-N 1 1 380.554 4.110 50 0 GIAAMO C[C@@H]1CCC[C@H](C)[N@@H+]1CCCNC(=O)c1nn(C)c2c1CSc1ccccc1-2 ZINC000006817701 206682505 /nfs/dbraw/zinc/68/25/05/206682505.db2.gz NNUUXVLGCLCFMP-IYBDPMFKSA-N 1 1 398.576 4.076 50 0 GIAAMO CC(C)[N@@H+](Cc1ccccc1)CN1C(=O)NC2(CCC(C(C)(C)C)CC2)C1=O ZINC000014245573 207017659 /nfs/dbraw/zinc/01/76/59/207017659.db2.gz UDNOQCNBCMULLA-UHFFFAOYSA-N 1 1 385.552 4.381 50 0 GIAAMO CC(C)[N@H+](Cc1ccccc1)CN1C(=O)NC2(CCC(C(C)(C)C)CC2)C1=O ZINC000014245573 207017663 /nfs/dbraw/zinc/01/76/63/207017663.db2.gz UDNOQCNBCMULLA-UHFFFAOYSA-N 1 1 385.552 4.381 50 0 GIAAMO O=C(Nc1ccc(-c2cscn2)cc1)[C@@H]1CCC[N@H+](Cc2cccc(O)c2)C1 ZINC000014949528 207033176 /nfs/dbraw/zinc/03/31/76/207033176.db2.gz LPTPDCXJDMERPT-GOSISDBHSA-N 1 1 393.512 4.366 50 0 GIAAMO C[N@H+](Cc1nc(COc2ccccc2)no1)C[C@]1(c2ccccc2)CC1(C)C ZINC000014965640 207034282 /nfs/dbraw/zinc/03/42/82/207034282.db2.gz KFBKEIKEWPQKGH-QHCPKHFHSA-N 1 1 377.488 4.448 50 0 GIAAMO C[N@@H+](Cc1nc(COc2ccccc2)no1)C[C@]1(c2ccccc2)CC1(C)C ZINC000014965640 207034285 /nfs/dbraw/zinc/03/42/85/207034285.db2.gz KFBKEIKEWPQKGH-QHCPKHFHSA-N 1 1 377.488 4.448 50 0 GIAAMO CCN(Cc1cnn(C(C)C)c1)C[C@H]1CCC[N@@H+](CCc2cccc(OC)c2)C1 ZINC000014968654 207035265 /nfs/dbraw/zinc/03/52/65/207035265.db2.gz HYTXEDZJZZZLOV-JOCHJYFZSA-N 1 1 398.595 4.249 50 0 GIAAMO CC(C)/C=C/C(=O)NCC[N@H+]1Cc2ccccc2O[C@H](c2ccccc2F)C1 ZINC000014986829 207038239 /nfs/dbraw/zinc/03/82/39/207038239.db2.gz HWSHBJWDLIKATJ-LEQVUBRHSA-N 1 1 382.479 4.090 50 0 GIAAMO CC(C)/C=C/C(=O)NCC[N@@H+]1Cc2ccccc2O[C@H](c2ccccc2F)C1 ZINC000014986829 207038242 /nfs/dbraw/zinc/03/82/42/207038242.db2.gz HWSHBJWDLIKATJ-LEQVUBRHSA-N 1 1 382.479 4.090 50 0 GIAAMO Cc1cccc(C[N@@H+]2CCC[C@]3(CCN(C(=O)c4cc(C(C)C)no4)C3)C2)c1 ZINC000014980434 207038726 /nfs/dbraw/zinc/03/87/26/207038726.db2.gz CCRDEOWYZOVFDJ-QHCPKHFHSA-N 1 1 381.520 4.235 50 0 GIAAMO C[N@H+]1CCC[C@H](COc2cccc(CN(C(=O)C3CCCCC3)C3CC3)c2)C1 ZINC000014984965 207039528 /nfs/dbraw/zinc/03/95/28/207039528.db2.gz DRLXSSSNSMJJCD-FQEVSTJZSA-N 1 1 384.564 4.479 50 0 GIAAMO Cc1ccc(C)c(-n2cc(C[N@H+]3CCC[C@@H](CO)C3)c(-c3ccccc3)n2)c1 ZINC000015074083 207045212 /nfs/dbraw/zinc/04/52/12/207045212.db2.gz FCIRKEGGDHQIHI-HXUWFJFHSA-N 1 1 375.516 4.360 50 0 GIAAMO COc1ccc(NC(=O)CC[C@H]2CCC[N@@H+](Cc3cccc(C)n3)C2)c(C)c1 ZINC000015078687 207046497 /nfs/dbraw/zinc/04/64/97/207046497.db2.gz RQCALOABTPWURX-LJQANCHMSA-N 1 1 381.520 4.338 50 0 GIAAMO O=C(NC[C@H]1CCC[N@H+](Cc2ccc(C(F)(F)F)cc2)C1)c1cccs1 ZINC000015077043 207047236 /nfs/dbraw/zinc/04/72/36/207047236.db2.gz NVXJFVZAIJHIDG-OAHLLOKOSA-N 1 1 382.451 4.409 50 0 GIAAMO CCOC(=O)[C@@]1(Cc2ccccc2)CCC[N@@H+](Cc2c(C)nc3sccn23)C1 ZINC000015074246 207043892 /nfs/dbraw/zinc/04/38/92/207043892.db2.gz DEHPLDBUVATIAC-JOCHJYFZSA-N 1 1 397.544 4.092 50 0 GIAAMO Cc1ccc(C)c(-n2cc(C[N@H+]3CCC[C@H](CO)C3)c(-c3ccccc3)n2)c1 ZINC000015074084 207044194 /nfs/dbraw/zinc/04/41/94/207044194.db2.gz FCIRKEGGDHQIHI-FQEVSTJZSA-N 1 1 375.516 4.360 50 0 GIAAMO COc1ccc(OC)c([C@@H]2CCC[N@@H+]2CC(=O)N(C)[C@@H](C)c2ccccc2)c1 ZINC000015312668 207050120 /nfs/dbraw/zinc/05/01/20/207050120.db2.gz GBLVEHXGTCVVAT-UWJYYQICSA-N 1 1 382.504 4.060 50 0 GIAAMO COc1ccc(OC)c([C@@H]2CCC[N@H+]2CC(=O)N(C)[C@@H](C)c2ccccc2)c1 ZINC000015312668 207050124 /nfs/dbraw/zinc/05/01/24/207050124.db2.gz GBLVEHXGTCVVAT-UWJYYQICSA-N 1 1 382.504 4.060 50 0 GIAAMO COc1ccc(OC)c([C@H]2CCC[N@H+]2Cc2cc(=O)oc3cc(C)ccc23)c1 ZINC000015518394 207050724 /nfs/dbraw/zinc/05/07/24/207050724.db2.gz SOJGSXFXQBWUFR-HXUWFJFHSA-N 1 1 379.456 4.456 50 0 GIAAMO O=C(c1ccccn1)[C@H]1CCC[N@@H+](Cc2c[nH]nc2-c2cc3ccccc3o2)C1 ZINC000015961802 207069631 /nfs/dbraw/zinc/06/96/31/207069631.db2.gz WGTJRKGDOHMTBK-KRWDZBQOSA-N 1 1 386.455 4.313 50 0 GIAAMO O=C(Nc1ccccc1)C1CC[NH+](Cc2cc(Cl)cc3c2OCOC3)CC1 ZINC000016695337 207077904 /nfs/dbraw/zinc/07/79/04/207077904.db2.gz UFEKRXPNTSPAPB-UHFFFAOYSA-N 1 1 386.879 4.057 50 0 GIAAMO O=C(Nc1cccc(Cl)c1)N(CCC[NH+]1CCOCC1)C[C@H]1CC=CCC1 ZINC000017080054 207084280 /nfs/dbraw/zinc/08/42/80/207084280.db2.gz JRKLOCPWWFYXIC-SFHVURJKSA-N 1 1 391.943 4.253 50 0 GIAAMO C[C@H]([NH2+]CC(=O)Nc1cccc2nsnc21)c1ccc(Cl)cc1Cl ZINC000019110532 207102906 /nfs/dbraw/zinc/10/29/06/207102906.db2.gz WVHBZUZWOLFFID-VIFPVBQESA-N 1 1 381.288 4.287 50 0 GIAAMO COc1cccc([C@@H]2CC[N@H+](Cc3nc(-c4cccc(Cl)c4)no3)C2)c1OC ZINC000019745771 207158342 /nfs/dbraw/zinc/15/83/42/207158342.db2.gz SKXBNCPYDSNWRN-OAHLLOKOSA-N 1 1 399.878 4.397 50 0 GIAAMO COc1cccc([C@@H]2CC[N@@H+](Cc3nc(-c4cccc(Cl)c4)no3)C2)c1OC ZINC000019745771 207158344 /nfs/dbraw/zinc/15/83/44/207158344.db2.gz SKXBNCPYDSNWRN-OAHLLOKOSA-N 1 1 399.878 4.397 50 0 GIAAMO OCC[C@@H]1CN(Cc2cccc(-c3ccco3)c2)CC[N@H+]1Cc1cccs1 ZINC000019839685 207166110 /nfs/dbraw/zinc/16/61/10/207166110.db2.gz QCUHDTCFJIXAEB-HXUWFJFHSA-N 1 1 382.529 4.077 50 0 GIAAMO Cn1cc(NC(=O)c2ccc([C@@H]3CCC[N@@H+]3C/C=C/c3ccco3)s2)cn1 ZINC000019792482 207160869 /nfs/dbraw/zinc/16/08/69/207160869.db2.gz DHTNIJSNBYNPRL-RTZWDOBSSA-N 1 1 382.489 4.177 50 0 GIAAMO Cn1cc(NC(=O)c2ccc([C@@H]3CCC[N@H+]3C/C=C/c3ccco3)s2)cn1 ZINC000019792482 207160873 /nfs/dbraw/zinc/16/08/73/207160873.db2.gz DHTNIJSNBYNPRL-RTZWDOBSSA-N 1 1 382.489 4.177 50 0 GIAAMO COc1ccccc1N1CCN([C@H]2CCC[N@@H+](CCCC3CCCC3)C2)CC1 ZINC000019773513 207161003 /nfs/dbraw/zinc/16/10/03/207161003.db2.gz SPDKJAHHONYPBM-QFIPXVFZSA-N 1 1 385.596 4.252 50 0 GIAAMO Cc1ccsc1C(=O)[C@@H]1CCC[N@H+](Cc2cnc(N3CCCC3)s2)C1 ZINC000019788851 207161851 /nfs/dbraw/zinc/16/18/51/207161851.db2.gz VDZSFIRKUJBPOK-OAHLLOKOSA-N 1 1 375.563 4.208 50 0 GIAAMO Cc1ccsc1C(=O)[C@@H]1CCC[N@@H+](Cc2cnc(N3CCCC3)s2)C1 ZINC000019788851 207161855 /nfs/dbraw/zinc/16/18/55/207161855.db2.gz VDZSFIRKUJBPOK-OAHLLOKOSA-N 1 1 375.563 4.208 50 0 GIAAMO S=C(NC1CCCC1)N1CC[NH+](C(c2ccccc2)c2ccccc2)CC1 ZINC000019798340 207163139 /nfs/dbraw/zinc/16/31/39/207163139.db2.gz JPDWFYRJLBFJQY-UHFFFAOYSA-N 1 1 379.573 4.211 50 0 GIAAMO C[C@@H](Oc1ccc(Cl)cc1Cl)C(=O)N1CC[NH+](Cc2ccccc2)CC1 ZINC000019809442 207163644 /nfs/dbraw/zinc/16/36/44/207163644.db2.gz XKBZEWWVGMKDRL-OAHLLOKOSA-N 1 1 393.314 4.105 50 0 GIAAMO CN1CC[NH+](CCC(=O)N2c3ccccc3Sc3ccc(Cl)cc32)CC1 ZINC000020191296 207181690 /nfs/dbraw/zinc/18/16/90/207181690.db2.gz POTWBOICYBGNOO-UHFFFAOYSA-N 1 1 387.936 4.107 50 0 GIAAMO C[NH+]1CCN(C(=O)CC2(c3ccc(Cl)cc3)C3CC4CC(C3)CC2C4)CC1 ZINC000020389017 207189994 /nfs/dbraw/zinc/18/99/94/207189994.db2.gz XDUFXJIZTFOCLG-UHFFFAOYSA-N 1 1 386.967 4.198 50 0 GIAAMO CC(C)Oc1cccc(C(=O)[C@H]2CCC[N@H+](Cc3cnc(N(C)C)s3)C2)c1 ZINC000020601509 207206314 /nfs/dbraw/zinc/20/63/14/207206314.db2.gz HKYSINWIAVKYJC-KRWDZBQOSA-N 1 1 387.549 4.091 50 0 GIAAMO CC(C)Oc1cccc(C(=O)[C@H]2CCC[N@@H+](Cc3cnc(N(C)C)s3)C2)c1 ZINC000020601509 207206318 /nfs/dbraw/zinc/20/63/18/207206318.db2.gz HKYSINWIAVKYJC-KRWDZBQOSA-N 1 1 387.549 4.091 50 0 GIAAMO CCN(C(=O)Cn1c(C[NH+]2CCCCC2)nc2ccccc21)c1ccccc1 ZINC000021171106 207228144 /nfs/dbraw/zinc/22/81/44/207228144.db2.gz ZEXIXKFNUNYCMN-UHFFFAOYSA-N 1 1 376.504 4.075 50 0 GIAAMO COc1cc(Nc2ncc3c(n2)CC[N@@H+](Cc2cccc(C)c2)C3)cc(OC)c1 ZINC000021261557 207228959 /nfs/dbraw/zinc/22/89/59/207228959.db2.gz FNXAJOKREZZIPP-UHFFFAOYSA-N 1 1 390.487 4.104 50 0 GIAAMO COc1cc(Nc2ncc3c(n2)CC[N@H+](Cc2cccc(C)c2)C3)cc(OC)c1 ZINC000021261557 207228963 /nfs/dbraw/zinc/22/89/63/207228963.db2.gz FNXAJOKREZZIPP-UHFFFAOYSA-N 1 1 390.487 4.104 50 0 GIAAMO Cc1ccc([C@@H](CNC(=O)c2cc(-c3ccc(C)cc3)on2)[NH+]2CCCC2)o1 ZINC000021659810 207233682 /nfs/dbraw/zinc/23/36/82/207233682.db2.gz WNUJNEQTXATBFJ-LJQANCHMSA-N 1 1 379.460 4.118 50 0 GIAAMO CC[C@@H]1CCCC[N@H+]1CCCNc1ncnc2onc(-c3ccc(F)cc3)c21 ZINC000021714618 207234701 /nfs/dbraw/zinc/23/47/01/207234701.db2.gz MQKMESYDJSIYJV-QGZVFWFLSA-N 1 1 383.471 4.490 50 0 GIAAMO Cc1ccc(-c2cc(C(=O)NC[C@H](c3ccccc3Cl)[NH+](C)C)no2)cc1 ZINC000021807586 207238802 /nfs/dbraw/zinc/23/88/02/207238802.db2.gz HPQYHXVZISXALM-LJQANCHMSA-N 1 1 383.879 4.336 50 0 GIAAMO C[C@H]1CCC[N@@H+](CCCNC(=O)c2cc(-c3cccnc3)nc3ccccc32)C1 ZINC000021934599 207243027 /nfs/dbraw/zinc/24/30/27/207243027.db2.gz QRBHFCRRFREVOY-SFHVURJKSA-N 1 1 388.515 4.149 50 0 GIAAMO Fc1ccccc1-c1noc2c1CN([C@@H]1CC[N@@H+](Cc3ccccc3)C1)CC2 ZINC000023358325 207276160 /nfs/dbraw/zinc/27/61/60/207276160.db2.gz YMDIEHZYTDDEKF-GOSISDBHSA-N 1 1 377.463 4.113 50 0 GIAAMO O=C(CN1CC[NH+](Cc2csc3ccccc23)CC1)Nc1ccccc1Cl ZINC000022932342 207265344 /nfs/dbraw/zinc/26/53/44/207265344.db2.gz VZTZVEJQLLWGFZ-UHFFFAOYSA-N 1 1 399.947 4.311 50 0 GIAAMO Cc1cccn2c(=O)cc(C[N@@H+]3CCc4sccc4[C@H]3c3cccs3)nc12 ZINC000023864631 207284938 /nfs/dbraw/zinc/28/49/38/207284938.db2.gz KJTNKEBGTQHFIZ-FQEVSTJZSA-N 1 1 393.537 4.274 50 0 GIAAMO Cc1cccn2c(=O)cc(C[N@H+]3CCc4sccc4[C@H]3c3cccs3)nc12 ZINC000023864631 207284940 /nfs/dbraw/zinc/28/49/40/207284940.db2.gz KJTNKEBGTQHFIZ-FQEVSTJZSA-N 1 1 393.537 4.274 50 0 GIAAMO Cc1cccc2nc(C[N@@H+]3CCc4sccc4[C@H]3c3cccs3)cc(=O)n12 ZINC000023864527 207285134 /nfs/dbraw/zinc/28/51/34/207285134.db2.gz LRXVDWBBPILUEP-NRFANRHFSA-N 1 1 393.537 4.274 50 0 GIAAMO Cc1cccc2nc(C[N@H+]3CCc4sccc4[C@H]3c3cccs3)cc(=O)n12 ZINC000023864527 207285136 /nfs/dbraw/zinc/28/51/36/207285136.db2.gz LRXVDWBBPILUEP-NRFANRHFSA-N 1 1 393.537 4.274 50 0 GIAAMO Cc1cc(C)n(-c2ccc(C[N@@H+](C)[C@H](C)c3ccc(S(C)(=O)=O)cc3)cc2)n1 ZINC000025947483 207306715 /nfs/dbraw/zinc/30/67/15/207306715.db2.gz IBXFQEIPSMAIPR-GOSISDBHSA-N 1 1 397.544 4.086 50 0 GIAAMO Cc1cc(C)n(-c2ccc(C[N@H+](C)[C@H](C)c3ccc(S(C)(=O)=O)cc3)cc2)n1 ZINC000025947483 207306718 /nfs/dbraw/zinc/30/67/18/207306718.db2.gz IBXFQEIPSMAIPR-GOSISDBHSA-N 1 1 397.544 4.086 50 0 GIAAMO O=C(CC[N@@H+]1CCO[C@H](c2ccccc2)C1)Nc1c(Cl)cccc1Cl ZINC000025948800 207307681 /nfs/dbraw/zinc/30/76/81/207307681.db2.gz LPWMLRPGJNQRGZ-KRWDZBQOSA-N 1 1 379.287 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CC(C)Oc1ccc(C(=O)NCCCC[N@@H+]2CCO[C@@H](c3ccccc3)C2)cc1 ZINC000036700043 570794829 /nfs/dbraw/zinc/79/48/29/570794829.db2.gz LCNXDWHATHBKQB-HSZRJFAPSA-N 1 1 396.531 4.057 50 0 GIAAMO CC(C)Oc1ccc(C(=O)NCCCC[N@H+]2CCO[C@@H](c3ccccc3)C2)cc1 ZINC000036700043 570794834 /nfs/dbraw/zinc/79/48/34/570794834.db2.gz LCNXDWHATHBKQB-HSZRJFAPSA-N 1 1 396.531 4.057 50 0 GIAAMO Oc1cc(-c2nc3ccccc3s2)cc2c1OCC[N@@H+](CC[C@H]1CCOC1)C2 ZINC000067967446 570798837 /nfs/dbraw/zinc/79/88/37/570798837.db2.gz YPJMFIBFZDJRKQ-HNNXBMFYSA-N 1 1 396.512 4.290 50 0 GIAAMO Cc1ccc(NC(=O)N2CC[NH+](Cc3cn(C)c4ccccc34)CC2)cc1C ZINC000065330048 570800906 /nfs/dbraw/zinc/80/09/06/570800906.db2.gz JVVRODTVQPUWFG-UHFFFAOYSA-N 1 1 376.504 4.145 50 0 GIAAMO [NH2+]=C1Nc2nc3ccccc3n2[C@H](c2ccc(-c3nc4ccccc4s3)o2)N1 ZINC000007127504 570803118 /nfs/dbraw/zinc/80/31/18/570803118.db2.gz SRBBXKYRRPAGGQ-QGZVFWFLSA-N 1 1 386.440 4.002 50 0 GIAAMO COc1cccc(NC(=S)N2CCC([N@@H+](C)[C@@H]3CCCC[C@@H]3C)CC2)c1 ZINC000004668287 570814371 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4.219 50 0 GIAAMO C[C@@H](C(=O)Nc1cccc(Cl)c1)[N@H+]1CCC[C@H](C(=O)Nc2ccccc2)C1 ZINC000037212983 570848498 /nfs/dbraw/zinc/84/84/98/570848498.db2.gz BOELZLLRPCWHHR-HOTGVXAUSA-N 1 1 385.895 4.018 50 0 GIAAMO COc1ccc(C[N@H+]2CCC(=O)N(Cc3ccc(F)cc3)[C@H](C(C)C)C2)cc1 ZINC000071758946 570848973 /nfs/dbraw/zinc/84/89/73/570848973.db2.gz JZCQEEHQIVWVLJ-QFIPXVFZSA-N 1 1 384.495 4.093 50 0 GIAAMO Cc1[nH+]ccn1-c1cc(CNC(=O)c2cc3c(s2)CCCCCC3)ccn1 ZINC000060576208 570857154 /nfs/dbraw/zinc/85/71/54/570857154.db2.gz AASRWNJTQZGKIX-UHFFFAOYSA-N 1 1 380.517 4.226 50 0 GIAAMO C[C@H]([NH2+][C@@H](C(=O)N1CCCCC1)c1ccccc1)c1ccc(-n2ccnc2)cc1 ZINC000012560217 570862405 /nfs/dbraw/zinc/86/24/05/570862405.db2.gz YDLTTXRVPYOILR-WMZHIEFXSA-N 1 1 388.515 4.277 50 0 GIAAMO COCc1ncc(C[N@H+]2CCC[C@H](CCc3ccccc3C(F)(F)F)C2)cn1 ZINC000072129640 570868318 /nfs/dbraw/zinc/86/83/18/570868318.db2.gz IFXMZMVJSFOCQA-MRXNPFEDSA-N 1 1 393.453 4.487 50 0 GIAAMO CC(C)[C@@H]1CN(C(=O)c2ccc(Cl)cn2)CCC[N@H+]1Cc1ccc(F)cc1 ZINC000072130993 570868914 /nfs/dbraw/zinc/86/89/14/570868914.db2.gz LUFJWYOUCPZAGI-FQEVSTJZSA-N 1 1 389.902 4.247 50 0 GIAAMO O=C(CCc1ccccc1)[C@@H]1CCC[N@@H+](Cc2cc(-c3ccccn3)no2)C1 ZINC000072144030 570870657 /nfs/dbraw/zinc/87/06/57/570870657.db2.gz SVTSKMLUTREZBE-LJQANCHMSA-N 1 1 375.472 4.151 50 0 GIAAMO O=C(NC[C@@H]1CCC[N@H+]2CCCC[C@@H]12)c1ccc2[nH]c3c(c2c1)CCCCC3 ZINC000170613541 570871683 /nfs/dbraw/zinc/87/16/83/570871683.db2.gz KBACKDWBFWWHPL-MBSDFSHPSA-N 1 1 379.548 4.431 50 0 GIAAMO Cc1ccc(-n2cc(C[N@@H+]3CCc4n[nH]cc4C3)c(-c3cccc(C)c3)n2)cc1 ZINC000072476839 570882264 /nfs/dbraw/zinc/88/22/64/570882264.db2.gz CKAMGQLLKOOPIQ-UHFFFAOYSA-N 1 1 383.499 4.438 50 0 GIAAMO Cc1ccc(-n2cc(C[N@H+]3CCc4n[nH]cc4C3)c(-c3cccc(C)c3)n2)cc1 ZINC000072476839 570882266 /nfs/dbraw/zinc/88/22/66/570882266.db2.gz CKAMGQLLKOOPIQ-UHFFFAOYSA-N 1 1 383.499 4.438 50 0 GIAAMO CCOc1ccccc1-c1noc(C[N@@H+]2CCC[C@H]2c2ccc(OC)cc2)n1 ZINC000010036656 570891333 /nfs/dbraw/zinc/89/13/33/570891333.db2.gz MWIPSAXUKTUBFG-IBGZPJMESA-N 1 1 379.460 4.481 50 0 GIAAMO CCOc1ccccc1-c1noc(C[N@H+]2CCC[C@H]2c2ccc(OC)cc2)n1 ZINC000010036656 570891335 /nfs/dbraw/zinc/89/13/35/570891335.db2.gz MWIPSAXUKTUBFG-IBGZPJMESA-N 1 1 379.460 4.481 50 0 GIAAMO Cn1nccc1[C@@H]1CCC[N@@H+](Cc2cc(Cl)ccc2OCc2cccnc2)C1 ZINC000071817052 570893627 /nfs/dbraw/zinc/89/36/27/570893627.db2.gz SGDYUIANSBZHNV-GOSISDBHSA-N 1 1 396.922 4.427 50 0 GIAAMO C[N@@H+](Cc1ccccc1NCc1cc(=O)n2ccsc2n1)C1CCCCC1 ZINC000015322804 570898561 /nfs/dbraw/zinc/89/85/61/570898561.db2.gz KUNXDHROAOSMBP-UHFFFAOYSA-N 1 1 382.533 4.133 50 0 GIAAMO C[N@H+](CC(=O)N1CCS[C@@H]1c1ccccc1Cl)Cc1cccc(F)c1 ZINC000004572313 570899522 /nfs/dbraw/zinc/89/95/22/570899522.db2.gz NOWYLNDRNZDECB-LJQANCHMSA-N 1 1 378.900 4.185 50 0 GIAAMO C[N@@H+](CC(=O)N1CCS[C@@H]1c1ccccc1Cl)Cc1cccc(F)c1 ZINC000004572313 570899525 /nfs/dbraw/zinc/89/95/25/570899525.db2.gz NOWYLNDRNZDECB-LJQANCHMSA-N 1 1 378.900 4.185 50 0 GIAAMO CC(C)C[N@H+]1CCCC[C@H]1CCNC(=O)c1cccc(-c2ccc(O)cn2)c1 ZINC000534585927 570904298 /nfs/dbraw/zinc/90/42/98/570904298.db2.gz RIMACEXYSUMFCW-FQEVSTJZSA-N 1 1 381.520 4.085 50 0 GIAAMO COc1cc(CNc2nc(C[NH+]3CCCCC3)nc3sc(C)c(C)c32)ccn1 ZINC000032906781 570905597 /nfs/dbraw/zinc/90/55/97/570905597.db2.gz STVWQFQWDPUDHN-UHFFFAOYSA-N 1 1 397.548 4.310 50 0 GIAAMO C[C@H]1CCCC[N@H+]1CC(=O)N1N=C(c2ccccc2)C[C@@H]1c1ccc(F)cc1 ZINC000105010956 570912799 /nfs/dbraw/zinc/91/27/99/570912799.db2.gz VJJMWQOGIZXVOQ-HTAPYJJXSA-N 1 1 379.479 4.378 50 0 GIAAMO COC(=O)c1c(-c2ccccc2)csc1NC(=O)C[N@H+]1C[C@H](C)C[C@H](C)C1 ZINC000017078946 570927050 /nfs/dbraw/zinc/92/70/50/570927050.db2.gz JGUDSTMNQDTOOI-GASCZTMLSA-N 1 1 386.517 4.118 50 0 GIAAMO COC(=O)c1c(-c2ccccc2)csc1NC(=O)C[N@@H+]1C[C@H](C)C[C@H](C)C1 ZINC000017078946 570927054 /nfs/dbraw/zinc/92/70/54/570927054.db2.gz JGUDSTMNQDTOOI-GASCZTMLSA-N 1 1 386.517 4.118 50 0 GIAAMO COc1ccc([C@H]2[C@@H]3CCCC[C@]3(O)CC[N@H+]2CC(=O)Nc2ccccc2)cc1 ZINC000004061597 570927688 /nfs/dbraw/zinc/92/76/88/570927688.db2.gz XPIMRLYLQKZKIJ-XWGVYQGASA-N 1 1 394.515 4.002 50 0 GIAAMO COc1ccc([C@@H]2CCC[N@H+]2Cc2cc(=O)oc3cc(C)ccc23)c(OC)c1 ZINC000012648218 570934904 /nfs/dbraw/zinc/93/49/04/570934904.db2.gz MKTIZSCBYGRSRZ-FQEVSTJZSA-N 1 1 379.456 4.456 50 0 GIAAMO CCOc1ccc(C(=O)Nc2ccc(Nc3cc(N(C)C)nc(C)[nH+]3)cc2)cc1 ZINC000033318324 570973528 /nfs/dbraw/zinc/97/35/28/570973528.db2.gz HWGGDUNTEIESNJ-UHFFFAOYSA-N 1 1 391.475 4.246 50 0 GIAAMO CCOc1ccc(C(=O)Nc2ccc(Nc3cc(N(C)C)[nH+]c(C)n3)cc2)cc1 ZINC000033318324 570973532 /nfs/dbraw/zinc/97/35/32/570973532.db2.gz HWGGDUNTEIESNJ-UHFFFAOYSA-N 1 1 391.475 4.246 50 0 GIAAMO Cc1nn(C)c(C)c1[C@@H]1CCC[N@H+]1CC[C@H]1CCCN(C(=O)OC(C)(C)C)C1 ZINC000252516253 570983569 /nfs/dbraw/zinc/98/35/69/570983569.db2.gz QWBBKLUNBIVBKV-MOPGFXCFSA-N 1 1 390.572 4.211 50 0 GIAAMO COc1ccccc1[C@H](CNC(=O)C(c1ccccc1)c1ccccc1)[NH+](C)C ZINC000007671209 571014805 /nfs/dbraw/zinc/01/48/05/571014805.db2.gz JEPZVYVMXSFWIS-QFIPXVFZSA-N 1 1 388.511 4.246 50 0 GIAAMO O=C(C[N@@H+](Cc1ccc2c(c1)OCO2)C1CCCC1)Nc1ccccc1Cl ZINC000012780839 571034108 /nfs/dbraw/zinc/03/41/08/571034108.db2.gz KHIWQABXVWLFSB-UHFFFAOYSA-N 1 1 386.879 4.452 50 0 GIAAMO C[C@H](C(=O)NC(c1ccccc1)c1ccccc1)[N@H+]1CCC[C@@H]1c1cccn1C ZINC000007854567 817939851 /nfs/dbraw/zinc/93/98/51/817939851.db2.gz BXJKCGCJXLNCFG-AUSIDOKSSA-N 1 1 387.527 4.456 50 0 GIAAMO COc1ccc(C[N@H+](C)[C@H](C)C(=O)Nc2ccc(C(F)(F)F)cc2)cc1F ZINC000008156459 818008583 /nfs/dbraw/zinc/00/85/83/818008583.db2.gz XJDVOOZPDWLBNH-GFCCVEGCSA-N 1 1 384.373 4.312 50 0 GIAAMO COc1ccc(C[N@@H+](C)[C@H](C)C(=O)Nc2ccc(C(F)(F)F)cc2)cc1F ZINC000008156459 818008588 /nfs/dbraw/zinc/00/85/88/818008588.db2.gz XJDVOOZPDWLBNH-GFCCVEGCSA-N 1 1 384.373 4.312 50 0 GIAAMO Cc1cc(C(=O)N[C@@H]2CCC[N@H+](Cc3ccccc3F)C2)c2ccccc2n1 ZINC000011844322 818125701 /nfs/dbraw/zinc/12/57/01/818125701.db2.gz UUMLLUJVECTTIY-GOSISDBHSA-N 1 1 377.463 4.077 50 0 GIAAMO Cc1cc(C(=O)N[C@@H]2CCC[N@@H+](Cc3ccccc3F)C2)c2ccccc2n1 ZINC000011844322 818125706 /nfs/dbraw/zinc/12/57/06/818125706.db2.gz UUMLLUJVECTTIY-GOSISDBHSA-N 1 1 377.463 4.077 50 0 GIAAMO Cc1cc(C)c(C(=O)NCC[N@H+]2Cc3ccccc3O[C@@H](c3ccsc3)C2)[nH]1 ZINC000011881232 818127267 /nfs/dbraw/zinc/12/72/67/818127267.db2.gz HTOAKBGXADWYHW-HXUWFJFHSA-N 1 1 395.528 4.059 50 0 GIAAMO Cc1cc(C)c(C(=O)NCC[N@@H+]2Cc3ccccc3O[C@@H](c3ccsc3)C2)[nH]1 ZINC000011881232 818127275 /nfs/dbraw/zinc/12/72/75/818127275.db2.gz HTOAKBGXADWYHW-HXUWFJFHSA-N 1 1 395.528 4.059 50 0 GIAAMO COc1ccc(C[N@H+]2CCC[C@@H](c3n[nH]cc3-c3ccc(C)cc3)C2)cc1O ZINC000011912092 818128477 /nfs/dbraw/zinc/12/84/77/818128477.db2.gz LNJCZSZDNOLKNM-LJQANCHMSA-N 1 1 377.488 4.479 50 0 GIAAMO Cc1c2cc(C)cc(Cl)c2oc1C(=O)N1CCN(c2cccc(C)[nH+]2)CC1 ZINC000012200521 818146827 /nfs/dbraw/zinc/14/68/27/818146827.db2.gz ZNBCODPCHFLMEJ-UHFFFAOYSA-N 1 1 383.879 4.369 50 0 GIAAMO c1ccc(C[N@H+]2CCC[C@@]3(CCCN(c4nncc(-c5ccccc5)n4)C3)C2)cc1 ZINC000012303298 818153751 /nfs/dbraw/zinc/15/37/51/818153751.db2.gz PJCQZNZMXIIDKT-RUZDIDTESA-N 1 1 399.542 4.421 50 0 GIAAMO COc1cccc(C[N@H+]2CCC[C@@]3(CCN(C(=O)c4cc(C)oc4C)C3)C2)c1 ZINC000012315991 818154511 /nfs/dbraw/zinc/15/45/11/818154511.db2.gz LXLNXQFFDNOEPE-HSZRJFAPSA-N 1 1 382.504 4.033 50 0 GIAAMO Cn1ccnc1C[N@@H+]1CCC[C@H](C(=O)Nc2cccc(-c3ccc(F)cc3)c2)C1 ZINC000012431680 818158835 /nfs/dbraw/zinc/15/88/35/818158835.db2.gz GBUOUHWDVWCTTM-IBGZPJMESA-N 1 1 392.478 4.077 50 0 GIAAMO Cn1ccnc1C[N@H+]1CCC[C@H](C(=O)Nc2cccc(-c3ccc(F)cc3)c2)C1 ZINC000012431680 818158842 /nfs/dbraw/zinc/15/88/42/818158842.db2.gz GBUOUHWDVWCTTM-IBGZPJMESA-N 1 1 392.478 4.077 50 0 GIAAMO COC[C@@H]1CC[N@@H+](Cc2cn(-c3cccc(C)c3)nc2-c2cccc(F)c2)C1 ZINC000012613219 818171238 /nfs/dbraw/zinc/17/12/38/818171238.db2.gz ANGJLQVIKRTPTE-GOSISDBHSA-N 1 1 379.479 4.455 50 0 GIAAMO O=C(NC[C@H]1CCC[N@@H+](Cc2cccc(C(F)(F)F)c2)C1)c1ccc(F)cc1 ZINC000012704452 818176942 /nfs/dbraw/zinc/17/69/42/818176942.db2.gz SQQLFJADLXKMCD-MRXNPFEDSA-N 1 1 394.412 4.487 50 0 GIAAMO COc1ccc(-c2ccccc2NC(=O)[C@H]2CCC[N@H+](Cc3ccon3)C2)cc1 ZINC000014981537 818280778 /nfs/dbraw/zinc/28/07/78/818280778.db2.gz SWKSBLWTZFLCRF-SFHVURJKSA-N 1 1 391.471 4.201 50 0 GIAAMO COc1ccc(-c2ccccc2NC(=O)[C@H]2CCC[N@@H+](Cc3ccon3)C2)cc1 ZINC000014981537 818280781 /nfs/dbraw/zinc/28/07/81/818280781.db2.gz SWKSBLWTZFLCRF-SFHVURJKSA-N 1 1 391.471 4.201 50 0 GIAAMO CC[N@@H+](Cc1ccccc1)[C@H]1CCC(=O)N(CCOc2ccc(F)cc2)CC1 ZINC000015002194 818282060 /nfs/dbraw/zinc/28/20/60/818282060.db2.gz MRZZFSRBCDSFJX-NRFANRHFSA-N 1 1 384.495 4.108 50 0 GIAAMO CC[N@@H+](Cc1ccccc1)[C@@H]1CCC(=O)N(CCOc2ccc(F)cc2)CC1 ZINC000015002197 818282153 /nfs/dbraw/zinc/28/21/53/818282153.db2.gz MRZZFSRBCDSFJX-OAQYLSRUSA-N 1 1 384.495 4.108 50 0 GIAAMO Cc1nn(C)c(Cl)c1CN1CC[C@]2(C1)CCC[N@@H+](Cc1cccc(C)c1)C2 ZINC000015064226 818286637 /nfs/dbraw/zinc/28/66/37/818286637.db2.gz IBUHKWDCODGPBV-JOCHJYFZSA-N 1 1 386.971 4.178 50 0 GIAAMO COc1ccc(C[N@H+](C)[C@@H](C)C(=O)Nc2ccc(OC(F)(F)F)cc2)cc1 ZINC000019531436 818593262 /nfs/dbraw/zinc/59/32/62/818593262.db2.gz LINIVIFYIFYCQL-ZDUSSCGKSA-N 1 1 382.382 4.053 50 0 GIAAMO COc1ccc(C[N@@H+](C)[C@@H](C)C(=O)Nc2ccc(OC(F)(F)F)cc2)cc1 ZINC000019531436 818593266 /nfs/dbraw/zinc/59/32/66/818593266.db2.gz LINIVIFYIFYCQL-ZDUSSCGKSA-N 1 1 382.382 4.053 50 0 GIAAMO CC[NH+]1CCN(Cc2c(=O)c3cc(Cl)ccc3[nH]c2-c2ccccc2)CC1 ZINC000019793408 818604979 /nfs/dbraw/zinc/60/49/79/818604979.db2.gz DQBPXUQAWQEZEQ-UHFFFAOYSA-N 1 1 381.907 4.398 50 0 GIAAMO Cc1cc(Cl)cc2c(=O)c(CN3CC[NH+](Cc4ccccc4)CC3)c(C)[nH]c12 ZINC000019793332 818605303 /nfs/dbraw/zinc/60/53/03/818605303.db2.gz UYRDEERVVUOWJO-UHFFFAOYSA-N 1 1 395.934 4.116 50 0 GIAAMO Cn1cc(CN2CCC[N@@H+](Cc3ccccc3F)CC2)c(-c2ccccc2F)n1 ZINC000020994760 818645712 /nfs/dbraw/zinc/64/57/12/818645712.db2.gz VHQVICJIYWBNOP-UHFFFAOYSA-N 1 1 396.485 4.073 50 0 GIAAMO Cn1cc(C[N@@H+]2CCCN(Cc3ccccc3F)CC2)c(-c2ccccc2F)n1 ZINC000020994760 818645718 /nfs/dbraw/zinc/64/57/18/818645718.db2.gz VHQVICJIYWBNOP-UHFFFAOYSA-N 1 1 396.485 4.073 50 0 GIAAMO Cn1cc(C[N@H+]2CCCN(Cc3ccccc3F)CC2)c(-c2ccccc2F)n1 ZINC000020994760 818645723 /nfs/dbraw/zinc/64/57/23/818645723.db2.gz VHQVICJIYWBNOP-UHFFFAOYSA-N 1 1 396.485 4.073 50 0 GIAAMO Cc1cc(C)c2ccc(C[N@@H+]3CCC[C@@H]3c3ccc(C(N)=O)s3)nc2c1O ZINC000023129619 818902181 /nfs/dbraw/zinc/90/21/81/818902181.db2.gz YEWRCARXYJRZNN-MRXNPFEDSA-N 1 1 381.501 4.055 50 0 GIAAMO Cc1cc(C)c2ccc(C[N@H+]3CCC[C@@H]3c3ccc(C(N)=O)s3)nc2c1O ZINC000023129619 818902185 /nfs/dbraw/zinc/90/21/85/818902185.db2.gz YEWRCARXYJRZNN-MRXNPFEDSA-N 1 1 381.501 4.055 50 0 GIAAMO CC(C)C[N@@H+](Cc1cccs1)Cc1cc(=O)n2c3c(sc2n1)CCCC3 ZINC000033068960 821030132 /nfs/dbraw/zinc/03/01/32/821030132.db2.gz MUYUBANCKQJMKO-UHFFFAOYSA-N 1 1 387.574 4.355 50 0 GIAAMO Cc1cc([C@H](c2ccccc2)N2CC[NH+](C)CC2)c(NC(=O)c2ccco2)s1 ZINC000038546399 821097656 /nfs/dbraw/zinc/09/76/56/821097656.db2.gz JNKDAHXCPHAFKA-FQEVSTJZSA-N 1 1 395.528 4.239 50 0 GIAAMO C[N@@H+]1CCN(C(=O)Nc2cccc(OC(F)(F)F)c2)[C@@H](c2ccccc2)C1 ZINC000040104642 821137791 /nfs/dbraw/zinc/13/77/91/821137791.db2.gz YYEJDDFDVOEDCU-QGZVFWFLSA-N 1 1 379.382 4.106 50 0 GIAAMO C[N@H+]1CCN(C(=O)Nc2cccc(OC(F)(F)F)c2)[C@@H](c2ccccc2)C1 ZINC000040104642 821137794 /nfs/dbraw/zinc/13/77/94/821137794.db2.gz YYEJDDFDVOEDCU-QGZVFWFLSA-N 1 1 379.382 4.106 50 0 GIAAMO C[C@@H](NC(=O)N1CC[NH+](CCSc2ccccc2)CC1)c1ccc(F)cc1 ZINC000040135604 821146418 /nfs/dbraw/zinc/14/64/18/821146418.db2.gz RGLXBEZQQSYCGE-QGZVFWFLSA-N 1 1 387.524 4.006 50 0 GIAAMO O=C(c1cc2cc(F)ccc2s1)N1CCN(c2cc[nH+]cc2Cl)CC1 ZINC000179262472 822458640 /nfs/dbraw/zinc/45/86/40/822458640.db2.gz XHCMBGUWQYQMRL-UHFFFAOYSA-N 1 1 375.856 4.051 50 0 GIAAMO C[N@H+](Cc1cccnc1)C[C@H]1CCN(C(=O)c2cc3cc(Cl)ccc3o2)C1 ZINC000190626960 823593293 /nfs/dbraw/zinc/59/32/93/823593293.db2.gz DREGIZRVLSNNEO-MRXNPFEDSA-N 1 1 383.879 4.075 50 0 GIAAMO CCCC(=O)N1CCC2(CC1)C[C@@H]([N@@H+](Cc1ccc(F)cc1)C1CC1)CCO2 ZINC000169776734 823915618 /nfs/dbraw/zinc/91/56/18/823915618.db2.gz PNQWYUPRQGMDQR-NRFANRHFSA-N 1 1 388.527 4.130 50 0 GIAAMO c1ccc(-c2nc(-c3ccncc3)no2)c(O[C@@H]2CC[N@H+](C3CCCC3)C2)c1 ZINC000169785099 823916210 /nfs/dbraw/zinc/91/62/10/823916210.db2.gz AUZACZRBFQHEFC-GOSISDBHSA-N 1 1 376.460 4.194 50 0 GIAAMO CC(C)(C)NC(=O)N1CCC([N@H+]2CC3(CCCCC3)[C@@H]2c2ccncc2)CC1 ZINC000169786991 823916715 /nfs/dbraw/zinc/91/67/15/823916715.db2.gz GVXROBGNWGEAOW-FQEVSTJZSA-N 1 1 384.568 4.361 50 0 GIAAMO Cc1ncsc1C[N@H+]1CC[C@@H](Oc2ccccc2-c2nc(C3CC3)no2)C1 ZINC000575314961 823952265 /nfs/dbraw/zinc/95/22/65/823952265.db2.gz UNEJOOMPWYDMJJ-OAHLLOKOSA-N 1 1 382.489 4.032 50 0 GIAAMO CCn1cc(CN2CCC([N@H+]3CC4(CCCCC4)[C@H]3c3ccncc3)CC2)cn1 ZINC000575545499 823975395 /nfs/dbraw/zinc/97/53/95/823975395.db2.gz NYEVQTWIUNSXJO-HSZRJFAPSA-N 1 1 393.579 4.270 50 0 GIAAMO Cc1cnc(C2CCOCC2)n1C[C@H]1CCC[N@@H+](Cc2ccc(F)cc2F)C1 ZINC000575547737 823976389 /nfs/dbraw/zinc/97/63/89/823976389.db2.gz UERZRGDMWINYHY-KRWDZBQOSA-N 1 1 389.490 4.276 50 0 GIAAMO COc1cccc(C[N@H+]2CCC[C@@H](Cn3c(C)cnc3-c3ccccc3)C2)n1 ZINC000575547628 823976658 /nfs/dbraw/zinc/97/66/58/823976658.db2.gz NLCSQPNYOIAOMR-LJQANCHMSA-N 1 1 376.504 4.174 50 0 GIAAMO CN(C[C@H]1CCC[N@@H+](CCc2ccc(Cl)cc2)C1)C(=O)c1ccsc1 ZINC000011872999 206840094 /nfs/dbraw/zinc/84/00/94/206840094.db2.gz ZKISYQXDYPOTKI-QGZVFWFLSA-N 1 1 376.953 4.428 50 0 GIAAMO COc1ccc(OC)c(NC(=O)[C@H](C)Nc2ccc([NH+]3CCCCC3)cc2)c1 ZINC000012550119 206911302 /nfs/dbraw/zinc/91/13/02/206911302.db2.gz JKRRAEXVGIKOGK-INIZCTEOSA-N 1 1 383.492 4.133 50 0 GIAAMO COc1ccccc1NC(=O)[C@H]1CC12CC[NH+](Cc1c(F)cccc1F)CC2 ZINC000014883087 207030830 /nfs/dbraw/zinc/03/08/30/207030830.db2.gz RJVOVXDHKNUABK-MRXNPFEDSA-N 1 1 386.442 4.214 50 0 GIAAMO Cc1nc(C)c(C(=O)N2CC[C@]3(C2)CCC[N@@H+](Cc2ccc(F)cc2)C3)s1 ZINC000014954908 207032197 /nfs/dbraw/zinc/03/21/97/207032197.db2.gz WMMYHUYEHBMWGI-OAQYLSRUSA-N 1 1 387.524 4.027 50 0 GIAAMO COc1c(C)cc(C(=O)[C@H]2CCC[N@H+](Cc3c(C)nn(C)c3Cl)C2)cc1C ZINC000014952894 207033262 /nfs/dbraw/zinc/03/32/62/207033262.db2.gz VKEVUCGRBVMJTC-INIZCTEOSA-N 1 1 389.927 4.102 50 0 GIAAMO COc1c(C)cc(C(=O)[C@H]2CCC[N@@H+](Cc3c(C)nn(C)c3Cl)C2)cc1C ZINC000014952894 207033268 /nfs/dbraw/zinc/03/32/68/207033268.db2.gz VKEVUCGRBVMJTC-INIZCTEOSA-N 1 1 389.927 4.102 50 0 GIAAMO CC[N@H+](Cc1cccc2nonc21)C[C@@H]1CCCN(CCc2cccc(F)c2)C1 ZINC000014967311 207034855 /nfs/dbraw/zinc/03/48/55/207034855.db2.gz JCCVJOBEIRLUBF-IBGZPJMESA-N 1 1 396.510 4.139 50 0 GIAAMO Cc1cnc(C(=O)N2CC[C@]3(C2)CCC[N@H+](Cc2ccc(C(C)C)cc2)C3)cn1 ZINC000014959886 207035914 /nfs/dbraw/zinc/03/59/14/207035914.db2.gz LPLBZPBPLXIHJE-XMMPIXPASA-N 1 1 392.547 4.037 50 0 GIAAMO O=C(Nc1ccc(-n2cccn2)cc1)[C@@H]1CCCC[N@@H+]1Cc1cc2ccccc2[nH]1 ZINC000015078561 207046373 /nfs/dbraw/zinc/04/63/73/207046373.db2.gz BAZCDLLUMUUMLN-QHCPKHFHSA-N 1 1 399.498 4.347 50 0 GIAAMO O=C(Nc1ccc(-n2cccn2)cc1)[C@@H]1CCCC[N@H+]1Cc1cc2ccccc2[nH]1 ZINC000015078561 207046378 /nfs/dbraw/zinc/04/63/78/207046378.db2.gz BAZCDLLUMUUMLN-QHCPKHFHSA-N 1 1 399.498 4.347 50 0 GIAAMO O=C(c1cc2ccccc2[nH]1)N1CC[C@]2(C1)CCC[N@H+](Cc1ccc(F)cc1)C2 ZINC000015066367 207043120 /nfs/dbraw/zinc/04/31/20/207043120.db2.gz QIPHCXXIQMMDMR-XMMPIXPASA-N 1 1 391.490 4.435 50 0 GIAAMO Cc1[nH+]ccn1-c1ccc(NC(=O)[C@H]2CCCN2C(=O)CC2=CCCCC2)cc1 ZINC000015065896 207043298 /nfs/dbraw/zinc/04/32/98/207043298.db2.gz UYNWBSUFEAOVOS-OAQYLSRUSA-N 1 1 392.503 4.001 50 0 GIAAMO COc1ccc([C@H]2CC(c3ccccc3)=NN2C(=O)C[N@H+]2CCCC[C@@H]2C)cc1 ZINC000015350771 207050287 /nfs/dbraw/zinc/05/02/87/207050287.db2.gz AVLULMFXAXTXNV-FDDCHVKYSA-N 1 1 391.515 4.247 50 0 GIAAMO CC[C@H]([NH2+][C@@H](C)c1nc2ccccc2c(=O)[nH]1)c1ccc(Br)cc1 ZINC000016694704 207077301 /nfs/dbraw/zinc/07/73/01/207077301.db2.gz RQIAEPNVPJIDDN-LRDDRELGSA-N 1 1 386.293 4.488 50 0 GIAAMO Cc1cc(Cl)ccc1C(=O)[C@H]1CCC[N@@H+](Cc2cnc(N(C)C)s2)C1 ZINC000019223337 207109384 /nfs/dbraw/zinc/10/93/84/207109384.db2.gz LXSMQHMRHMHCNZ-AWEZNQCLSA-N 1 1 377.941 4.266 50 0 GIAAMO Cc1cc(Cl)ccc1C(=O)[C@H]1CCC[N@H+](Cc2cnc(N(C)C)s2)C1 ZINC000019223337 207109388 /nfs/dbraw/zinc/10/93/88/207109388.db2.gz LXSMQHMRHMHCNZ-AWEZNQCLSA-N 1 1 377.941 4.266 50 0 GIAAMO CCCCCOc1ccc([C@H](O)[C@@H](C[NH+]2CCOCC2)c2ccccc2)cc1 ZINC000019314208 207115499 /nfs/dbraw/zinc/11/54/99/207115499.db2.gz TXAXLUUOZDHBRR-ZEQRLZLVSA-N 1 1 383.532 4.405 50 0 GIAAMO Fc1ccc(N2CCN([C@H]3CCC[N@@H+](C/C=C/c4ccccc4)C3)CC2)cc1 ZINC000019639615 207143258 /nfs/dbraw/zinc/14/32/58/207143258.db2.gz SAYGQUOQNOHPAG-LHLOKTHNSA-N 1 1 379.523 4.126 50 0 GIAAMO Fc1ccc(N2CC[NH+]([C@H]3CCCN(C/C=C/c4ccccc4)C3)CC2)cc1 ZINC000019639615 207143263 /nfs/dbraw/zinc/14/32/63/207143263.db2.gz SAYGQUOQNOHPAG-LHLOKTHNSA-N 1 1 379.523 4.126 50 0 GIAAMO O=C(/C=C/c1c(Cl)cccc1Cl)N1CC[NH+](Cc2ccccc2)CC1 ZINC000019760054 207158613 /nfs/dbraw/zinc/15/86/13/207158613.db2.gz BEXUIYLPBJNJHJ-MDZDMXLPSA-N 1 1 375.299 4.351 50 0 GIAAMO FC(F)(F)c1cccc(NC(=S)N2CC[NH+](Cc3ccccc3)CC2)c1 ZINC000019841102 207166733 /nfs/dbraw/zinc/16/67/33/207166733.db2.gz WWITVKYEPJKUSO-UHFFFAOYSA-N 1 1 379.451 4.220 50 0 GIAAMO CN(C)C(=O)c1ccc([C@@H]2CCC[N@H+]2Cc2ccc(-c3cc[nH]n3)s2)s1 ZINC000019789673 207161458 /nfs/dbraw/zinc/16/14/58/207161458.db2.gz LHOSLQJSJHDAHO-HNNXBMFYSA-N 1 1 386.546 4.239 50 0 GIAAMO O=C(COc1ccc(Cl)cc1)N1CC[NH+](Cc2cccc3ccccc32)CC1 ZINC000019831519 207164910 /nfs/dbraw/zinc/16/49/10/207164910.db2.gz XRKUERLZDPBYKM-UHFFFAOYSA-N 1 1 394.902 4.216 50 0 GIAAMO CCC[N@@H+]1CCc2c(sc3nc(SCC)n(-c4ccccc4)c(=O)c32)C1 ZINC000019939762 207172314 /nfs/dbraw/zinc/17/23/14/207172314.db2.gz QDPBQVZYINNILM-UHFFFAOYSA-N 1 1 385.558 4.327 50 0 GIAAMO CCC[N@H+]1CCc2c(sc3nc(SCC)n(-c4ccccc4)c(=O)c32)C1 ZINC000019939762 207172318 /nfs/dbraw/zinc/17/23/18/207172318.db2.gz QDPBQVZYINNILM-UHFFFAOYSA-N 1 1 385.558 4.327 50 0 GIAAMO Cc1ccc(/C=C/C(=O)NCCN2CCC([N@H+](C)[C@@H]3CCCC[C@@H]3C)CC2)cc1 ZINC000020241344 207184500 /nfs/dbraw/zinc/18/45/00/207184500.db2.gz LUHSUUOGVHQADD-VQMHNJBBSA-N 1 1 397.607 4.099 50 0 GIAAMO COc1cccc(-c2nn(-c3ccccc3)cc2C[N@H+]2C[C@@H](C)O[C@@H](C)C2)c1 ZINC000020363744 207189831 /nfs/dbraw/zinc/18/98/31/207189831.db2.gz FPCYEGYZSUNUHE-HDICACEKSA-N 1 1 377.488 4.157 50 0 GIAAMO COc1cccc(-c2nn(-c3ccccc3)cc2C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)c1 ZINC000020363744 207189836 /nfs/dbraw/zinc/18/98/36/207189836.db2.gz FPCYEGYZSUNUHE-HDICACEKSA-N 1 1 377.488 4.157 50 0 GIAAMO C[C@@H](NC(=O)c1ccco1)[C@H](c1cccs1)[NH+]1CCN(c2ccccc2)CC1 ZINC000020288490 207186182 /nfs/dbraw/zinc/18/61/82/207186182.db2.gz WHNZMWHKFAUTNW-DYESRHJHSA-N 1 1 395.528 4.023 50 0 GIAAMO CSc1ccc(C(=O)[C@H]2CCC[N@@H+](Cc3ccc(NC(C)=O)cc3)C2)cc1 ZINC000020451581 207192736 /nfs/dbraw/zinc/19/27/36/207192736.db2.gz ALIKZGHJIWJSQH-IBGZPJMESA-N 1 1 382.529 4.462 50 0 GIAAMO Cc1ccccc1-c1ncc(CN[C@H]2CCC[N@@H+](C3Cc4ccccc4C3)C2)cn1 ZINC000020598752 207204881 /nfs/dbraw/zinc/20/48/81/207204881.db2.gz MJFKAWLBTWYJCK-QHCPKHFHSA-N 1 1 398.554 4.173 50 0 GIAAMO Cc1ccccc1-c1ncc(CN[C@H]2CCC[N@H+](C3Cc4ccccc4C3)C2)cn1 ZINC000020598752 207204885 /nfs/dbraw/zinc/20/48/85/207204885.db2.gz MJFKAWLBTWYJCK-QHCPKHFHSA-N 1 1 398.554 4.173 50 0 GIAAMO Cc1nn(C)c(C)c1NC(=O)c1ccc([C@@H]2CCC[N@@H+]2Cc2ccco2)s1 ZINC000020600714 207205781 /nfs/dbraw/zinc/20/57/81/207205781.db2.gz LCFVTTISBWASEV-INIZCTEOSA-N 1 1 384.505 4.281 50 0 GIAAMO Cc1nn(C)c(C)c1NC(=O)c1ccc([C@@H]2CCC[N@H+]2Cc2ccco2)s1 ZINC000020600714 207205783 /nfs/dbraw/zinc/20/57/83/207205783.db2.gz LCFVTTISBWASEV-INIZCTEOSA-N 1 1 384.505 4.281 50 0 GIAAMO Brc1ccc(-c2nnc3sc(C[NH2+]Cc4ccco4)cn32)cc1 ZINC000020605401 207206152 /nfs/dbraw/zinc/20/61/52/207206152.db2.gz LQAIXRJTVYEVLD-UHFFFAOYSA-N 1 1 389.278 4.103 50 0 GIAAMO O=C(c1cccc(C(F)(F)F)c1)[C@@H]1CCC[N@H+](C2CSCCSC2)C1 ZINC000020599545 207206393 /nfs/dbraw/zinc/20/63/93/207206393.db2.gz DCCXCQVSFYYOAC-CQSZACIVSA-N 1 1 389.508 4.449 50 0 GIAAMO O[C@H]1[C@H]([NH+]2CCCCCC2)c2ccccc2C12CCN(Cc1ccco1)CC2 ZINC000020859445 207215985 /nfs/dbraw/zinc/21/59/85/207215985.db2.gz VJSDWFFTNWHZEQ-PKTZIBPZSA-N 1 1 380.532 4.105 50 0 GIAAMO Cc1ccc(NC(=O)N(CCC[NH+]2CCOCC2)Cc2cccs2)cc1C ZINC000020685572 207210131 /nfs/dbraw/zinc/21/01/31/207210131.db2.gz YRYGJZSHPOCPHH-UHFFFAOYSA-N 1 1 387.549 4.121 50 0 GIAAMO Fc1ccccc1N1CCN([C@H]2CCC[N@@H+](Cc3ccc(Cl)cc3)C2)CC1 ZINC000020992967 207223018 /nfs/dbraw/zinc/22/30/18/207223018.db2.gz FERXVTXJCNVALG-FQEVSTJZSA-N 1 1 387.930 4.266 50 0 GIAAMO Fc1ccccc1N1CC[NH+]([C@H]2CCCN(Cc3ccc(Cl)cc3)C2)CC1 ZINC000020992967 207223024 /nfs/dbraw/zinc/22/30/24/207223024.db2.gz FERXVTXJCNVALG-FQEVSTJZSA-N 1 1 387.930 4.266 50 0 GIAAMO COc1ccc(CC[N@@H+](C)[C@@H]2CCCN(Cc3cc(C)c(C)o3)C2)cc1OC ZINC000023360359 207275277 /nfs/dbraw/zinc/27/52/77/207275277.db2.gz PVXPXRFIALVYPX-HXUWFJFHSA-N 1 1 386.536 4.053 50 0 GIAAMO CC[NH+](CC)CCNCc1cn(-c2ccccc2F)nc1-c1ccc(OC)cc1 ZINC000023373820 207276833 /nfs/dbraw/zinc/27/68/33/207276833.db2.gz IEOUWXIOITXGEL-UHFFFAOYSA-N 1 1 396.510 4.118 50 0 GIAAMO Cc1oc(-c2ccccc2)nc1C(=O)NC[C@H](c1ccco1)[NH+]1CCCCC1 ZINC000022917029 207264683 /nfs/dbraw/zinc/26/46/83/207264683.db2.gz RPAQNJHCNHIHAG-GOSISDBHSA-N 1 1 379.460 4.200 50 0 GIAAMO Cc1csc2nc(C[NH2+][C@@H](c3cccs3)c3ccc(F)cc3)cc(=O)n12 ZINC000023805734 207283397 /nfs/dbraw/zinc/28/33/97/207283397.db2.gz PTDHVDHNKFGISK-GOSISDBHSA-N 1 1 385.489 4.144 50 0 GIAAMO CCCCc1cc(=O)[nH]c(-c2cccc(C[N@@H+](C)[C@H](C)c3cccnc3)c2)n1 ZINC000023541222 207278074 /nfs/dbraw/zinc/27/80/74/207278074.db2.gz YNCDMEQGAFRQGG-QGZVFWFLSA-N 1 1 376.504 4.368 50 0 GIAAMO Cc1cccc(-c2nnc([C@@H](C)[NH+]3CCC(C(=O)Nc4ccccc4)CC3)o2)c1 ZINC000024856354 207295917 /nfs/dbraw/zinc/29/59/17/207295917.db2.gz XKBZSFLOURXELL-QGZVFWFLSA-N 1 1 390.487 4.457 50 0 GIAAMO Cc1ccc([C@@H]([NH2+]CC(=O)Nc2ccc3c(c2)OCCO3)c2cccs2)cc1 ZINC000025058625 207300685 /nfs/dbraw/zinc/30/06/85/207300685.db2.gz AVVTWXJIFUGRPH-JOCHJYFZSA-N 1 1 394.496 4.145 50 0 GIAAMO Brc1cc(C[NH2+][C@H](c2ccccc2)c2ccccn2)cc2c1OCO2 ZINC000025363713 207303569 /nfs/dbraw/zinc/30/35/69/207303569.db2.gz JVEOABRITXKGNF-LJQANCHMSA-N 1 1 397.272 4.452 50 0 GIAAMO Cc1c2cccc(Cl)c2oc1C(=O)NCC1([NH+]2CCOCC2)CCCCC1 ZINC000025701854 207305750 /nfs/dbraw/zinc/30/57/50/207305750.db2.gz JAXASQSUVFONCW-UHFFFAOYSA-N 1 1 390.911 4.160 50 0 GIAAMO C[N@@H+]1CCN(C(=O)c2ccc(-n3cnc4ccccc43)cc2)[C@H](c2ccccc2)C1 ZINC000030029871 207369142 /nfs/dbraw/zinc/36/91/42/207369142.db2.gz SBLUQPQYZRVYJP-DEOSSOPVSA-N 1 1 396.494 4.154 50 0 GIAAMO C[N@H+]1CCN(C(=O)c2ccc(-n3cnc4ccccc43)cc2)[C@H](c2ccccc2)C1 ZINC000030029871 207369149 /nfs/dbraw/zinc/36/91/49/207369149.db2.gz SBLUQPQYZRVYJP-DEOSSOPVSA-N 1 1 396.494 4.154 50 0 GIAAMO Cc1cccc(NC(=O)C2CC[NH+](Cc3nc(-c4ccccc4)no3)CC2)c1C ZINC000030955168 207378516 /nfs/dbraw/zinc/37/85/16/207378516.db2.gz OGKWIGIKFMBDKN-UHFFFAOYSA-N 1 1 390.487 4.204 50 0 GIAAMO CCC[C@@H](O)C[N@H+](Cc1ccccc1)C[C@@H]1CC(c2ccc(Cl)cc2)=NO1 ZINC000036145963 207514174 /nfs/dbraw/zinc/51/41/74/207514174.db2.gz WBJWSQVNPYVVHY-RTWAWAEBSA-N 1 1 386.923 4.496 50 0 GIAAMO CCOc1ccc(C[N@@H+](C)Cc2cc(=O)oc3c(C)c(C)ccc23)cc1OC ZINC000057024612 207747561 /nfs/dbraw/zinc/74/75/61/207747561.db2.gz AHSMUGYEUDLUEJ-UHFFFAOYSA-N 1 1 381.472 4.449 50 0 GIAAMO O=C(c1ccc2cccc(Cl)c2n1)N1CC[C@@]2(C1)CCC[N@@H+](CC1CC1)C2 ZINC000072168504 207984420 /nfs/dbraw/zinc/98/44/20/207984420.db2.gz HZDVYKPFTIKDMO-QFIPXVFZSA-N 1 1 383.923 4.226 50 0 GIAAMO CC(=O)c1cc(C[NH+]2CCC(c3n[nH]cc3-c3ccccc3C)CC2)n(C)c1 ZINC000077485583 208046702 /nfs/dbraw/zinc/04/67/02/208046702.db2.gz GDCAIBBMJQRQQE-UHFFFAOYSA-N 1 1 376.504 4.306 50 0 GIAAMO COc1ccc(-c2nc3cc(C)ccc3cc2C[N@@H+]2CC[C@H](N(C)C)C2)cc1 ZINC000072429056 208024986 /nfs/dbraw/zinc/02/49/86/208024986.db2.gz BDBSOBCJGAGPCL-NRFANRHFSA-N 1 1 375.516 4.355 50 0 GIAAMO COc1ccc(-c2nc3cc(C)ccc3cc2C[N@H+]2CC[C@H](N(C)C)C2)cc1 ZINC000072429056 208024992 /nfs/dbraw/zinc/02/49/92/208024992.db2.gz BDBSOBCJGAGPCL-NRFANRHFSA-N 1 1 375.516 4.355 50 0 GIAAMO CNC(=O)[C@H]1CCC[N@H+]1Cc1cc2cc(C)ccc2nc1-c1ccc(F)cc1 ZINC000072432989 208025425 /nfs/dbraw/zinc/02/54/25/208025425.db2.gz YHDYZNPMWXBFIC-OAQYLSRUSA-N 1 1 377.463 4.060 50 0 GIAAMO CC(C)(CO)C[N@H+]1CCC[C@@H](C(=O)Nc2cccc(-c3ccc(F)cc3)c2)C1 ZINC000015063661 208037474 /nfs/dbraw/zinc/03/74/74/208037474.db2.gz RYUATCZVQUYDNC-LJQANCHMSA-N 1 1 384.495 4.162 50 0 GIAAMO Cc1ccc(-c2c[nH]nc2[C@@H]2CCC[N@H+](Cc3cnc(N(C)C)s3)C2)cc1 ZINC000077455919 208043805 /nfs/dbraw/zinc/04/38/05/208043805.db2.gz FTGHCQRBTFNQGZ-QGZVFWFLSA-N 1 1 381.549 4.287 50 0 GIAAMO Cc1cc(=O)[nH]c(-c2cccc(C[N@@H+](Cc3ccccn3)C3CCCCC3)c2)n1 ZINC000082039357 208077368 /nfs/dbraw/zinc/07/73/68/208077368.db2.gz DLRARVHZMRABDD-UHFFFAOYSA-N 1 1 388.515 4.475 50 0 GIAAMO CCc1c(C)nc(C)nc1NCc1cc2n(n1)CCC[N@H+](C1CCCCC1)C2 ZINC000082098891 208079516 /nfs/dbraw/zinc/07/95/16/208079516.db2.gz WMPOVEJWUCWHTC-UHFFFAOYSA-N 1 1 382.556 4.003 50 0 GIAAMO C[N@@H+](Cc1ccccc1)[C@](C)(CNS(=O)(=O)c1ccccc1)c1ccccc1 ZINC000089901353 208112177 /nfs/dbraw/zinc/11/21/77/208112177.db2.gz HCXJNSDPMSJPMP-HSZRJFAPSA-N 1 1 394.540 4.012 50 0 GIAAMO Cc1[nH]c2c(cc(C)cc2C)c1CC(=O)N[C@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000091254383 208114547 /nfs/dbraw/zinc/11/45/47/208114547.db2.gz NZRRVDTXIXBLPE-SFHVURJKSA-N 1 1 395.572 4.478 50 0 GIAAMO Cc1[nH]c2c(c1CC(=O)NCc1ccccc1-n1cc[nH+]c1C)c(C)ccc2C ZINC000091468252 208120385 /nfs/dbraw/zinc/12/03/85/208120385.db2.gz TVKRXRNGXUEEHG-UHFFFAOYSA-N 1 1 386.499 4.446 50 0 GIAAMO O=C1CC2(CN1CCCc1ccccc1)CC[NH+](Cc1c(F)cccc1F)CC2 ZINC000095362808 208163742 /nfs/dbraw/zinc/16/37/42/208163742.db2.gz QTYVAMZNIFTMHN-UHFFFAOYSA-N 1 1 398.497 4.412 50 0 GIAAMO COCOc1ccc(OC)cc1C[N@@H+]1CC=C(c2c[nH]c3ccccc32)CC1 ZINC000095467762 208190795 /nfs/dbraw/zinc/19/07/95/208190795.db2.gz GQGWVXGGEZKUPF-UHFFFAOYSA-N 1 1 378.472 4.449 50 0 GIAAMO O=C([C@H]1C[C@@H]1c1ccccc1C(F)(F)F)N1CC[NH+](Cc2ccccc2)CC1 ZINC000095469942 208191105 /nfs/dbraw/zinc/19/11/05/208191105.db2.gz QVUNJUAAHQAZOE-MOPGFXCFSA-N 1 1 388.433 4.153 50 0 GIAAMO C[C@H](c1ccc(NC(=O)c2ncoc2-c2cccs2)cc1)[NH+]1CCOCC1 ZINC000095957402 208245089 /nfs/dbraw/zinc/24/50/89/208245089.db2.gz YAUDNCXKWPGQTP-CQSZACIVSA-N 1 1 383.473 4.049 50 0 GIAAMO CCCOc1ccc(OCC(=O)N[C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)cc1 ZINC000230139601 209005536 /nfs/dbraw/zinc/00/55/36/209005536.db2.gz PWJTXWXSQISESL-PZJWPPBQSA-N 1 1 396.531 4.024 50 0 GIAAMO C[C@@H](C(=O)NC[C@@H]1CCC[N@H+]2CCCC[C@H]12)c1ccc(C[C@@H]2CCCC2=O)cc1 ZINC000096113979 209010558 /nfs/dbraw/zinc/01/05/58/209010558.db2.gz XNSUPKAJFXOXLL-HGSOSGBHSA-N 1 1 396.575 4.083 50 0 GIAAMO Cc1cccc(NC(=O)[C@@H]2CCC[N@H+](Cc3nc4ccccc4n3C)C2)c1C ZINC000247961367 209029466 /nfs/dbraw/zinc/02/94/66/209029466.db2.gz FGMIPAAFTKFLMS-GOSISDBHSA-N 1 1 376.504 4.041 50 0 GIAAMO CCn1c(C[N@@H+]2CCC[C@H](C(=O)Nc3ccc(F)cc3F)C2)nc2ccccc21 ZINC000249697886 209031303 /nfs/dbraw/zinc/03/13/03/209031303.db2.gz VFITVFRSGJZPAQ-HNNXBMFYSA-N 1 1 398.457 4.185 50 0 GIAAMO CCn1c(C[N@H+]2CCC[C@H](C(=O)Nc3ccc(F)cc3F)C2)nc2ccccc21 ZINC000249697886 209031309 /nfs/dbraw/zinc/03/13/09/209031309.db2.gz VFITVFRSGJZPAQ-HNNXBMFYSA-N 1 1 398.457 4.185 50 0 GIAAMO CCn1c(C[N@H+]2CCC[C@H](C(=O)N[C@@H](C)c3ccccc3)C2)nc2ccccc21 ZINC000248264899 209033052 /nfs/dbraw/zinc/03/30/52/209033052.db2.gz SBFYJGYUNTWSLQ-ICSRJNTNSA-N 1 1 390.531 4.146 50 0 GIAAMO CCCCN(CCC)C(=O)[C@@H]1CCC[N@@H+](Cc2nc3ccccc3n2CC)C1 ZINC000249681523 209033274 /nfs/dbraw/zinc/03/32/74/209033274.db2.gz BKZIIQCWHFKWLH-LJQANCHMSA-N 1 1 384.568 4.307 50 0 GIAAMO C[C@@H]1CC[C@H](O)[C@@H]([C@@H]2CCCC[N@H+]2Cc2cccc(C(=O)N3CCCCC3)c2)C1 ZINC000253393150 209038993 /nfs/dbraw/zinc/03/89/93/209038993.db2.gz AFVNDNOBNVMNSE-JFTIXFDTSA-N 1 1 398.591 4.464 50 0 GIAAMO COc1ccc([C@H]2CCC[N@H+]2Cc2cc(=O)oc3cc(OC)ccc23)c(OC)c1 ZINC000007740022 221009566 /nfs/dbraw/zinc/00/95/66/221009566.db2.gz UZQJEWVRCUNUGM-HXUWFJFHSA-N 1 1 395.455 4.156 50 0 GIAAMO CC(C)C[N@@H+]1CCO[C@@H](CNCc2ccc(-c3nc4ccccc4s3)o2)C1 ZINC000007985271 221018564 /nfs/dbraw/zinc/01/85/64/221018564.db2.gz XFHGCSUHHUCABC-KRWDZBQOSA-N 1 1 385.533 4.003 50 0 GIAAMO CC(C)C[N@H+]1CCO[C@@H](CNCc2ccc(-c3nc4ccccc4s3)o2)C1 ZINC000007985271 221018566 /nfs/dbraw/zinc/01/85/66/221018566.db2.gz XFHGCSUHHUCABC-KRWDZBQOSA-N 1 1 385.533 4.003 50 0 GIAAMO COc1ccccc1N1CC[NH+](Cc2cc(=O)oc3ccc(C(C)C)cc23)CC1 ZINC000054219973 132441922 /nfs/dbraw/zinc/44/19/22/132441922.db2.gz YLWJPNMXDGZSOY-UHFFFAOYSA-N 1 1 392.499 4.247 50 0 GIAAMO CC[N@H+](Cc1nc(-c2ccc(N3CCC[C@H](C)C3)nc2)no1)Cc1ccccc1 ZINC000065216032 136160319 /nfs/dbraw/zinc/16/03/19/136160319.db2.gz QJLIXLAJSYMAAR-SFHVURJKSA-N 1 1 391.519 4.390 50 0 GIAAMO CC[N@@H+](Cc1nc(-c2ccc(N3CCC[C@H](C)C3)nc2)no1)Cc1ccccc1 ZINC000065216032 136160320 /nfs/dbraw/zinc/16/03/20/136160320.db2.gz QJLIXLAJSYMAAR-SFHVURJKSA-N 1 1 391.519 4.390 50 0 GIAAMO CCN(C)c1cc(N2CCC[C@H](C(=O)c3ccc(C(F)(F)F)cc3)C2)nc[nH+]1 ZINC000071775633 136166725 /nfs/dbraw/zinc/16/67/25/136166725.db2.gz SQDZAPAEMMEWGC-HNNXBMFYSA-N 1 1 392.425 4.051 50 0 GIAAMO Clc1ccc(C[N@H+]2CC[C@H](C3CCN(c4ncnc5c4CCC5)CC3)C2)cc1 ZINC000072171317 136167443 /nfs/dbraw/zinc/16/74/43/136167443.db2.gz SOZJVGJQTJNNBI-IBGZPJMESA-N 1 1 396.966 4.357 50 0 GIAAMO Cc1ccc(N2CCC3(CCC[N@H+]3Cc3ccc([C@H]4CCCO4)s3)CC2)nn1 ZINC000072424263 136169822 /nfs/dbraw/zinc/16/98/22/136169822.db2.gz LQQFKZBPZLMXEH-LJQANCHMSA-N 1 1 398.576 4.333 50 0 GIAAMO CCc1ncc(C[N@H+]2CCCC23CCN(c2ccc4ncccc4c2)CC3)cn1 ZINC000072435805 136170353 /nfs/dbraw/zinc/17/03/53/136170353.db2.gz NYGBDRPCQMRIKF-UHFFFAOYSA-N 1 1 387.531 4.222 50 0 GIAAMO c1cn(Cc2cscn2)c([C@H]2CCCN(c3ccc4c([nH+]3)CCCC4)C2)n1 ZINC000095525178 136181428 /nfs/dbraw/zinc/18/14/28/136181428.db2.gz ZODXTGYWKLJVPD-KRWDZBQOSA-N 1 1 379.533 4.046 50 0 GIAAMO COc1cccc2ccc(N3CCC(c4[nH+]ccn4Cc4ccccn4)CC3)nc21 ZINC000095527052 136181755 /nfs/dbraw/zinc/18/17/55/136181755.db2.gz OVNHWSNRMZGPKR-UHFFFAOYSA-N 1 1 399.498 4.267 50 0 GIAAMO FC(F)(F)c1ccnc(N2CCC[C@@H](c3[nH+]ccn3Cc3ccncc3)C2)c1 ZINC000095531376 136181807 /nfs/dbraw/zinc/18/18/07/136181807.db2.gz KAHBTDUSUDJWTM-MRXNPFEDSA-N 1 1 387.409 4.124 50 0 GIAAMO Cc1ccc(NC(=O)C[NH+]2CCC(c3nc(-c4ccc(F)cc4)no3)CC2)cc1 ZINC000065184161 222107162 /nfs/dbraw/zinc/10/71/62/222107162.db2.gz LGSAZLXINAHKHU-UHFFFAOYSA-N 1 1 394.450 4.002 50 0 GIAAMO C[C@@H]1C[N@H+](Cc2ccccc2)CCN1C(=O)Nc1ccccc1N1CCCC1 ZINC000072313541 222224238 /nfs/dbraw/zinc/22/42/38/222224238.db2.gz YZOAAUFGMJKXPA-LJQANCHMSA-N 1 1 378.520 4.025 50 0 GIAAMO C[C@@H]1C[N@@H+](Cc2ccccc2)CCN1C(=O)Nc1ccccc1N1CCCC1 ZINC000072313541 222224241 /nfs/dbraw/zinc/22/42/41/222224241.db2.gz YZOAAUFGMJKXPA-LJQANCHMSA-N 1 1 378.520 4.025 50 0 GIAAMO C[N@@H+](Cc1ccccc1NCC(=O)NC(=O)Nc1ccccc1)C1CCCCC1 ZINC000010170575 523377541 /nfs/dbraw/zinc/37/75/41/523377541.db2.gz VZNJCXOHIFPWHP-UHFFFAOYSA-N 1 1 394.519 4.211 50 0 GIAAMO CC(C)c1ccc(CN2CCC[C@]3(CC[N@@H+](CCc4ccccn4)C3)C2=O)cc1 ZINC000426382616 528092996 /nfs/dbraw/zinc/09/29/96/528092996.db2.gz GYRHYDVQJVYPDH-RUZDIDTESA-N 1 1 391.559 4.262 50 0 GIAAMO C[C@@H](CNC(=O)c1ccc(Oc2ccccc2)nc1)[N@@H+]1CCc2sccc2C1 ZINC000048262106 570224622 /nfs/dbraw/zinc/22/46/22/570224622.db2.gz WFDPYWVBZJRPKN-INIZCTEOSA-N 1 1 393.512 4.112 50 0 GIAAMO C[C@@H](CNC(=O)c1ccc(Oc2ccccc2)nc1)[N@H+]1CCc2sccc2C1 ZINC000048262106 570224625 /nfs/dbraw/zinc/22/46/25/570224625.db2.gz WFDPYWVBZJRPKN-INIZCTEOSA-N 1 1 393.512 4.112 50 0 GIAAMO Cc1ccc(C)c(Oc2ccc(CNC(=O)[C@H](c3ccccc3)[NH+](C)C)cn2)c1 ZINC000048311866 570233307 /nfs/dbraw/zinc/23/33/07/570233307.db2.gz AEERAFHPGKVKQN-QHCPKHFHSA-N 1 1 389.499 4.410 50 0 GIAAMO Cc1ccc(NC(=O)C(C)C)cc1NC(=O)N1CC[N@H+](C)C[C@H]1c1ccccc1 ZINC000048344136 570240209 /nfs/dbraw/zinc/24/02/09/570240209.db2.gz WOBLBTHGKIKQTG-NRFANRHFSA-N 1 1 394.519 4.110 50 0 GIAAMO Cc1ccc(NC(=O)C(C)C)cc1NC(=O)N1CC[N@@H+](C)C[C@H]1c1ccccc1 ZINC000048344136 570240212 /nfs/dbraw/zinc/24/02/12/570240212.db2.gz WOBLBTHGKIKQTG-NRFANRHFSA-N 1 1 394.519 4.110 50 0 GIAAMO Cc1[nH+]ccn1-c1ccccc1CNC(=O)c1ccc(OC(F)(F)F)cc1 ZINC000048354994 570243632 /nfs/dbraw/zinc/24/36/32/570243632.db2.gz GOZKBKLBZLSIBT-UHFFFAOYSA-N 1 1 375.350 4.009 50 0 GIAAMO Cc1cc(Nc2ccc(NC(=O)Cc3cccs3)cc2)nc(N2CCCC2)[nH+]1 ZINC000049028132 570260078 /nfs/dbraw/zinc/26/00/78/570260078.db2.gz JZYMLXZKIIYTGH-UHFFFAOYSA-N 1 1 393.516 4.372 50 0 GIAAMO CCOc1ccc([C@@H](C)[NH2+][C@@H](C)c2nc3ccccc3c(=O)[nH]2)cc1OCC ZINC000049581350 570271537 /nfs/dbraw/zinc/27/15/37/570271537.db2.gz HZQZXLBGHNRKRP-CABCVRRESA-N 1 1 381.476 4.132 50 0 GIAAMO O=C(c1ccc(Br)cc1)c1cccc(C[NH+]2CCSCC2)c1 ZINC000002515283 570289344 /nfs/dbraw/zinc/28/93/44/570289344.db2.gz QXBJJVICPJSHSE-UHFFFAOYSA-N 1 1 376.319 4.229 50 0 GIAAMO CC(C)c1nccc(CN2CCC[C@]3(CCC[N@@H+](Cc4ccccc4)C3)C2)n1 ZINC000215535473 570289699 /nfs/dbraw/zinc/28/96/99/570289699.db2.gz IJKHPTSRNAUSQK-DEOSSOPVSA-N 1 1 378.564 4.478 50 0 GIAAMO Cc1cc([C@@H]2C[C@H](C(=O)NC3CC3)C[N@@H+](Cc3ccc(F)cc3)C2)ccc1F ZINC000034716646 570319576 /nfs/dbraw/zinc/31/95/76/570319576.db2.gz IEWAIOTWEUUXAC-MOPGFXCFSA-N 1 1 384.470 4.158 50 0 GIAAMO CC(=O)Nc1ccc(NC(=O)[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)cc1Cl ZINC000050028024 570328430 /nfs/dbraw/zinc/32/84/30/570328430.db2.gz XRYBTGAGLPNSOK-QGZVFWFLSA-N 1 1 385.895 4.149 50 0 GIAAMO C[C@H]1CCCC[N@H+]1Cc1ccc(NC(=O)c2csc(-c3cnn(C)c3)n2)cc1 ZINC000053722154 570338926 /nfs/dbraw/zinc/33/89/26/570338926.db2.gz PGMGARVICNTPMV-HNNXBMFYSA-N 1 1 395.532 4.170 50 0 GIAAMO CCC(=O)N[C@H](C)[C@@H]1c2cc(OC)c(OC)cc2CC[N@H+]1Cc1ccc(C)cc1 ZINC000034855498 570341464 /nfs/dbraw/zinc/34/14/64/570341464.db2.gz RDNCJWOKSNUJBH-MZNJEOGPSA-N 1 1 396.531 4.026 50 0 GIAAMO CCC(=O)N[C@H](C)[C@@H]1c2cc(OC)c(OC)cc2CC[N@@H+]1Cc1ccc(C)cc1 ZINC000034855498 570341467 /nfs/dbraw/zinc/34/14/67/570341467.db2.gz RDNCJWOKSNUJBH-MZNJEOGPSA-N 1 1 396.531 4.026 50 0 GIAAMO O=C(C[NH+]1CCCCC1)N1N=C2c3ccccc3CC[C@H]2[C@H]1c1ccc(F)cc1 ZINC000004335050 570368949 /nfs/dbraw/zinc/36/89/49/570368949.db2.gz YLABMUXTANIIBN-ZJSXRUAMSA-N 1 1 391.490 4.162 50 0 GIAAMO COc1ccccc1N1CCN(C2CC[NH+](Cc3ccccc3Cl)CC2)CC1 ZINC000004703450 570395229 /nfs/dbraw/zinc/39/52/29/570395229.db2.gz RWUBMOVNJMETCZ-UHFFFAOYSA-N 1 1 399.966 4.135 50 0 GIAAMO O=C([C@@H]1CCC[N@H+](Cc2ccccc2Br)C1)N1CCCCCC1 ZINC000004745213 570401697 /nfs/dbraw/zinc/40/16/97/570401697.db2.gz YYMVVDYXESRLFA-QGZVFWFLSA-N 1 1 379.342 4.064 50 0 GIAAMO CC[C@@H](C)NC(=O)[C@@H]1CCC[N@@H+](Cc2nc(-c3ccc(Cl)cc3)oc2C)C1 ZINC000005044128 570405186 /nfs/dbraw/zinc/40/51/86/570405186.db2.gz VEAGHIUTBUYDPV-RHSMWYFYSA-N 1 1 389.927 4.430 50 0 GIAAMO C[C@@H]([NH2+]CC(=O)Nc1cc(C2CC2)nn1-c1ccccc1)c1ccccc1F ZINC000013010745 570416447 /nfs/dbraw/zinc/41/64/47/570416447.db2.gz XCUWKPBQSMOAMV-OAHLLOKOSA-N 1 1 378.451 4.178 50 0 GIAAMO C[NH+](C)[C@@H](CNC(=O)CCc1ncc(-c2ccccc2)o1)c1ccccc1Cl ZINC000013010416 570416477 /nfs/dbraw/zinc/41/64/77/570416477.db2.gz NNQBHJDQYVFCLY-IBGZPJMESA-N 1 1 397.906 4.347 50 0 GIAAMO COc1ccc(C[N@H+]2CCC[C@@H](C(=O)Nc3c(C)cccc3C)C2)cc1OC ZINC000005017762 570424018 /nfs/dbraw/zinc/42/40/18/570424018.db2.gz QSVNBDGOVAQFFK-LJQANCHMSA-N 1 1 382.504 4.171 50 0 GIAAMO [NH3+][C@@H](Cc1ccccc1)c1nnc(SCc2ccc(Br)cc2)o1 ZINC000011903983 570445492 /nfs/dbraw/zinc/44/54/92/570445492.db2.gz ZQCKEPRCAGWLSC-HNNXBMFYSA-N 1 1 390.306 4.367 50 0 GIAAMO C[N@@H+](CC(=O)Nc1ccccc1C(=O)Nc1ccccc1)[C@@H]1CCc2ccccc21 ZINC000029484730 570474777 /nfs/dbraw/zinc/47/47/77/570474777.db2.gz CKGUJPRVWLZXFV-HSZRJFAPSA-N 1 1 399.494 4.497 50 0 GIAAMO CC(C)Cn1ccc2cc(NC(=O)N3C[C@@H]4C[N@H+]5CCCC[C@@H]5[C@@H]4C3)ccc21 ZINC000072295078 570500981 /nfs/dbraw/zinc/50/09/81/570500981.db2.gz ZDVRLEZRGXLOBD-CZTZKLFOSA-N 1 1 380.536 4.245 50 0 GIAAMO Cc1ccc2occ(CN3CC[N@H+]4CCC[C@@H]4[C@H]3C3CCCCC3)c(=O)c2c1 ZINC000584904397 570504876 /nfs/dbraw/zinc/50/48/76/570504876.db2.gz CQCLHXBXXLTALA-FYYLOGMGSA-N 1 1 380.532 4.330 50 0 GIAAMO Cc1ccc(C[N@@H+](C[C@H](O)COc2ccccc2C)C[C@@H]2CCCO2)c(C)c1 ZINC000036031192 570517571 /nfs/dbraw/zinc/51/75/71/570517571.db2.gz ZBCWLNGVSAPTBY-GOTSBHOMSA-N 1 1 383.532 4.033 50 0 GIAAMO CC[N@@H+](CCCc1nc(-c2ccc(C)c(F)c2)no1)C[C@H](O)c1ccc(C)cc1 ZINC000072305236 570518440 /nfs/dbraw/zinc/51/84/40/570518440.db2.gz RAHCGKLARGBIHS-NRFANRHFSA-N 1 1 397.494 4.481 50 0 GIAAMO CC[C@@H](C)NC(=O)c1coc(C[N@H+](Cc2cccc(OC)c2)[C@@H](C)C(C)C)n1 ZINC000036065583 570526272 /nfs/dbraw/zinc/52/62/72/570526272.db2.gz XPSSKRXFBCLYJO-SJORKVTESA-N 1 1 387.524 4.258 50 0 GIAAMO CC[C@@H](C)NC(=O)c1coc(C[N@@H+](Cc2cccc(OC)c2)[C@@H](C)C(C)C)n1 ZINC000036065583 570526274 /nfs/dbraw/zinc/52/62/74/570526274.db2.gz XPSSKRXFBCLYJO-SJORKVTESA-N 1 1 387.524 4.258 50 0 GIAAMO Cc1[nH+]ccn1CCc1nc2cc(NC(=O)c3ccccc3Cl)ccc2n1C ZINC000006665107 570526690 /nfs/dbraw/zinc/52/66/90/570526690.db2.gz AQNXRWYZFZOFDI-UHFFFAOYSA-N 1 1 393.878 4.227 50 0 GIAAMO O=C(C[NH2+]C(c1cccs1)c1cccs1)N[C@@H]1CCOc2ccccc21 ZINC000072308147 570526776 /nfs/dbraw/zinc/52/67/76/570526776.db2.gz YPAWBRQVDQNVRS-OAHLLOKOSA-N 1 1 384.526 4.129 50 0 GIAAMO COc1ccc(OC[C@@H](O)C[N@@H+](Cc2ccccc2)Cc2ccccc2C)cc1 ZINC000036104434 570540797 /nfs/dbraw/zinc/54/07/97/570540797.db2.gz GGHBBHSFQHSMHJ-QHCPKHFHSA-N 1 1 391.511 4.446 50 0 GIAAMO COCc1c2ccccc2oc1C(=O)NC[C@H](c1ccco1)[NH+]1CCCCC1 ZINC000032967217 570550785 /nfs/dbraw/zinc/55/07/85/570550785.db2.gz FVBIKJCDJBSOLY-GOSISDBHSA-N 1 1 382.460 4.129 50 0 GIAAMO COc1ccc(C[N@H+]2CCC[C@H]2c2cc(C)no2)cc1COCC(F)(F)F ZINC000035511215 570553871 /nfs/dbraw/zinc/55/38/71/570553871.db2.gz FSSBNHCXPQQDNG-INIZCTEOSA-N 1 1 384.398 4.408 50 0 GIAAMO COc1ccccc1-c1csc2[nH]c(C[N@@H+](C)C3CCCCC3)nc(=O)c12 ZINC000036204186 570568624 /nfs/dbraw/zinc/56/86/24/570568624.db2.gz WDZZFLREGXPGHE-UHFFFAOYSA-N 1 1 383.517 4.425 50 0 GIAAMO CC(C)c1ccc(C[N@H+]2CCC[C@@]3(CCN(C(=O)C4CCOCC4)C3)C2)cc1 ZINC000011662059 570576949 /nfs/dbraw/zinc/57/69/49/570576949.db2.gz PUKNDYFZCMQUMN-XMMPIXPASA-N 1 1 384.564 4.051 50 0 GIAAMO Cc1ccccc1CC[N@@H+]1CCC[C@@H](CN(C)C(=O)c2cc(C(C)C)no2)C1 ZINC000011661413 570576981 /nfs/dbraw/zinc/57/69/81/570576981.db2.gz NBWSGNWCKAUTHL-IBGZPJMESA-N 1 1 383.536 4.133 50 0 GIAAMO O=C(N[C@H]1CCC[N@@H+](CCc2ccccc2)C1)c1ccccc1C(F)(F)F ZINC000011662249 570577596 /nfs/dbraw/zinc/57/75/96/570577596.db2.gz FZGHPMPQRAWOLJ-KRWDZBQOSA-N 1 1 376.422 4.142 50 0 GIAAMO O=C(N[C@H]1CCC[N@H+](C2CCCCCC2)C1)c1c[nH]nc1-c1ccccc1F ZINC000011664278 570578593 /nfs/dbraw/zinc/57/85/93/570578593.db2.gz MNVRVAWCWKXZPV-INIZCTEOSA-N 1 1 384.499 4.133 50 0 GIAAMO O=C(CCc1ccc(F)c(F)c1)N[C@@H]1CCC[N@H+](Cc2ccc(Cl)cc2)C1 ZINC000011818756 570585506 /nfs/dbraw/zinc/58/55/06/570585506.db2.gz FQKJKMWESNDLFE-GOSISDBHSA-N 1 1 392.877 4.332 50 0 GIAAMO O=C(CCc1ccc(F)c(F)c1)N[C@@H]1CCC[N@@H+](Cc2ccc(Cl)cc2)C1 ZINC000011818756 570585508 /nfs/dbraw/zinc/58/55/08/570585508.db2.gz FQKJKMWESNDLFE-GOSISDBHSA-N 1 1 392.877 4.332 50 0 GIAAMO Oc1ccc(CC[C@H]2CCCC[N@H+]2Cc2nc(Cc3cccc(F)c3)no2)cc1 ZINC000011839828 570586758 /nfs/dbraw/zinc/58/67/58/570586758.db2.gz SBBGIYXCXXAUJK-HXUWFJFHSA-N 1 1 395.478 4.492 50 0 GIAAMO Cc1ccccc1CC[N@@H+]1CCC[C@@H](CN(C)C(=O)c2cc(CC(C)C)on2)C1 ZINC000011842577 570587263 /nfs/dbraw/zinc/58/72/63/570587263.db2.gz QMHOGGVLZNBITA-FQEVSTJZSA-N 1 1 397.563 4.208 50 0 GIAAMO CC1CC[NH+]([C@H](CNC(=O)c2cc(-c3ccccc3)on2)c2ccco2)CC1 ZINC000011905249 570591687 /nfs/dbraw/zinc/59/16/87/570591687.db2.gz IMOZIRLIJGKYRH-LJQANCHMSA-N 1 1 379.460 4.138 50 0 GIAAMO COc1ccc(CC[N@H+]2CCC[C@H](CN(C)Cc3cc(CC(C)C)n[nH]3)C2)cc1 ZINC000011936275 570594040 /nfs/dbraw/zinc/59/40/40/570594040.db2.gz CEAGEJIYAWAGTP-OAQYLSRUSA-N 1 1 398.595 4.003 50 0 GIAAMO COc1ccc(CC[N@@H+]2CCC[C@H](CN(C)Cc3cc(CC(C)C)[nH]n3)C2)cc1 ZINC000011936275 570594041 /nfs/dbraw/zinc/59/40/41/570594041.db2.gz CEAGEJIYAWAGTP-OAQYLSRUSA-N 1 1 398.595 4.003 50 0 GIAAMO COc1ccc(CC[N@H+]2CCC[C@H](CN(C)Cc3cc(CC(C)C)[nH]n3)C2)cc1 ZINC000011936275 570594044 /nfs/dbraw/zinc/59/40/44/570594044.db2.gz CEAGEJIYAWAGTP-OAQYLSRUSA-N 1 1 398.595 4.003 50 0 GIAAMO COc1ccccc1N1CC[C@H](C)[N@@H+](Cc2ncc(-c3ccccc3)o2)CC1 ZINC000225613828 570594186 /nfs/dbraw/zinc/59/41/86/570594186.db2.gz ZYATWMLRSIVISG-SFHVURJKSA-N 1 1 377.488 4.451 50 0 GIAAMO O=C(c1cc(F)ccc1F)[C@H]1CCC[N@H+](Cc2cccn2-c2ccccn2)C1 ZINC000011937441 570594564 /nfs/dbraw/zinc/59/45/64/570594564.db2.gz QZHJZSRLDNFYRC-INIZCTEOSA-N 1 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Cc1ccccc1-c1ncc(C[N@H+]2CCC[C@](CO)(Cc3ccccc3)C2)cn1 ZINC000012054186 570601445 /nfs/dbraw/zinc/60/14/45/570601445.db2.gz HYVQXLWMLVANDD-VWLOTQADSA-N 1 1 387.527 4.269 50 0 GIAAMO C[C@H](O)C[N@@H+](Cc1c(-c2ccccc2)nn(C)c1Oc1cccc(F)c1)C1CC1 ZINC000036307119 570604221 /nfs/dbraw/zinc/60/42/21/570604221.db2.gz ACSAVJNEIAABTA-INIZCTEOSA-N 1 1 395.478 4.364 50 0 GIAAMO CC(C)[C@@H](C(=O)NCc1ccc(C[N@H+]2CCC[C@H](C)C2)cc1)c1ccccn1 ZINC000225704019 570606090 /nfs/dbraw/zinc/60/60/90/570606090.db2.gz CDYAFYRHGIVVOX-WMZHIEFXSA-N 1 1 379.548 4.370 50 0 GIAAMO COc1ccccc1C[NH2+]Cc1ccccc1OCC(=O)Nc1ccc(C)cc1 ZINC000040732896 570608996 /nfs/dbraw/zinc/60/89/96/570608996.db2.gz DJKXJKGRGPJLHF-UHFFFAOYSA-N 1 1 390.483 4.311 50 0 GIAAMO C(=C/c1ccccc1)\C[NH+]1CCN(c2nc3ccccc3c(N3CCCC3)n2)CC1 ZINC000041148369 570615388 /nfs/dbraw/zinc/61/53/88/570615388.db2.gz OTFNYJPAOCGPRS-DHZHZOJOSA-N 1 1 399.542 4.065 50 0 GIAAMO C[C@H]1CCCC[N@H+]1CCNC(=O)c1ccc2nc(CCc3ccccc3)oc2c1 ZINC000064968148 570619227 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CCOc1cc(CNCC[NH+](C)C)cc(Cl)c1OCc1ccccc1C ZINC000040720511 570605226 /nfs/dbraw/zinc/60/52/26/570605226.db2.gz WMAZCOITWINIQT-UHFFFAOYSA-N 1 1 376.928 4.277 50 0 GIAAMO COc1cccc([C@@H]2CC(c3cccc(C)c3)=NN2C(=O)C[NH+]2CCCCC2)c1 ZINC000036345629 570628077 /nfs/dbraw/zinc/62/80/77/570628077.db2.gz XYWUSQFPVIJTKK-QHCPKHFHSA-N 1 1 391.515 4.167 50 0 GIAAMO COC[C@H]1CCCC[N@H+]1Cc1nc(-c2cc3c(cc2Cl)OCO3)oc1C ZINC000012299939 570635357 /nfs/dbraw/zinc/63/53/57/570635357.db2.gz FIIIVVFQSZVVSU-CYBMUJFWSA-N 1 1 378.856 4.033 50 0 GIAAMO CC(C)c1ccc(N[C@H]2CCC[N@@H+](Cc3ccc(N4CCNC4=O)cc3)C2)cc1 ZINC000012301851 570636539 /nfs/dbraw/zinc/63/65/39/570636539.db2.gz SLYASSPXDKGDJI-QFIPXVFZSA-N 1 1 392.547 4.416 50 0 GIAAMO CN(C)c1ncc(CN2CC[C@]3(C2)CCC[N@@H+](CC2CCCCC2)C3)s1 ZINC000012304259 570638168 /nfs/dbraw/zinc/63/81/68/570638168.db2.gz ZSYABBQRFQAEAL-OAQYLSRUSA-N 1 1 376.614 4.077 50 0 GIAAMO COc1ccccc1C(=O)[C@H]1CCC[N@@H+](Cc2c[nH]nc2-c2cccc(F)c2)C1 ZINC000012316509 570641323 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ZINC000071748959 211052994 /nfs/dbraw/zinc/05/29/94/211052994.db2.gz NWEHBKTXXGMBKO-OAQYLSRUSA-N 1 1 384.495 4.212 50 0 GIAAMO COc1cccc(C[N@H+]2CCC(=O)N(Cc3ccc(F)cc3)[C@H](C(C)C)C2)c1 ZINC000071749816 211056718 /nfs/dbraw/zinc/05/67/18/211056718.db2.gz UBPVDCPSDYJVAR-QFIPXVFZSA-N 1 1 384.495 4.093 50 0 GIAAMO COc1ccc2cc([C@@H]3C[N@H+](Cc4ccc(O)c(OC)c4)CCO3)ccc2c1 ZINC000071439954 211049579 /nfs/dbraw/zinc/04/95/79/211049579.db2.gz XSBDDQVYXLZKDQ-QHCPKHFHSA-N 1 1 379.456 4.136 50 0 GIAAMO COc1ccc2cc([C@@H]3C[N@@H+](Cc4ccc(O)c(OC)c4)CCO3)ccc2c1 ZINC000071439954 211049582 /nfs/dbraw/zinc/04/95/82/211049582.db2.gz XSBDDQVYXLZKDQ-QHCPKHFHSA-N 1 1 379.456 4.136 50 0 GIAAMO C[C@H]1CCCC[N@@H+]1Cc1c(C(=O)N(C)CCc2ccccc2)nc2sccn12 ZINC000071524087 211048537 /nfs/dbraw/zinc/04/85/37/211048537.db2.gz MZGVIQYIHZQVOJ-KRWDZBQOSA-N 1 1 396.560 4.085 50 0 GIAAMO C[C@H]1CCCC[N@H+]1Cc1c(C(=O)N(C)CCc2ccccc2)nc2sccn12 ZINC000071524087 211048539 /nfs/dbraw/zinc/04/85/39/211048539.db2.gz MZGVIQYIHZQVOJ-KRWDZBQOSA-N 1 1 396.560 4.085 50 0 GIAAMO O=C(Nc1ccc(Oc2ccccc2)nc1)C1CC[NH+](Cc2nccs2)CC1 ZINC000067908041 211028836 /nfs/dbraw/zinc/02/88/36/211028836.db2.gz IOTUUZHTBYAYPN-UHFFFAOYSA-N 1 1 394.500 4.181 50 0 GIAAMO Cc1cccc(OCC(=O)NC[C@H](c2ccccc2Cl)[NH+]2CCCCC2)c1 ZINC000027663736 210515605 /nfs/dbraw/zinc/51/56/05/210515605.db2.gz CYERVMCCWLARET-OAQYLSRUSA-N 1 1 386.923 4.371 50 0 GIAAMO Cc1nc(N(C)C)cc(Nc2ccc(NC(=O)Nc3ccc(F)cc3)cc2)[nH+]1 ZINC000021795391 210393398 /nfs/dbraw/zinc/39/33/98/210393398.db2.gz WKPCYEYGVGFSAO-UHFFFAOYSA-N 1 1 380.427 4.378 50 0 GIAAMO Cc1nc(Nc2ccc(NC(=O)Nc3ccc(F)cc3)cc2)cc(N(C)C)[nH+]1 ZINC000021795391 210393403 /nfs/dbraw/zinc/39/34/03/210393403.db2.gz WKPCYEYGVGFSAO-UHFFFAOYSA-N 1 1 380.427 4.378 50 0 GIAAMO Cc1ccc([C@H](CNC(=O)c2cc(-c3ccc(C)cc3)on2)[NH+]2CCCC2)o1 ZINC000021659812 210387749 /nfs/dbraw/zinc/38/77/49/210387749.db2.gz WNUJNEQTXATBFJ-IBGZPJMESA-N 1 1 379.460 4.118 50 0 GIAAMO CC(C)N(C(=O)Cn1c(C[NH+]2CCCCC2)nc2ccccc21)c1ccccc1 ZINC000021783136 210393614 /nfs/dbraw/zinc/39/36/14/210393614.db2.gz UAVTUFWFRXCKNA-UHFFFAOYSA-N 1 1 390.531 4.464 50 0 GIAAMO CCOC(=O)C1(CC2CC2)CCN(Cc2ccc(C[NH+]3CCCC3)s2)CC1 ZINC000020997996 210373139 /nfs/dbraw/zinc/37/31/39/210373139.db2.gz QYYLKMZPTVXHGD-UHFFFAOYSA-N 1 1 390.593 4.289 50 0 GIAAMO CCN(C[C@@H]1CCC[N@@H+](CCc2cccc(OC)c2)C1)C(=O)CC1CCCC1 ZINC000020919167 210368876 /nfs/dbraw/zinc/36/88/76/210368876.db2.gz LHDBKRWWGHMFQP-JOCHJYFZSA-N 1 1 386.580 4.379 50 0 GIAAMO OCCOc1cccc(C[N@H+]2Cc3ccccc3O[C@@H](c3ccccc3F)C2)c1 ZINC000020912082 210368635 /nfs/dbraw/zinc/36/86/35/210368635.db2.gz SPWZSYHGCIAYJB-XMMPIXPASA-N 1 1 393.458 4.333 50 0 GIAAMO OCCOc1cccc(C[N@@H+]2Cc3ccccc3O[C@@H](c3ccccc3F)C2)c1 ZINC000020912082 210368639 /nfs/dbraw/zinc/36/86/39/210368639.db2.gz SPWZSYHGCIAYJB-XMMPIXPASA-N 1 1 393.458 4.333 50 0 GIAAMO CC(C)NC(=O)c1ccc([C@H]2CCC[N@@H+]2Cc2ccc3nsnc3c2)s1 ZINC000020868039 210364934 /nfs/dbraw/zinc/36/49/34/210364934.db2.gz PFXLWWMFIRCNLI-MRXNPFEDSA-N 1 1 386.546 4.228 50 0 GIAAMO CC(C)NC(=O)c1ccc([C@H]2CCC[N@H+]2Cc2ccc3nsnc3c2)s1 ZINC000020868039 210364937 /nfs/dbraw/zinc/36/49/37/210364937.db2.gz PFXLWWMFIRCNLI-MRXNPFEDSA-N 1 1 386.546 4.228 50 0 GIAAMO Cc1cc(C)n(-c2ccc(NC(=O)[C@@H]3CCCC[N@H+]3Cc3ccc(C)o3)cc2)n1 ZINC000020858089 210364989 /nfs/dbraw/zinc/36/49/89/210364989.db2.gz JFBJBEAMTZZIAQ-QFIPXVFZSA-N 1 1 392.503 4.384 50 0 GIAAMO Cc1cc(C)n(-c2ccc(NC(=O)[C@@H]3CCCC[N@@H+]3Cc3ccc(C)o3)cc2)n1 ZINC000020858089 210364994 /nfs/dbraw/zinc/36/49/94/210364994.db2.gz JFBJBEAMTZZIAQ-QFIPXVFZSA-N 1 1 392.503 4.384 50 0 GIAAMO CCOc1ccc([C@](C)(O)[C@H](C[NH+]2CCOCC2)c2ccc(Cl)cc2)cc1 ZINC000020868302 210364620 /nfs/dbraw/zinc/36/46/20/210364620.db2.gz BKKAJBWGYWELMO-YADHBBJMSA-N 1 1 389.923 4.062 50 0 GIAAMO COc1ccc(-c2nc(CN3CC[N@H+](C)[C@@H](c4ccccc4)C3)c(C)o2)cc1 ZINC000020783484 210361998 /nfs/dbraw/zinc/36/19/98/210361998.db2.gz YOHYOBTVZLZRHK-JOCHJYFZSA-N 1 1 377.488 4.147 50 0 GIAAMO COc1ccc(-c2nc(CN3CC[N@@H+](C)[C@@H](c4ccccc4)C3)c(C)o2)cc1 ZINC000020783484 210362002 /nfs/dbraw/zinc/36/20/02/210362002.db2.gz YOHYOBTVZLZRHK-JOCHJYFZSA-N 1 1 377.488 4.147 50 0 GIAAMO COc1cccc([C@H]2CCCC[N@H+]2Cc2cccc(-c3nc(C)cc(=O)[nH]3)c2)c1 ZINC000020783097 210361420 /nfs/dbraw/zinc/36/14/20/210361420.db2.gz MFQUSWGHXWNWKP-JOCHJYFZSA-N 1 1 389.499 4.481 50 0 GIAAMO OCC[C@H]1CN(Cc2ccccc2-c2ccco2)CC[N@@H+]1Cc1ccsc1 ZINC000020538788 210346906 /nfs/dbraw/zinc/34/69/06/210346906.db2.gz RQHUOWKEBMZIDT-FQEVSTJZSA-N 1 1 382.529 4.077 50 0 GIAAMO OCC[C@H]1CN(Cc2ccccc2-c2ccco2)CC[N@H+]1Cc1ccsc1 ZINC000020538788 210346910 /nfs/dbraw/zinc/34/69/10/210346910.db2.gz RQHUOWKEBMZIDT-FQEVSTJZSA-N 1 1 382.529 4.077 50 0 GIAAMO OCC[C@H]1C[N@@H+](Cc2ccccc2-c2ccco2)CCN1Cc1ccsc1 ZINC000020538788 210346901 /nfs/dbraw/zinc/34/69/01/210346901.db2.gz RQHUOWKEBMZIDT-FQEVSTJZSA-N 1 1 382.529 4.077 50 0 GIAAMO FC(F)(F)c1cccc(N2CCN([C@@H]3CCC[N@@H+](Cc4ccco4)C3)CC2)c1 ZINC000020455417 210336605 /nfs/dbraw/zinc/33/66/05/210336605.db2.gz SYZDEHAZVIIWHF-LJQANCHMSA-N 1 1 393.453 4.085 50 0 GIAAMO FC(F)(F)c1cccc(N2CC[NH+]([C@@H]3CCCN(Cc4ccco4)C3)CC2)c1 ZINC000020455417 210336609 /nfs/dbraw/zinc/33/66/09/210336609.db2.gz SYZDEHAZVIIWHF-LJQANCHMSA-N 1 1 393.453 4.085 50 0 GIAAMO CCN1CC[NH+](CCCOc2ccc3ccccc3c2Br)CC1 ZINC000020406485 210332178 /nfs/dbraw/zinc/33/21/78/210332178.db2.gz YDGDWPVBMUXSOV-UHFFFAOYSA-N 1 1 377.326 4.009 50 0 GIAAMO CNC(=O)c1ccc([C@H]2CCC[N@H+]2Cc2cc(C)n(-c3cccnc3)c2C)s1 ZINC000020203487 210321824 /nfs/dbraw/zinc/32/18/24/210321824.db2.gz WRNXTSBSTFUCDK-LJQANCHMSA-N 1 1 394.544 4.247 50 0 GIAAMO CCOc1ccc(C[NH+]2CCN(Cc3ccccc3C(F)(F)F)CC2)cc1 ZINC000019842281 210303247 /nfs/dbraw/zinc/30/32/47/210303247.db2.gz GQXYSGDAKPQYPE-UHFFFAOYSA-N 1 1 378.438 4.422 50 0 GIAAMO CSc1ccc(C[NH+]2CCN(Cc3ccccc3Br)CC2)cc1 ZINC000019832126 210299865 /nfs/dbraw/zinc/29/98/65/210299865.db2.gz QFKWMIQGRQIWSM-UHFFFAOYSA-N 1 1 391.378 4.489 50 0 GIAAMO CCc1ccc2c(c1)c(-c1ccc(Cl)cc1)c(C(=O)N1CC[NH+](C)CC1)n2C ZINC000019894352 210306357 /nfs/dbraw/zinc/30/63/57/210306357.db2.gz ABABHIKKRHDYEQ-UHFFFAOYSA-N 1 1 395.934 4.449 50 0 GIAAMO Fc1cccc(-c2c[nH]nc2[C@H]2CCC[N@@H+](Cc3cccc4c3OCO4)C2)c1 ZINC000019774464 210296715 /nfs/dbraw/zinc/29/67/15/210296715.db2.gz HQBSCYXQTZRBRR-INIZCTEOSA-N 1 1 379.435 4.324 50 0 GIAAMO FC(F)(F)c1cccc(N2CCN([C@H]3CCC[N@H+](C4CCCC4)C3)CC2)c1 ZINC000019774351 210296384 /nfs/dbraw/zinc/29/63/84/210296384.db2.gz AOGKAOUCTAPNMX-FQEVSTJZSA-N 1 1 381.486 4.234 50 0 GIAAMO COc1ccccc1N1CCN([C@@H]2CCC[N@@H+](CCCC3CCCC3)C2)CC1 ZINC000019773511 210296049 /nfs/dbraw/zinc/29/60/49/210296049.db2.gz SPDKJAHHONYPBM-JOCHJYFZSA-N 1 1 385.596 4.252 50 0 GIAAMO CCn1c2ccccc2c2cc(C[N@H+]3CCC[C@H](N4CCOCC4)C3)ccc21 ZINC000019607096 210275300 /nfs/dbraw/zinc/27/53/00/210275300.db2.gz FLMSCWWEWBLSPV-FQEVSTJZSA-N 1 1 377.532 4.111 50 0 GIAAMO Cc1ccccc1CC[N@@H+]1CCC[C@@H](CN(C)Cc2nc3ccccc3n2C)C1 ZINC000011820150 221128795 /nfs/dbraw/zinc/12/87/95/221128795.db2.gz XLMVBBFPNVATRS-NRFANRHFSA-N 1 1 390.575 4.268 50 0 GIAAMO CSCCC[N@H+]1CCCC[C@@H]1C(=O)Nc1ccc(Oc2ccccc2)nc1 ZINC000011821671 221129639 /nfs/dbraw/zinc/12/96/39/221129639.db2.gz WYWXUQUUNZGFMC-LJQANCHMSA-N 1 1 385.533 4.420 50 0 GIAAMO C[C@@H](c1ccc(F)cc1)N(C)C(=O)C[N@H+](C)Cc1ccccc1N1CCCC1 ZINC000011193198 221111990 /nfs/dbraw/zinc/11/19/90/221111990.db2.gz KTMFYXBPXRNXTK-SFHVURJKSA-N 1 1 383.511 4.077 50 0 GIAAMO C[C@@H](c1ccc(F)cc1)N(C)C(=O)C[N@@H+](C)Cc1ccccc1N1CCCC1 ZINC000011193198 221111994 /nfs/dbraw/zinc/11/19/94/221111994.db2.gz KTMFYXBPXRNXTK-SFHVURJKSA-N 1 1 383.511 4.077 50 0 GIAAMO COc1cc(C[N@H+](C)[C@H](C)C(=O)Nc2cc(C)ccc2C)ccc1OC(F)F ZINC000011219985 221112908 /nfs/dbraw/zinc/11/29/08/221112908.db2.gz BILHLLUMOZBSAC-OAHLLOKOSA-N 1 1 392.446 4.372 50 0 GIAAMO COc1cc(C[N@@H+](C)[C@H](C)C(=O)Nc2cc(C)ccc2C)ccc1OC(F)F ZINC000011219985 221112910 /nfs/dbraw/zinc/11/29/10/221112910.db2.gz BILHLLUMOZBSAC-OAHLLOKOSA-N 1 1 392.446 4.372 50 0 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388.427 4.092 50 0 GIAAMO C[N@@H+](Cc1cc(-c2ccccc2)no1)Cc1c[nH]nc1-c1ccc2c(c1)OCO2 ZINC000012433327 818159412 /nfs/dbraw/zinc/15/94/12/818159412.db2.gz RLHWKIBACBBDLN-UHFFFAOYSA-N 1 1 388.427 4.092 50 0 GIAAMO OC[C@]1(CCc2ccccc2)CCC[N@@H+](Cc2cccc(-n3cccn3)c2)C1 ZINC000012443276 818160250 /nfs/dbraw/zinc/16/02/50/818160250.db2.gz IJVDHCMNOXRKQS-DEOSSOPVSA-N 1 1 375.516 4.080 50 0 GIAAMO COc1ccc(OC)c(NC(=O)[C@H](C)Nc2ccc([NH+]3CCC(C)CC3)cc2)c1 ZINC000012550254 818166167 /nfs/dbraw/zinc/16/61/67/818166167.db2.gz LYLGXBISMKDCEM-KRWDZBQOSA-N 1 1 397.519 4.379 50 0 GIAAMO COc1ccc2cc(/C=C/C(=O)N3CC[N@H+](C)C[C@@H]3c3ccccc3)ccc2c1 ZINC000012740900 818179962 /nfs/dbraw/zinc/17/99/62/818179962.db2.gz HWRPXISUJGPOPH-GPOLZQFCSA-N 1 1 386.495 4.377 50 0 GIAAMO COc1ccc2cc(/C=C/C(=O)N3CC[N@@H+](C)C[C@@H]3c3ccccc3)ccc2c1 ZINC000012740900 818179965 /nfs/dbraw/zinc/17/99/65/818179965.db2.gz HWRPXISUJGPOPH-GPOLZQFCSA-N 1 1 386.495 4.377 50 0 GIAAMO Cc1ccc(-n2cccn2)c(C[N@H+]2CCC[C@](CO)(CCc3ccccc3)C2)c1 ZINC000015078325 818288356 /nfs/dbraw/zinc/28/83/56/818288356.db2.gz DEYGXKYVGMOGQL-VWLOTQADSA-N 1 1 389.543 4.388 50 0 GIAAMO Fc1cccc(F)c1-c1c[nH]nc1[C@H]1CCC[N@@H+](Cc2cccc3c2OCO3)C1 ZINC000019741904 818604018 /nfs/dbraw/zinc/60/40/18/818604018.db2.gz IPALFRPMCBMPSZ-AWEZNQCLSA-N 1 1 397.425 4.463 50 0 GIAAMO CCOc1ccc(-c2cc(C(=O)N3CC[NH+](CC)CC3)c3ccccc3n2)cc1 ZINC000058093307 823361444 /nfs/dbraw/zinc/36/14/44/823361444.db2.gz YCUDZHRLGJSLNH-UHFFFAOYSA-N 1 1 389.499 4.078 50 0 GIAAMO C[C@@H]1CCCC[N@H+]1CCCNC(=O)c1cc(-c2ccccn2)nc2ccccc21 ZINC000021934119 818756783 /nfs/dbraw/zinc/75/67/83/818756783.db2.gz SXOZNFRCUUGHGR-GOSISDBHSA-N 1 1 388.515 4.291 50 0 GIAAMO C[C@H](NC(=O)C(C)(C)C)[C@H](c1cccs1)N1CC[NH+](Cc2ccccc2)CC1 ZINC000022460318 818809748 /nfs/dbraw/zinc/80/97/48/818809748.db2.gz YLTYJVFHPDGBNI-GHTZIAJQSA-N 1 1 399.604 4.158 50 0 GIAAMO C[C@@H]1CCCN(C(=O)CC[N@@H+]2Cc3ccccc3O[C@H](c3ccccc3F)C2)C1 ZINC000023144508 818903824 /nfs/dbraw/zinc/90/38/24/818903824.db2.gz WOCICRNEBKPSHM-JPYJTQIMSA-N 1 1 396.506 4.410 50 0 GIAAMO Fc1ccc(N2CCN([C@@H]3CCC[N@H+](Cc4cccc(Cl)c4)C3)CC2)cc1 ZINC000023373577 818928991 /nfs/dbraw/zinc/92/89/91/818928991.db2.gz PWLXIEVAKOISEO-JOCHJYFZSA-N 1 1 387.930 4.266 50 0 GIAAMO Fc1ccc(N2CCN([C@@H]3CCC[N@@H+](Cc4cccc(Cl)c4)C3)CC2)cc1 ZINC000023373577 818928995 /nfs/dbraw/zinc/92/89/95/818928995.db2.gz PWLXIEVAKOISEO-JOCHJYFZSA-N 1 1 387.930 4.266 50 0 GIAAMO O=C(NCCOc1cccnc1)c1ccc([C@@H]2CCC[N@H+]2C2CCCC2)s1 ZINC000023540850 818957326 /nfs/dbraw/zinc/95/73/26/818957326.db2.gz IODZRDGMVILULJ-SFHVURJKSA-N 1 1 385.533 4.031 50 0 GIAAMO O=C(NCCc1nccs1)c1ccc([C@@H]2CCC[N@@H+]2Cc2ccoc2)s1 ZINC000023581749 818960650 /nfs/dbraw/zinc/96/06/50/818960650.db2.gz FSSZPRHZRSRNDJ-HNNXBMFYSA-N 1 1 387.530 4.107 50 0 GIAAMO O=C(NCCc1nccs1)c1ccc([C@@H]2CCC[N@H+]2Cc2ccoc2)s1 ZINC000023581749 818960655 /nfs/dbraw/zinc/96/06/55/818960655.db2.gz FSSZPRHZRSRNDJ-HNNXBMFYSA-N 1 1 387.530 4.107 50 0 GIAAMO COc1ccccc1[C@@H](CNC(=O)c1oc2cc(C)cc(C)c2c1C)[NH+](C)C ZINC000028232085 820319646 /nfs/dbraw/zinc/31/96/46/820319646.db2.gz WQOJZMCRMAZWMQ-GOSISDBHSA-N 1 1 380.488 4.399 50 0 GIAAMO Cc1nc2ccccc2nc1N1CC[NH+](Cc2ccc(C(F)(F)F)cc2)CC1 ZINC000030003805 820566108 /nfs/dbraw/zinc/56/61/08/820566108.db2.gz LQSVLGDAQOGLJY-UHFFFAOYSA-N 1 1 386.421 4.279 50 0 GIAAMO CC[NH+]1CCN(C(=O)C[C@@H](Cc2ccccc2)c2cn(C)c3ccccc23)CC1 ZINC000035768718 821066642 /nfs/dbraw/zinc/06/66/42/821066642.db2.gz KNZQGNSNFWSSCJ-OAQYLSRUSA-N 1 1 389.543 4.059 50 0 GIAAMO COc1ccccc1[C@@H](CNC(=O)c1sc(C(C)C)nc1C)[NH+]1CCCC1 ZINC000040093815 821135663 /nfs/dbraw/zinc/13/56/63/821135663.db2.gz VWTBPTRGXPOQBS-QGZVFWFLSA-N 1 1 387.549 4.150 50 0 GIAAMO Cc1[nH+]ccn1-c1ccc(NC(=O)c2ccc(NC(=O)OC(C)(C)C)cc2)cn1 ZINC000040118535 821141567 /nfs/dbraw/zinc/14/15/67/821141567.db2.gz MQAAEFOSMLAMSC-UHFFFAOYSA-N 1 1 393.447 4.175 50 0 GIAAMO COCc1ccc(C(=O)N[C@@H](C[N@H+]2CCc3ccccc3C2)C(C)(C)C)cc1 ZINC000040142752 821147952 /nfs/dbraw/zinc/14/79/52/821147952.db2.gz QQDLLQKWOLUEPM-QFIPXVFZSA-N 1 1 380.532 4.036 50 0 GIAAMO CC[NH+]1CCN(C(=O)c2cc(-c3ccc(Cl)cc3)nc3ccccc32)CC1 ZINC000055079186 822936706 /nfs/dbraw/zinc/93/67/06/822936706.db2.gz RWUKJCMUEGLWHJ-UHFFFAOYSA-N 1 1 379.891 4.333 50 0 GIAAMO Cc1c(C(=O)N2CC[C@H](C[N@H+](C)Cc3cccnc3)C2)sc2cccc(F)c12 ZINC000190612677 823591569 /nfs/dbraw/zinc/59/15/69/823591569.db2.gz QSHPAZRDWMBJDV-QGZVFWFLSA-N 1 1 397.519 4.338 50 0 GIAAMO O=C(c1ccccc1OC[C@H]1CCC[N@@H+](Cc2cccs2)C1)N1CCCC1 ZINC000169776576 823915605 /nfs/dbraw/zinc/91/56/05/823915605.db2.gz LDXCTWHQWWXNPA-SFHVURJKSA-N 1 1 384.545 4.275 50 0 GIAAMO COCCn1c(C)cnc1C[C@H]1CCC[N@@H+](Cc2ccc(C(F)(F)F)cc2)C1 ZINC000575317150 823953236 /nfs/dbraw/zinc/95/32/36/823953236.db2.gz CBORPPHIQDLEBG-GOSISDBHSA-N 1 1 395.469 4.311 50 0 GIAAMO CCCCCOc1ccc([C@@H](O)[C@H](C[NH+]2CCOCC2)c2ccccc2)cc1 ZINC000019314211 210239957 /nfs/dbraw/zinc/23/99/57/210239957.db2.gz TXAXLUUOZDHBRR-DNQXCXABSA-N 1 1 383.532 4.405 50 0 GIAAMO Cc1ccc(-c2nc(CC(=O)NCCC[N@H+](C)Cc3ccccc3)cs2)cc1 ZINC000018232723 210218100 /nfs/dbraw/zinc/21/81/00/210218100.db2.gz VOEAXRVHOHNOKH-UHFFFAOYSA-N 1 1 393.556 4.299 50 0 GIAAMO COc1ccc([C@@H]2CCC[N@@H+]2Cc2nc(-c3ccc(OC)c(OC)c3)no2)cc1 ZINC000015300611 210156964 /nfs/dbraw/zinc/15/69/64/210156964.db2.gz VJNBMNAUFAKJSW-SFHVURJKSA-N 1 1 395.459 4.100 50 0 GIAAMO COc1ccc([C@@H]2CCC[N@H+]2Cc2nc(-c3ccc(OC)c(OC)c3)no2)cc1 ZINC000015300611 210156970 /nfs/dbraw/zinc/15/69/70/210156970.db2.gz VJNBMNAUFAKJSW-SFHVURJKSA-N 1 1 395.459 4.100 50 0 GIAAMO Cc1oc(-c2ccc(Cl)cc2)nc1C[N@H+]1CCC[C@H](CN2CCCC2=O)C1 ZINC000015076247 210149403 /nfs/dbraw/zinc/14/94/03/210149403.db2.gz BNBIJSOBZIQMAX-INIZCTEOSA-N 1 1 387.911 4.138 50 0 GIAAMO CCN1CCC([N@H+]2CCC[C@H](C(=O)c3ccc4cc(OC)ccc4c3)C2)CC1 ZINC000015065295 210144559 /nfs/dbraw/zinc/14/45/59/210144559.db2.gz IRZBXVLLMGKHFG-NRFANRHFSA-N 1 1 380.532 4.227 50 0 GIAAMO Cc1nc(C)c(C[N@H+]2CC[C@]3(C2)CCCN(Cc2ccccc2F)C3)nc1C ZINC000015062906 210144668 /nfs/dbraw/zinc/14/46/68/210144668.db2.gz WZMMMDQZBLASAD-HSZRJFAPSA-N 1 1 382.527 4.029 50 0 GIAAMO Cc1nc(C)c(CN2CC[C@]3(C2)CCC[N@H+](Cc2ccccc2F)C3)nc1C ZINC000015062906 210144671 /nfs/dbraw/zinc/14/46/71/210144671.db2.gz WZMMMDQZBLASAD-HSZRJFAPSA-N 1 1 382.527 4.029 50 0 GIAAMO Cc1nc(C)c(CN2CC[C@]3(C2)CCC[N@@H+](Cc2ccccc2F)C3)nc1C ZINC000015062906 210144674 /nfs/dbraw/zinc/14/46/74/210144674.db2.gz WZMMMDQZBLASAD-HSZRJFAPSA-N 1 1 382.527 4.029 50 0 GIAAMO COc1cccc(CN2CCC[C@@]3(CC[N@@H+](Cc4ccc(C)o4)C3)C2)c1OC ZINC000014981487 210139217 /nfs/dbraw/zinc/13/92/17/210139217.db2.gz MKRQXDJUTDXHHF-HSZRJFAPSA-N 1 1 384.520 4.093 50 0 GIAAMO COc1cccc(C[N@@H+]2CCC[C@@]3(CCN(Cc4ccc(C)o4)C3)C2)c1OC ZINC000014981487 210139220 /nfs/dbraw/zinc/13/92/20/210139220.db2.gz MKRQXDJUTDXHHF-HSZRJFAPSA-N 1 1 384.520 4.093 50 0 GIAAMO COc1cccc(C[N@H+]2CCC[C@@]3(CCN(Cc4ccc(C)o4)C3)C2)c1OC ZINC000014981487 210139223 /nfs/dbraw/zinc/13/92/23/210139223.db2.gz MKRQXDJUTDXHHF-HSZRJFAPSA-N 1 1 384.520 4.093 50 0 GIAAMO c1cc2cnccc2c(C[N@H+]2CCC[C@@H](Nc3ccc4c(c3)OCCO4)C2)c1 ZINC000014978673 210138674 /nfs/dbraw/zinc/13/86/74/210138674.db2.gz LMNSCYQGANGAKT-HXUWFJFHSA-N 1 1 375.472 4.083 50 0 GIAAMO CC(C)(C)c1ccc(-n2ncc3c2CCC[C@@H]3[NH2+]Cc2ccc(CO)o2)cc1 ZINC000014977149 210137994 /nfs/dbraw/zinc/13/79/94/210137994.db2.gz STRAPKPARAINKW-NRFANRHFSA-N 1 1 379.504 4.422 50 0 GIAAMO COc1ccc(CN(C)C[C@H]2CCC[N@@H+](CCc3ccccc3C)C2)cc1OC ZINC000014974268 210137793 /nfs/dbraw/zinc/13/77/93/210137793.db2.gz RDXPVGPRONDETI-JOCHJYFZSA-N 1 1 396.575 4.399 50 0 GIAAMO COc1ccc(C[N@H+]2CCC[C@@H](CCC(=O)NCc3ccc(C)o3)C2)cc1C ZINC000014969651 210136420 /nfs/dbraw/zinc/13/64/20/210136420.db2.gz BINMVODZLYRQMC-IBGZPJMESA-N 1 1 384.520 4.214 50 0 GIAAMO CCOC(=O)N1CCC([N@H+]2CCC[C@H](C(=O)c3ccc(Cl)cc3C)C2)CC1 ZINC000014964256 210136062 /nfs/dbraw/zinc/13/60/62/210136062.db2.gz PFWLKNQUMOAGNM-INIZCTEOSA-N 1 1 392.927 4.164 50 0 GIAAMO Cc1cc(C(=O)N2CC[C@@]3(C2)CCC[N@H+](Cc2ccc(C(C)C)cc2)C3)no1 ZINC000014950458 210131413 /nfs/dbraw/zinc/13/14/13/210131413.db2.gz WSDKGHNQILZVSH-QHCPKHFHSA-N 1 1 381.520 4.235 50 0 GIAAMO COc1ccc(C(=O)[C@@H]2CCC[N@H+](C/C=C/c3ccccc3OC)C2)c(OC)c1 ZINC000013593341 210071457 /nfs/dbraw/zinc/07/14/57/210071457.db2.gz VDQDSCLUERDOST-MBNRZODZSA-N 1 1 395.499 4.321 50 0 GIAAMO COc1ccc(C(=O)[C@@H]2CCC[N@@H+](C/C=C/c3ccccc3OC)C2)c(OC)c1 ZINC000013593341 210071462 /nfs/dbraw/zinc/07/14/62/210071462.db2.gz VDQDSCLUERDOST-MBNRZODZSA-N 1 1 395.499 4.321 50 0 GIAAMO Fc1ccc([C@H]2C3=C([NH+]=C4N=CNN42)c2ccccc2O[C@H]3c2ccncc2)cc1 ZINC000013127666 210052030 /nfs/dbraw/zinc/05/20/30/210052030.db2.gz OLKLATOBUFSZII-VXKWHMMOSA-N 1 1 397.413 4.025 50 0 GIAAMO C[C@@H](C(=O)Nc1cc(Cl)ccc1Cl)[N@H+](C)Cc1ccc2c(c1)OCCO2 ZINC000012985265 210040300 /nfs/dbraw/zinc/04/03/00/210040300.db2.gz VIIHMBCUELFOBD-LBPRGKRZSA-N 1 1 395.286 4.224 50 0 GIAAMO C[C@@H](C(=O)Nc1cc(Cl)ccc1Cl)[N@@H+](C)Cc1ccc2c(c1)OCCO2 ZINC000012985265 210040307 /nfs/dbraw/zinc/04/03/07/210040307.db2.gz VIIHMBCUELFOBD-LBPRGKRZSA-N 1 1 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COc1ccc(C[N@@H+](C)[C@H](C)C(=O)Nc2ccc(Cl)cc2Cl)cc1OC ZINC000003570998 209447410 /nfs/dbraw/zinc/44/74/10/209447410.db2.gz MUDLDOUVLOHZIZ-GFCCVEGCSA-N 1 1 397.302 4.470 50 0 GIAAMO OC1(c2ccc(Br)cc2)CC[NH+](Cc2cc(F)ccc2F)CC1 ZINC000000757227 209263539 /nfs/dbraw/zinc/26/35/39/209263539.db2.gz PXOROAWNLLTEIH-UHFFFAOYSA-N 1 1 382.248 4.211 50 0 GIAAMO Cc1nnc([C@@H]2CCC[N@@H+](Cc3cc(Cl)ccc3OCc3cccnc3)C2)[nH]1 ZINC000095966313 209237381 /nfs/dbraw/zinc/23/73/81/209237381.db2.gz ODBAPXXASOCMBB-QGZVFWFLSA-N 1 1 397.910 4.120 50 0 GIAAMO CCc1cc2c(C[NH+]3CCN(c4cccc(Cl)c4)CC3)cc(=O)oc2cc1O ZINC000054147553 209212593 /nfs/dbraw/zinc/21/25/93/209212593.db2.gz QXIABOAPIVZMMZ-UHFFFAOYSA-N 1 1 398.890 4.037 50 0 GIAAMO C/C(=C\c1ccco1)C[N@@H+]1CCOc2ccc([C@H](O)c3cccnc3)cc2C1 ZINC000299772923 212035453 /nfs/dbraw/zinc/03/54/53/212035453.db2.gz DDVMDNQFHUBMFR-LVJXIGIWSA-N 1 1 376.456 4.054 50 0 GIAAMO C/C(=C\c1ccco1)C[N@H+]1CCOc2ccc([C@H](O)c3cccnc3)cc2C1 ZINC000299772923 212035457 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50 0 GIAAMO CC[N@@H+](Cc1ccc(C(=O)Nc2cccc(-c3n[nH]c(C)n3)c2)cc1)C(C)C ZINC000078726033 528775594 /nfs/dbraw/zinc/77/55/94/528775594.db2.gz GZGCXHSMZWANPE-UHFFFAOYSA-N 1 1 377.492 4.263 50 0 GIAAMO CC1(C)C[C@H](C[N@H+]2CCCC23CCN(c2cnc4ccccc4n2)CC3)CCO1 ZINC000072440207 535366916 /nfs/dbraw/zinc/36/69/16/535366916.db2.gz FSLDMZWBLLWAGP-LJQANCHMSA-N 1 1 394.563 4.270 50 0 GIAAMO C[C@@H](Sc1ccccc1)C(=O)NC1CC[NH+](Cc2ccc(F)c(F)c2)CC1 ZINC000047715552 570214569 /nfs/dbraw/zinc/21/45/69/570214569.db2.gz VKPMCJPZBJBJHU-OAHLLOKOSA-N 1 1 390.499 4.226 50 0 GIAAMO CC(C)c1ccc(CNc2nc3ccccc3n2CC[NH+]2CCOCC2)cc1 ZINC000005054365 570218468 /nfs/dbraw/zinc/21/84/68/570218468.db2.gz UWMDMQWURGGNGP-UHFFFAOYSA-N 1 1 378.520 4.104 50 0 GIAAMO Cc1ccc(NC(=O)C(C)C)cc1NC(=O)NCCC[N@@H+]1C[C@H](C)C[C@H](C)C1 ZINC000048255067 570224052 /nfs/dbraw/zinc/22/40/52/570224052.db2.gz BJNNEJNMKJNPJS-CALCHBBNSA-N 1 1 388.556 4.079 50 0 GIAAMO Cc1[nH+]ccn1-c1ccc(CNC(=O)C2=Cc3cc(Cl)ccc3OC2)cc1F ZINC000048324012 570235577 /nfs/dbraw/zinc/23/55/77/570235577.db2.gz IWMOTUSKHPAJBL-UHFFFAOYSA-N 1 1 397.837 4.065 50 0 GIAAMO Cc1ccc(OCC(=O)Nc2nc(C[NH+]3C[C@@H](C)C[C@H](C)C3)cs2)c(C)c1 ZINC000012886429 570284787 /nfs/dbraw/zinc/28/47/87/570284787.db2.gz RUGUBCGHAVHMCO-HOTGVXAUSA-N 1 1 387.549 4.255 50 0 GIAAMO O=C(NC[C@@H](c1ccc(Cl)cc1)[NH+]1CCCC1)c1cnc2c(c1)CCCC2 ZINC000215505084 570289450 /nfs/dbraw/zinc/28/94/50/570289450.db2.gz QJBKONWVNDVGTG-NRFANRHFSA-N 1 1 383.923 4.181 50 0 GIAAMO CC(C)CNC(=O)c1cccc(C[NH+]2CCN(c3cccc(Cl)c3)CC2)c1 ZINC000034668637 570293105 /nfs/dbraw/zinc/29/31/05/570293105.db2.gz VNSQJYIQSNOTPY-UHFFFAOYSA-N 1 1 385.939 4.048 50 0 GIAAMO Cc1nc(-c2ccccc2F)sc1C(=O)NC[C@@H]1CCC[N@H+]2CCCC[C@H]12 ZINC000012296612 570293961 /nfs/dbraw/zinc/29/39/61/570293961.db2.gz YLTOHZVDYJFKAP-MAUKXSAKSA-N 1 1 387.524 4.252 50 0 GIAAMO COc1ccc(NC(=O)[C@@H](C)[N@@H+](C)Cc2ccc3cc(OC)ccc3c2)cc1 ZINC000012921300 570294478 /nfs/dbraw/zinc/29/44/78/570294478.db2.gz JOXKEYMFUDVADS-MRXNPFEDSA-N 1 1 378.472 4.316 50 0 GIAAMO CC(C)=CC(=O)Nc1ccc(N2CCC[N@@H+](Cc3ccccc3Cl)CC2)nc1 ZINC000034682001 570300117 /nfs/dbraw/zinc/30/01/17/570300117.db2.gz CNVAXVKQJOFSFP-UHFFFAOYSA-N 1 1 398.938 4.352 50 0 GIAAMO Cc1cccc(OCC(=O)Nc2nc(C[NH+]3C[C@H](C)C[C@@H](C)C3)cs2)c1C ZINC000022293003 570312533 /nfs/dbraw/zinc/31/25/33/570312533.db2.gz XPXIYEJCIBFGGQ-HUUCEWRRSA-N 1 1 387.549 4.255 50 0 GIAAMO COCCNC(=O)[C@H]1CC[C@H](c2ccccc2)[N@@H+](Cc2cccc(Cl)c2)C1 ZINC000034739879 570327326 /nfs/dbraw/zinc/32/73/26/570327326.db2.gz DTICTTJHWJCJNO-PZJWPPBQSA-N 1 1 386.923 4.056 50 0 GIAAMO CC(=O)Nc1ccc(NC(=O)[C@H]2CCC[N@@H+](Cc3ccccc3)C2)cc1Cl ZINC000050028027 570328576 /nfs/dbraw/zinc/32/85/76/570328576.db2.gz XRYBTGAGLPNSOK-KRWDZBQOSA-N 1 1 385.895 4.149 50 0 GIAAMO Cc1cccc(CN2CC[N@H+](Cc3ccc(C4CCCC4)s3)C[C@@H]2CCO)n1 ZINC000022853467 570331428 /nfs/dbraw/zinc/33/14/28/570331428.db2.gz KILHLMREARDCGL-NRFANRHFSA-N 1 1 399.604 4.178 50 0 GIAAMO Cc1cccc(CN2CC[N@@H+](Cc3ccc(C4CCCC4)s3)C[C@@H]2CCO)n1 ZINC000022853467 570331429 /nfs/dbraw/zinc/33/14/29/570331429.db2.gz KILHLMREARDCGL-NRFANRHFSA-N 1 1 399.604 4.178 50 0 GIAAMO C[C@@H]1C[C@H](C)C[N@@H+](Cc2csc(NC(=O)c3cnn(-c4ccccc4)c3)n2)C1 ZINC000022295433 570332903 /nfs/dbraw/zinc/33/29/03/570332903.db2.gz DPSBJBIVVFTDOI-IYBDPMFKSA-N 1 1 395.532 4.059 50 0 GIAAMO C[C@@H]1C[C@H](C)C[N@H+](Cc2csc(NC(=O)c3cnn(-c4ccccc4)c3)n2)C1 ZINC000022295433 570332905 /nfs/dbraw/zinc/33/29/05/570332905.db2.gz DPSBJBIVVFTDOI-IYBDPMFKSA-N 1 1 395.532 4.059 50 0 GIAAMO CC1(C)C[C@@]2(CCCN(CC[N@H+]3CCC[C@@]4(CCOC(C)(C)C4)C3)C2)CCO1 ZINC000022924282 570336210 /nfs/dbraw/zinc/33/62/10/570336210.db2.gz VOSHMDSOMREFNT-PSWAGMNNSA-N 1 1 392.628 4.329 50 0 GIAAMO CC1(C)C[C@@]2(CCC[N@@H+](CCN3CCC[C@@]4(CCOC(C)(C)C4)C3)C2)CCO1 ZINC000022924282 570336213 /nfs/dbraw/zinc/33/62/13/570336213.db2.gz VOSHMDSOMREFNT-PSWAGMNNSA-N 1 1 392.628 4.329 50 0 GIAAMO CC1(C)C[C@@]2(CCC[N@H+](CCN3CCC[C@@]4(CCOC(C)(C)C4)C3)C2)CCO1 ZINC000022924282 570336214 /nfs/dbraw/zinc/33/62/14/570336214.db2.gz VOSHMDSOMREFNT-PSWAGMNNSA-N 1 1 392.628 4.329 50 0 GIAAMO CCC(=O)N[C@H](C)[C@H]1c2cc(OC)c(OC)cc2CC[N@H+]1Cc1cccc(C)c1 ZINC000034855637 570341631 /nfs/dbraw/zinc/34/16/31/570341631.db2.gz YZJIKPQOFXTLCO-OSPHWJPCSA-N 1 1 396.531 4.026 50 0 GIAAMO CCC(=O)N[C@H](C)[C@H]1c2cc(OC)c(OC)cc2CC[N@@H+]1Cc1cccc(C)c1 ZINC000034855637 570341633 /nfs/dbraw/zinc/34/16/33/570341633.db2.gz YZJIKPQOFXTLCO-OSPHWJPCSA-N 1 1 396.531 4.026 50 0 GIAAMO CCC[C@H](O)C[N@@H+](CCOC)Cc1cccn1Cc1ccc(C(C)(C)C)cc1 ZINC000004907716 570361474 /nfs/dbraw/zinc/36/14/74/570361474.db2.gz WGPRHHBJYIOBHA-QHCPKHFHSA-N 1 1 386.580 4.443 50 0 GIAAMO Cc1nn(-c2ccccc2)c(C)c1NC(=O)C[N@@H+](Cc1ccccc1)C(C)C ZINC000010930394 570372683 /nfs/dbraw/zinc/37/26/83/570372683.db2.gz BONFMOYEPHXOGE-UHFFFAOYSA-N 1 1 376.504 4.338 50 0 GIAAMO COc1cc2c(cc1OC)[C@H](c1cccs1)[N@@H+](C[C@H](O)c1ccccc1)CC2 ZINC000023908563 570375066 /nfs/dbraw/zinc/37/50/66/570375066.db2.gz FJFFCYJYGDSGJR-WMZHIEFXSA-N 1 1 395.524 4.446 50 0 GIAAMO CCOC(=O)c1c(NC(=O)[C@@H](C)n2cc(C)[nH+]c2C)sc2c1CC[C@@H](C)C2 ZINC000024762325 570392243 /nfs/dbraw/zinc/39/22/43/570392243.db2.gz FSXMNEHSJGMBFW-DGCLKSJQSA-N 1 1 389.521 4.063 50 0 GIAAMO CC(=O)c1ccc(C(=O)NC[C@H](c2cccs2)[NH+]2CCC(C)CC2)s1 ZINC000024928467 570398825 /nfs/dbraw/zinc/39/88/25/570398825.db2.gz HJDAZSQDUGVNQF-OAHLLOKOSA-N 1 1 376.547 4.215 50 0 GIAAMO Brc1ccc(CN2CCC([N@H+]3CCc4ccccc4C3)CC2)cc1 ZINC000004744579 570401364 /nfs/dbraw/zinc/40/13/64/570401364.db2.gz RGEKVKDFAMKIKN-UHFFFAOYSA-N 1 1 385.349 4.472 50 0 GIAAMO C[N@@H+]1CCN(C(=O)c2ccc(C3SCCS3)cc2)[C@@H](c2ccccc2)C1 ZINC000024983515 570401494 /nfs/dbraw/zinc/40/14/94/570401494.db2.gz NIKQPSRTJVOUBK-LJQANCHMSA-N 1 1 384.570 4.294 50 0 GIAAMO C[N@H+]1CCN(C(=O)c2ccc(C3SCCS3)cc2)[C@@H](c2ccccc2)C1 ZINC000024983515 570401499 /nfs/dbraw/zinc/40/14/99/570401499.db2.gz NIKQPSRTJVOUBK-LJQANCHMSA-N 1 1 384.570 4.294 50 0 GIAAMO O=C(C[NH+]1CCC(c2nc3cc(Cl)ccc3s2)CC1)NCc1ccco1 ZINC000025033340 570403244 /nfs/dbraw/zinc/40/32/44/570403244.db2.gz JTMHYYZSMHWHCB-UHFFFAOYSA-N 1 1 389.908 4.039 50 0 GIAAMO Cc1cc(C)c2nc(C)cc(C(=O)NCCC[N@H+](C)Cc3ccccc3)c2c1 ZINC000033252879 570403312 /nfs/dbraw/zinc/40/33/12/570403312.db2.gz HEMKLNFRGOADNW-UHFFFAOYSA-N 1 1 375.516 4.412 50 0 GIAAMO Cc1ccc2c(c1)[C@H]1C[N@@H+](C)CC[C@@H]1N2C(=O)c1nc(Cl)ccc1Cl ZINC000121167715 570403627 /nfs/dbraw/zinc/40/36/27/570403627.db2.gz OXBFFPRFHOVLFY-CJNGLKHVSA-N 1 1 376.287 4.145 50 0 GIAAMO CC[C@@H](C)[N@@H+](CCNC(=O)c1cc(C)nn1-c1ccccc1)C1CCCCC1 ZINC000005058700 570408364 /nfs/dbraw/zinc/40/83/64/570408364.db2.gz KSWYGEQSCTYHHF-LJQANCHMSA-N 1 1 382.552 4.344 50 0 GIAAMO Brc1cc(C[NH2+][C@@H](c2ccccc2)c2ccccn2)cc2c1OCO2 ZINC000025363710 570412251 /nfs/dbraw/zinc/41/22/51/570412251.db2.gz JVEOABRITXKGNF-IBGZPJMESA-N 1 1 397.272 4.452 50 0 GIAAMO C[C@@H]1CCC[N@@H+](CC2CCN(S(=O)(=O)c3ccc(C(C)(C)C)cc3)CC2)C1 ZINC000032951970 570428387 /nfs/dbraw/zinc/42/83/87/570428387.db2.gz WUKSIMROLFDTMM-GOSISDBHSA-N 1 1 392.609 4.117 50 0 GIAAMO O=C(NC[C@H](c1ccco1)[NH+]1CCCC1)c1cc(-c2ccc(Cl)cc2)on1 ZINC000027336197 570433417 /nfs/dbraw/zinc/43/34/17/570433417.db2.gz AUFLXRAKGNWGON-QGZVFWFLSA-N 1 1 385.851 4.155 50 0 GIAAMO Cc1ccc2oc(C(=O)NC[C@@H](c3cccs3)[NH+]3CCCCC3)cc(=O)c2c1 ZINC000028290157 570455477 /nfs/dbraw/zinc/45/54/77/570455477.db2.gz WLMDEATWEUQRAW-KRWDZBQOSA-N 1 1 396.512 4.120 50 0 GIAAMO Cc1ccc2c(=O)cc(C(=O)NC[C@@H](c3cccs3)[NH+]3CCCCC3)oc2c1 ZINC000028291683 570456454 /nfs/dbraw/zinc/45/64/54/570456454.db2.gz UJFIDQRFKLRIIS-KRWDZBQOSA-N 1 1 396.512 4.120 50 0 GIAAMO FC(F)(F)c1ccc(C[NH+]2CCN(c3ncnc4ccsc43)CC2)cc1 ZINC000028620123 570462114 /nfs/dbraw/zinc/46/21/14/570462114.db2.gz VTQNMTINVJMKDP-UHFFFAOYSA-N 1 1 378.423 4.032 50 0 GIAAMO Cc1nc2ccccc2nc1C[NH+]1CCC(C(=O)c2cc(F)ccc2F)CC1 ZINC000047797064 570503275 /nfs/dbraw/zinc/50/32/75/570503275.db2.gz IIASCOIWFUHAHU-UHFFFAOYSA-N 1 1 381.426 4.311 50 0 GIAAMO Cc1ccc2occ(CN3CC[N@H+]4CCC[C@H]4[C@@H]3C3CCCCC3)c(=O)c2c1 ZINC000584904398 570504941 /nfs/dbraw/zinc/50/49/41/570504941.db2.gz CQCLHXBXXLTALA-GMAHTHKFSA-N 1 1 380.532 4.330 50 0 GIAAMO C[C@H]1CCCC[N@H+]1CCNC(=O)Cn1c(-c2cccs2)cc2cc(F)ccc21 ZINC000064657592 570512242 /nfs/dbraw/zinc/51/22/42/570512242.db2.gz SCTMHSQBXAOUSL-INIZCTEOSA-N 1 1 399.535 4.500 50 0 GIAAMO O=C(c1ccccc1F)N(C[C@H]1CC[N@@H+](Cc2ccccc2)C1)CC(F)(F)F ZINC000072304631 570515535 /nfs/dbraw/zinc/51/55/35/570515535.db2.gz FNXUXNWKVHFTRC-KRWDZBQOSA-N 1 1 394.412 4.352 50 0 GIAAMO Cc1cc(N2CCCC2)ccc1NC(=O)N1CCC[N@@H+](Cc2ccccc2)CC1 ZINC000043496307 570521360 /nfs/dbraw/zinc/52/13/60/570521360.db2.gz QXAHEIRFBNJTAH-UHFFFAOYSA-N 1 1 392.547 4.335 50 0 GIAAMO Cc1cccnc1NC(=O)[C@@H]1CCC[N@@H+](Cc2sccc2Br)C1 ZINC000072308201 570526553 /nfs/dbraw/zinc/52/65/53/570526553.db2.gz TZIHFAKMBLWSMZ-CYBMUJFWSA-N 1 1 394.338 4.065 50 0 GIAAMO C[NH2+]CCCNCc1ccc(OCc2ccc(Cl)cc2Cl)c(OC)c1 ZINC000008377052 570529982 /nfs/dbraw/zinc/52/99/82/570529982.db2.gz GYQHISHDWWKFGP-UHFFFAOYSA-N 1 1 383.319 4.280 50 0 GIAAMO COc1ccc(C[N@@H+](Cc2ccccc2F)C[C@H](O)COc2ccccc2)cc1 ZINC000036095338 570534270 /nfs/dbraw/zinc/53/42/70/570534270.db2.gz WVGNJFDVMPBAMM-NRFANRHFSA-N 1 1 395.474 4.276 50 0 GIAAMO COc1ccc(C[N@H+](Cc2ccccc2F)C[C@H](O)COc2ccccc2)cc1 ZINC000036095338 570534272 /nfs/dbraw/zinc/53/42/72/570534272.db2.gz WVGNJFDVMPBAMM-NRFANRHFSA-N 1 1 395.474 4.276 50 0 GIAAMO Cc1ccc(C[N@H+](Cc2ccc(F)cc2)C[C@@H](O)COCc2ccccc2)o1 ZINC000036097910 570535972 /nfs/dbraw/zinc/53/59/72/570535972.db2.gz ODXOMQKRKLAHPG-JOCHJYFZSA-N 1 1 383.463 4.307 50 0 GIAAMO COCCC[N@H+](Cc1cc(C)ccc1C)C[C@H](O)COc1ccc(Cl)cc1 ZINC000036097410 570536106 /nfs/dbraw/zinc/53/61/06/570536106.db2.gz WMQDUBRVBGZXGU-NRFANRHFSA-N 1 1 391.939 4.235 50 0 GIAAMO COc1cccc(C[N@H+](Cc2ccc(F)cc2)C[C@@H](O)Cc2ccccc2)c1 ZINC000036098532 570536581 /nfs/dbraw/zinc/53/65/81/570536581.db2.gz JZGKFMPZWCLOGW-QHCPKHFHSA-N 1 1 379.475 4.440 50 0 GIAAMO COc1cccc(C[N@H+](Cc2ccccc2)C[C@H](O)Cc2ccccc2)c1OC ZINC000036103641 570540425 /nfs/dbraw/zinc/54/04/25/570540425.db2.gz VAKUMLUWPVPKCW-HSZRJFAPSA-N 1 1 391.511 4.310 50 0 GIAAMO CCOc1ccc2ccccc2c1[C@@H]1Nc2sc3c(c2C(=O)N1)CC[N@@H+](C)C3 ZINC000005274698 570547820 /nfs/dbraw/zinc/54/78/20/570547820.db2.gz OSMCXWYVGORVMU-FQEVSTJZSA-N 1 1 393.512 4.142 50 0 GIAAMO CCOc1ccc2ccccc2c1[C@@H]1Nc2sc3c(c2C(=O)N1)CC[N@H+](C)C3 ZINC000005274698 570547823 /nfs/dbraw/zinc/54/78/23/570547823.db2.gz OSMCXWYVGORVMU-FQEVSTJZSA-N 1 1 393.512 4.142 50 0 GIAAMO C[C@H]1CCC[N@@H+](Cc2ccccc2CNC(=O)Cc2c[nH]c3ccccc23)C1 ZINC000040107100 570556093 /nfs/dbraw/zinc/55/60/93/570556093.db2.gz MDUBIFMDGGDRLQ-SFHVURJKSA-N 1 1 375.516 4.259 50 0 GIAAMO COc1cccc(NC(=O)N2CCC([N@@H+](C)Cc3cccc(Cl)c3)CC2)c1 ZINC000006750539 570568379 /nfs/dbraw/zinc/56/83/79/570568379.db2.gz NSAIJZNBRYNRQA-UHFFFAOYSA-N 1 1 387.911 4.477 50 0 GIAAMO CCN(CC(=O)Nc1c(Cl)cc(Cl)cc1Cl)C[C@H]1CCC[N@H+]1CC ZINC000225410029 570571177 /nfs/dbraw/zinc/57/11/77/570571177.db2.gz VAOZQEDKEKCRPL-CYBMUJFWSA-N 1 1 392.758 4.392 50 0 GIAAMO OC[C@@]1(Cc2ccccc2)CCC[N@@H+](Cc2c[nH]nc2-c2ccc(F)cc2)C1 ZINC000011664132 570577871 /nfs/dbraw/zinc/57/78/71/570577871.db2.gz JHZTVMGSGHAQGP-HSZRJFAPSA-N 1 1 379.479 4.033 50 0 GIAAMO COc1ccc(C[N@H+]2CCC[C@H](Nc3ccc(F)cc3)C2)cc1Cn1cccn1 ZINC000012051070 570600853 /nfs/dbraw/zinc/60/08/53/570600853.db2.gz UOXLQZMSMJBDBF-QFIPXVFZSA-N 1 1 394.494 4.156 50 0 GIAAMO COc1cccc(CNCC[NH+](C)C)c1OCc1c(Cl)cccc1Cl ZINC000040719465 570604271 /nfs/dbraw/zinc/60/42/71/570604271.db2.gz ZULLCNGUTMABTJ-UHFFFAOYSA-N 1 1 383.319 4.232 50 0 GIAAMO O=c1c2ccc(C(F)(F)F)cc2ncn1CC[C@@H]1CCC[N@H+]2CCCC[C@H]12 ZINC000042460234 570619998 /nfs/dbraw/zinc/61/99/98/570619998.db2.gz DJANTXHIBWKGJL-KBXCAEBGSA-N 1 1 379.426 4.070 50 0 GIAAMO Cc1oc(-c2ccccc2Cl)nc1C[N@H+]1CCC[C@H](CN2CCCC2=O)C1 ZINC000012194113 570622739 /nfs/dbraw/zinc/62/27/39/570622739.db2.gz IXLQCDDBXXHSRH-INIZCTEOSA-N 1 1 387.911 4.138 50 0 GIAAMO O=C(NC[C@@H]1CCC[N@H+](Cc2ccc3cccc(F)c3n2)C1)c1cccs1 ZINC000012208831 570626367 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0 GIAAMO CCn1cc(CN(Cc2cccnc2)C[C@H]2CCC[N@H+](C3CCCCC3)C2)cn1 ZINC000012308248 570640153 /nfs/dbraw/zinc/64/01/53/570640153.db2.gz YXSPXTYIPQIFOR-JOCHJYFZSA-N 1 1 395.595 4.345 50 0 GIAAMO O=C(Nc1cccc(-c2ccc(F)cc2)c1)[C@@H]1CCC[N@@H+]1Cc1cccnc1 ZINC000012320833 570642904 /nfs/dbraw/zinc/64/29/04/570642904.db2.gz MUHOKQUFNVFFIV-QFIPXVFZSA-N 1 1 375.447 4.491 50 0 GIAAMO O=C(Nc1cccc(-c2ccc(F)cc2)c1)[C@@H]1CCC[N@H+]1Cc1cccnc1 ZINC000012320833 570642907 /nfs/dbraw/zinc/64/29/07/570642907.db2.gz MUHOKQUFNVFFIV-QFIPXVFZSA-N 1 1 375.447 4.491 50 0 GIAAMO Cc1ccccc1-c1nn(-c2ccc(F)cc2F)cc1C[N@H+]1CCC[C@H](CO)C1 ZINC000012373350 570648614 /nfs/dbraw/zinc/64/86/14/570648614.db2.gz YCCDWLJKIXEGQG-KRWDZBQOSA-N 1 1 397.469 4.330 50 0 GIAAMO CCc1ccc2oc(=O)cc(C[NH+]3CCN(c4cc(C)ccc4C)CC3)c2c1 ZINC000012413487 570656769 /nfs/dbraw/zinc/65/67/69/570656769.db2.gz RMIBWXDHMWFOQP-UHFFFAOYSA-N 1 1 376.500 4.294 50 0 biogenic,in-vitro GIAAMO CCOC(=O)[C@]1(CCCc2ccccc2)CCC[N@H+](Cc2nccn2CC)C1 ZINC000012434293 570661784 /nfs/dbraw/zinc/66/17/84/570661784.db2.gz BOGOELHBVSOXCH-HSZRJFAPSA-N 1 1 383.536 4.071 50 0 GIAAMO CCOC(=O)[C@]1(CCCc2ccccc2)CCC[N@@H+](Cc2nccn2CC)C1 ZINC000012434293 570661786 /nfs/dbraw/zinc/66/17/86/570661786.db2.gz BOGOELHBVSOXCH-HSZRJFAPSA-N 1 1 383.536 4.071 50 0 GIAAMO Cc1cccc(C)c1NC(=O)CNC(=O)[C@@H](C)[N@@H+](C)Cc1ccc(C(C)C)cc1 ZINC000006876273 570666036 /nfs/dbraw/zinc/66/60/36/570666036.db2.gz VIZVGYLYMOPEBE-LJQANCHMSA-N 1 1 395.547 4.002 50 0 GIAAMO Cc1cccc(C)c1NC(=O)CNC(=O)[C@@H](C)[N@H+](C)Cc1ccc(C(C)C)cc1 ZINC000006876273 570666039 /nfs/dbraw/zinc/66/60/39/570666039.db2.gz VIZVGYLYMOPEBE-LJQANCHMSA-N 1 1 395.547 4.002 50 0 GIAAMO COc1ccc(F)c(C[N@H+]2CCC[C@@]3(CCN(C(=O)c4ccsc4)C3)C2)c1 ZINC000012454707 570668613 /nfs/dbraw/zinc/66/86/13/570668613.db2.gz WGBVHGWFBFFGIF-OAQYLSRUSA-N 1 1 388.508 4.024 50 0 GIAAMO CCOc1ccccc1-c1nc(C[N@H+](C)C[C@@H]2Cc3ccccc3O2)c(C)o1 ZINC000012455444 570669244 /nfs/dbraw/zinc/66/92/44/570669244.db2.gz CAAZUWJWKQKIKI-SFHVURJKSA-N 1 1 378.472 4.484 50 0 GIAAMO CCOc1ccccc1-c1nc(C[N@@H+](C)C[C@@H]2Cc3ccccc3O2)c(C)o1 ZINC000012455444 570669246 /nfs/dbraw/zinc/66/92/46/570669246.db2.gz CAAZUWJWKQKIKI-SFHVURJKSA-N 1 1 378.472 4.484 50 0 GIAAMO C[C@@H]1C[NH+](C[C@H](O)COc2ccc(C(C)(C)C)cc2C(C)(C)C)C[C@@H](C)O1 ZINC000012421488 570672853 /nfs/dbraw/zinc/67/28/53/570672853.db2.gz PIGXXTGSOQVEQT-LMMKCTJWSA-N 1 1 377.569 4.131 50 0 GIAAMO COc1ccc2c(c1)C=C(C[N@H+]1CCC[C@](CO)(CCc3ccccc3)C1)CO2 ZINC000012471231 570672896 /nfs/dbraw/zinc/67/28/96/570672896.db2.gz KOZKNWPFUUCSOB-VWLOTQADSA-N 1 1 393.527 4.178 50 0 GIAAMO CSc1ccccc1C(=O)[C@H]1CCC[N@@H+](Cc2cccc3nccnc23)C1 ZINC000055042404 570679994 /nfs/dbraw/zinc/67/99/94/570679994.db2.gz LOTOJLVEIKZPCB-KRWDZBQOSA-N 1 1 377.513 4.447 50 0 GIAAMO Cc1ncc(C[N@H+]2CCC[C@@H](CNC(=O)c3cccc(C(F)(F)F)c3)C2)s1 ZINC000012572295 570681255 /nfs/dbraw/zinc/68/12/55/570681255.db2.gz BVSDGOHFFKJSAT-AWEZNQCLSA-N 1 1 397.466 4.112 50 0 GIAAMO COc1cc(C[N@H+]2CCC[C@@](CO)(Cc3cccc(Cl)c3)C2)cc(OC)c1 ZINC000012576515 570682417 /nfs/dbraw/zinc/68/24/17/570682417.db2.gz ZOEUDFXNAGZEHO-JOCHJYFZSA-N 1 1 389.923 4.174 50 0 GIAAMO Cc1cccn2c(C[NH2+]Cc3ccccc3Cl)c(C(=O)N3CCCCC3)nc12 ZINC000055154141 570685041 /nfs/dbraw/zinc/68/50/41/570685041.db2.gz VSFBWVYNAPDAAX-UHFFFAOYSA-N 1 1 396.922 4.212 50 0 GIAAMO COc1ccc([C@H]2[C@@H]3CCCC[C@@]3(O)CC[N@H+]2CC(=O)Nc2ccccc2)cc1 ZINC000016043235 570686433 /nfs/dbraw/zinc/68/64/33/570686433.db2.gz XPIMRLYLQKZKIJ-OEMFJLHTSA-N 1 1 394.515 4.002 50 0 GIAAMO C[N@H+](Cc1c[nH]nc1-c1cc2ccccc2o1)C[C@H]1COc2ccccc2O1 ZINC000055307296 570690729 /nfs/dbraw/zinc/69/07/29/570690729.db2.gz NFHOIWARLXPZPD-KRWDZBQOSA-N 1 1 375.428 4.095 50 0 GIAAMO CCOc1ccc(C[N@H+]2CCC[C@@H](C(=O)c3cccc(Cl)c3)C2)cc1CO ZINC000012701507 570698965 /nfs/dbraw/zinc/69/89/65/570698965.db2.gz FBKLNFICPHVEBL-GOSISDBHSA-N 1 1 387.907 4.326 50 0 GIAAMO O=C(Nc1ccc(N2CC[NH+](Cc3ccccc3F)CC2)cc1)c1cccs1 ZINC000057330569 570701822 /nfs/dbraw/zinc/70/18/22/570701822.db2.gz DOTVPTVJQWAJJM-UHFFFAOYSA-N 1 1 395.503 4.462 50 0 GIAAMO Cc1ccccc1-c1nn(-c2ccc(F)cc2F)cc1C[N@H+](C)[C@@H]1CCOC1 ZINC000012716670 570704994 /nfs/dbraw/zinc/70/49/94/570704994.db2.gz NRPVBZIIESAZJD-GOSISDBHSA-N 1 1 383.442 4.347 50 0 GIAAMO c1ccc(Cn2nc(C[NH2+]Cc3ccc4c(c3)OCO4)c(-c3ccccc3)n2)cc1 ZINC000248055574 570720233 /nfs/dbraw/zinc/72/02/33/570720233.db2.gz OLHSJZVFSHHROO-UHFFFAOYSA-N 1 1 398.466 4.012 50 0 GIAAMO CC(C)n1c(C[N@H+]2CCC[C@H](C(=O)NCc3ccccc3)C2)nc2ccccc21 ZINC000248140472 570721091 /nfs/dbraw/zinc/72/10/91/570721091.db2.gz BQDGSRFPDRETLJ-FQEVSTJZSA-N 1 1 390.531 4.146 50 0 GIAAMO Fc1ccc(OCc2noc(C[N@H+]3CCC[C@H]3CCc3ccccc3)n2)cc1 ZINC000058277676 570724169 /nfs/dbraw/zinc/72/41/69/570724169.db2.gz HVYZZCYLVZREDZ-IBGZPJMESA-N 1 1 381.451 4.385 50 0 GIAAMO CC[N@@H+](C)Cc1cccc(CNC(=O)CCc2ncc(-c3ccccc3)o2)c1 ZINC000058292498 570725003 /nfs/dbraw/zinc/72/50/03/570725003.db2.gz YPRYVJOSEDXZTM-UHFFFAOYSA-N 1 1 377.488 4.042 50 0 GIAAMO COc1ccc(C)cc1NC(=O)CC[N@H+]1CCCC[C@H]1CCc1ccccn1 ZINC000252478829 570727668 /nfs/dbraw/zinc/72/76/68/570727668.db2.gz AVPWJGGNAPXBLE-FQEVSTJZSA-N 1 1 381.520 4.215 50 0 GIAAMO Cn1c(C[NH+]2CCC(C(=O)Nc3cccc(Cl)c3)CC2)nc2ccccc21 ZINC000253612883 570735693 /nfs/dbraw/zinc/73/56/93/570735693.db2.gz CSILZNSTSGHTKV-UHFFFAOYSA-N 1 1 382.895 4.077 50 0 GIAAMO Cc1cc(C(=O)N2CC[NH+](Cc3ccccc3)CC2)c(C)n1Cc1cccs1 ZINC000012458441 570736526 /nfs/dbraw/zinc/73/65/26/570736526.db2.gz XFMOAUMEBSTVDK-UHFFFAOYSA-N 1 1 393.556 4.173 50 0 GIAAMO CCOC(=O)c1c2c(sc1NC(=O)C[N@@H+](C)C1CCCCC1)C[C@H](C)CC2 ZINC000000955169 570737476 /nfs/dbraw/zinc/73/74/76/570737476.db2.gz JDMHAFMFARYOAH-CQSZACIVSA-N 1 1 392.565 4.253 50 0 GIAAMO O[C@@H](COc1ccc(F)cc1)C[N@@H+](Cc1ccccc1C(F)(F)F)C1CC1 ZINC000059387300 570738216 /nfs/dbraw/zinc/73/82/16/570738216.db2.gz KYHFRBXYYCJPJM-QGZVFWFLSA-N 1 1 383.385 4.249 50 0 GIAAMO COc1cc(C[N@@H+](Cc2c(C)nn(C)c2C)C(C)C)cc(Cl)c1OC(C)=O ZINC000063885129 570752764 /nfs/dbraw/zinc/75/27/64/570752764.db2.gz DKQAKTVKCVAPSU-UHFFFAOYSA-N 1 1 393.915 4.035 50 0 GIAAMO CCc1ccc(-c2c(-c3ccccc3)ncn2CC[N@H+]2CCC[C@@H](CO)C2)o1 ZINC000065395625 570765556 /nfs/dbraw/zinc/76/55/56/570765556.db2.gz JETLAKNJPUGQOR-GOSISDBHSA-N 1 1 379.504 4.077 50 0 GIAAMO COc1cccc(C[N@@H+]2CCCn3nc(-c4ccc(F)cc4)cc3C2)c1OC ZINC000065270424 570773229 /nfs/dbraw/zinc/77/32/29/570773229.db2.gz JGSJJJYHWGWINQ-UHFFFAOYSA-N 1 1 381.451 4.112 50 0 GIAAMO COc1cccc(C[N@H+]2CCCn3nc(-c4ccc(F)cc4)cc3C2)c1OC ZINC000065270424 570773231 /nfs/dbraw/zinc/77/32/31/570773231.db2.gz JGSJJJYHWGWINQ-UHFFFAOYSA-N 1 1 381.451 4.112 50 0 GIAAMO Cc1csc2nc(C[N@@H+](Cc3ccc(C(F)(F)F)cc3)C3CC3)cc(=O)n12 ZINC000032777451 570799954 /nfs/dbraw/zinc/79/99/54/570799954.db2.gz CKLYNVJAVFABMU-UHFFFAOYSA-N 1 1 393.434 4.248 50 0 GIAAMO Cc1csc([C@H]2CCCCN2C(=O)[C@H]2CCC[N@@H+](Cc3ccccc3)C2)n1 ZINC000065553714 570834342 /nfs/dbraw/zinc/83/43/42/570834342.db2.gz OBZRVCMGVGGFKO-VQTJNVASSA-N 1 1 383.561 4.417 50 0 GIAAMO CCN1CCN(c2cc(C[NH2+][C@H](c3cc4ccccc4o3)C(C)C)ccn2)CC1 ZINC000170592011 570849772 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GIAAMO Cc1ccc(NC(=O)C2CC[NH+](Cc3nc(-c4ccccc4)no3)CC2)cc1F ZINC000051317159 570908779 /nfs/dbraw/zinc/90/87/79/570908779.db2.gz PQYPHBHRDYSCHM-UHFFFAOYSA-N 1 1 394.450 4.035 50 0 GIAAMO Cc1ccc(C[NH+]2CCN(c3cc(Oc4cccc(F)c4)ncn3)CC2)cc1 ZINC000037357440 570927559 /nfs/dbraw/zinc/92/75/59/570927559.db2.gz XKZWNZYCWOPBII-UHFFFAOYSA-N 1 1 378.451 4.039 50 0 GIAAMO Cc1ccc(C[N@@H+](C[C@@H](O)COc2ccccc2C)C[C@@H]2CCCO2)c(C)c1 ZINC000105750443 570932493 /nfs/dbraw/zinc/93/24/93/570932493.db2.gz ZBCWLNGVSAPTBY-PKTZIBPZSA-N 1 1 383.532 4.033 50 0 GIAAMO Cc1cc(C)c(OCCOCC[N@@H+]2C[C@H](C)C[C@H](C)C2)c(Br)c1 ZINC000002822864 570933271 /nfs/dbraw/zinc/93/32/71/570933271.db2.gz SIRQYOHQTBOJBG-IYBDPMFKSA-N 1 1 384.358 4.439 50 0 GIAAMO CCOC(=O)c1c(NC(=S)Nc2ccccc2)sc2c1CC[N@H+](CC)C2 ZINC000004734339 570948721 /nfs/dbraw/zinc/94/87/21/570948721.db2.gz LVQLOMDPDLGKOX-UHFFFAOYSA-N 1 1 389.546 4.112 50 0 GIAAMO CCOC(=O)c1c(NC(=S)Nc2ccccc2)sc2c1CC[N@@H+](CC)C2 ZINC000004734339 570948725 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397.519 4.299 50 0 GIAAMO Cc1c(C(=O)N2CC[C@@H](C[N@H+](C)Cc3cccnc3)C2)sc2cccc(F)c12 ZINC000190612695 823591522 /nfs/dbraw/zinc/59/15/22/823591522.db2.gz QSHPAZRDWMBJDV-KRWDZBQOSA-N 1 1 397.519 4.338 50 0 GIAAMO COc1cccc(C[N@H+]2CCC[C@H](Cn3c(C)cnc3-c3ccccc3)C2)n1 ZINC000575547627 823976440 /nfs/dbraw/zinc/97/64/40/823976440.db2.gz NLCSQPNYOIAOMR-IBGZPJMESA-N 1 1 376.504 4.174 50 0 GIAAMO COC(=O)c1c(-c2ccc(F)cc2)csc1NC(=O)C[N@@H+]1CCC[C@@H](C)C1 ZINC000017079649 210203099 /nfs/dbraw/zinc/20/30/99/210203099.db2.gz FYEHXKAPXABJGD-CYBMUJFWSA-N 1 1 390.480 4.011 50 0 GIAAMO COC(=O)c1c(-c2ccc(F)cc2)csc1NC(=O)C[N@H+]1CCC[C@@H](C)C1 ZINC000017079649 210203103 /nfs/dbraw/zinc/20/31/03/210203103.db2.gz FYEHXKAPXABJGD-CYBMUJFWSA-N 1 1 390.480 4.011 50 0 GIAAMO Cc1ccc(Nc2cc(C)[nH+]c(N3CCN(C(=O)C4CCCCC4)CC3)n2)cc1 ZINC000017042542 210201951 /nfs/dbraw/zinc/20/19/51/210201951.db2.gz SGUCXLOCHKPJAH-UHFFFAOYSA-N 1 1 393.535 4.066 50 0 GIAAMO O=C(c1cccc2ccccc21)[C@@H]1CCC[N@H+](Cc2cccc(OCCO)c2)C1 ZINC000015080666 210152582 /nfs/dbraw/zinc/15/25/82/210152582.db2.gz YSBFQNNGFKVDSV-OAQYLSRUSA-N 1 1 389.495 4.306 50 0 GIAAMO CCCCc1nc(CN(C)C[C@H]2CCC[N@@H+](CCc3ccccc3OC)C2)c[nH]1 ZINC000015075407 210151152 /nfs/dbraw/zinc/15/11/52/210151152.db2.gz WEFPLACGXIRMLD-HXUWFJFHSA-N 1 1 398.595 4.147 50 0 GIAAMO CCCCc1ncc(CN(C)C[C@H]2CCC[N@H+](CCc3ccccc3OC)C2)[nH]1 ZINC000015075407 210151156 /nfs/dbraw/zinc/15/11/56/210151156.db2.gz WEFPLACGXIRMLD-HXUWFJFHSA-N 1 1 398.595 4.147 50 0 GIAAMO CCCCc1ncc(CN(C)C[C@H]2CCC[N@@H+](CCc3ccccc3OC)C2)[nH]1 ZINC000015075407 210151162 /nfs/dbraw/zinc/15/11/62/210151162.db2.gz WEFPLACGXIRMLD-HXUWFJFHSA-N 1 1 398.595 4.147 50 0 GIAAMO Cc1nn(C)c(Cl)c1CN(C)C[C@H]1CCC[N@@H+](CCc2ccccc2C)C1 ZINC000015077595 210150343 /nfs/dbraw/zinc/15/03/43/210150343.db2.gz LBWIIVWYABDMKL-LJQANCHMSA-N 1 1 388.987 4.077 50 0 GIAAMO COc1cccc(C[N@@H+]2CCC[C@@H]2C(=O)Nc2ccc(-c3cscn3)cc2)c1 ZINC000015066124 210148797 /nfs/dbraw/zinc/14/87/97/210148797.db2.gz UPUBIACOAXDLSH-OAQYLSRUSA-N 1 1 393.512 4.422 50 0 GIAAMO COc1cccc(C[N@H+]2CCC[C@@H]2C(=O)Nc2ccc(-c3cscn3)cc2)c1 ZINC000015066124 210148801 /nfs/dbraw/zinc/14/88/01/210148801.db2.gz UPUBIACOAXDLSH-OAQYLSRUSA-N 1 1 393.512 4.422 50 0 GIAAMO COc1cccc(-c2ccc(NC(=O)[C@@H]3CCC[N@@H+]3Cc3cccnc3)cc2)c1 ZINC000015065917 210147898 /nfs/dbraw/zinc/14/78/98/210147898.db2.gz FPTMORHFHSNUAU-QHCPKHFHSA-N 1 1 387.483 4.360 50 0 GIAAMO COc1cccc(-c2ccc(NC(=O)[C@@H]3CCC[N@H+]3Cc3cccnc3)cc2)c1 ZINC000015065917 210147902 /nfs/dbraw/zinc/14/79/02/210147902.db2.gz FPTMORHFHSNUAU-QHCPKHFHSA-N 1 1 387.483 4.360 50 0 GIAAMO COc1cccc(C[N@@H+]2CCC[C@H]2C(=O)Nc2ccc(-c3cscn3)cc2)c1 ZINC000015066125 210147491 /nfs/dbraw/zinc/14/74/91/210147491.db2.gz UPUBIACOAXDLSH-NRFANRHFSA-N 1 1 393.512 4.422 50 0 GIAAMO COc1cccc(C[N@H+]2CCC[C@H]2C(=O)Nc2ccc(-c3cscn3)cc2)c1 ZINC000015066125 210147495 /nfs/dbraw/zinc/14/74/95/210147495.db2.gz UPUBIACOAXDLSH-NRFANRHFSA-N 1 1 393.512 4.422 50 0 GIAAMO CCSc1ncc(CN2CC[C@]3(C2)CCC[N@@H+](CCc2ccccc2)C3)cn1 ZINC000015062209 210145262 /nfs/dbraw/zinc/14/52/62/210145262.db2.gz UXSLPGATTHBNRG-HSZRJFAPSA-N 1 1 396.604 4.119 50 0 GIAAMO CC(C)(C)c1ccc(-n2ncc3c2CCC[C@H]3[NH2+]Cc2ccc(CO)o2)cc1 ZINC000014977152 210138892 /nfs/dbraw/zinc/13/88/92/210138892.db2.gz STRAPKPARAINKW-OAQYLSRUSA-N 1 1 379.504 4.422 50 0 GIAAMO O=C(c1cccc2ccccc21)[C@H]1CCC[N@H+](Cc2ccc(OCCO)cc2)C1 ZINC000014955994 210134364 /nfs/dbraw/zinc/13/43/64/210134364.db2.gz ISLUBIWXNTWZFE-NRFANRHFSA-N 1 1 389.495 4.306 50 0 GIAAMO Cc1ccc2cc(C[NH2+]Cc3ccccc3Cl)c(N3CCC(O)CC3)nc2c1 ZINC000014958573 210133604 /nfs/dbraw/zinc/13/36/04/210133604.db2.gz NBDXNNHEBKTPFH-UHFFFAOYSA-N 1 1 395.934 4.448 50 0 GIAAMO OC1(c2ccc3c(c2)C[N@@H+](C2CCC2)CCO3)CCN(c2ccccc2F)CC1 ZINC000014883319 210128480 /nfs/dbraw/zinc/12/84/80/210128480.db2.gz TZWAPCWCLKFFKU-UHFFFAOYSA-N 1 1 396.506 4.061 50 0 GIAAMO CCOC(=O)C1(CCOc2ccccc2)CC[NH+](Cc2cnc(C)s2)CC1 ZINC000013595824 210070936 /nfs/dbraw/zinc/07/09/36/210070936.db2.gz AQDWISRSCBMKHV-UHFFFAOYSA-N 1 1 388.533 4.066 50 0 GIAAMO O=C(NC1CCCCC1)N1CC[NH+](C(c2ccccc2)c2ccccc2)CC1 ZINC000013468414 210062941 /nfs/dbraw/zinc/06/29/41/210062941.db2.gz IRRGBCHOFRYUCB-UHFFFAOYSA-N 1 1 377.532 4.436 50 0 in-vivo GIAAMO Cc1cccc(C(C)C)c1NC(=O)C[NH+]1CCC(C(=O)N2CCCCCC2)CC1 ZINC000012996636 210044681 /nfs/dbraw/zinc/04/46/81/210044681.db2.gz DKMURLALNOUACZ-UHFFFAOYSA-N 1 1 399.579 4.172 50 0 GIAAMO COc1ccc([C@H]2CCCCC[N@H+]2CC(=O)Nc2ccc(OC)c(OC)c2)cc1 ZINC000012995349 210043814 /nfs/dbraw/zinc/04/38/14/210043814.db2.gz ZHPTYQPTENJEKV-HXUWFJFHSA-N 1 1 398.503 4.268 50 0 GIAAMO Cc1cccc(C(C)C)c1NC(=O)C[N@@H+]1CCC[C@@H](C(=O)Nc2ccccc2)C1 ZINC000012933638 210031954 /nfs/dbraw/zinc/03/19/54/210031954.db2.gz LEQFRVOUBATOHF-LJQANCHMSA-N 1 1 393.531 4.408 50 0 GIAAMO Cc1cccc(C(C)C)c1NC(=O)C[N@H+]1CCC[C@@H](C(=O)Nc2ccccc2)C1 ZINC000012933638 210031960 /nfs/dbraw/zinc/03/19/60/210031960.db2.gz LEQFRVOUBATOHF-LJQANCHMSA-N 1 1 393.531 4.408 50 0 GIAAMO O=C(Nc1cccc(Cl)c1)N1CC[NH+](Cc2cccc3cccnc32)CC1 ZINC000012817024 210015041 /nfs/dbraw/zinc/01/50/41/210015041.db2.gz ZXCNQNNJUHFYAV-UHFFFAOYSA-N 1 1 380.879 4.238 50 0 GIAAMO Cc1cc(NC(=O)C[NH2+][C@H](C)c2ccccc2Cl)n(-c2ccc(F)cc2)n1 ZINC000012774930 210007264 /nfs/dbraw/zinc/00/72/64/210007264.db2.gz FQVCYVNVVNTSJY-CQSZACIVSA-N 1 1 386.858 4.263 50 0 GIAAMO C[C@H](C(=O)Nc1cccc(Cl)c1)[NH+]1CCC(C(=O)Nc2ccccc2)CC1 ZINC000012771689 210007241 /nfs/dbraw/zinc/00/72/41/210007241.db2.gz KTGXJTGZWXKYBN-OAHLLOKOSA-N 1 1 385.895 4.018 50 0 GIAAMO C[C@@H]1C[C@@H](C)C[NH+](Cc2csc(NC(=O)c3ccc(C(F)(F)F)nc3)n2)C1 ZINC000012758087 210002606 /nfs/dbraw/zinc/00/26/06/210002606.db2.gz ZNGMQNKEPZIIGW-VXGBXAGGSA-N 1 1 398.454 4.287 50 0 GIAAMO CSc1ncccc1C(=O)NC[C@H](c1ccccc1Cl)[NH+]1CCCC1 ZINC000012755116 210000358 /nfs/dbraw/zinc/00/03/58/210000358.db2.gz BBDIYOQDVKJCLK-QGZVFWFLSA-N 1 1 375.925 4.024 50 0 GIAAMO COc1ccc(OC)c(NC(=O)[C@@H](C)Nc2ccc([NH+]3CCC(C)CC3)cc2)c1 ZINC000012550248 209972343 /nfs/dbraw/zinc/97/23/43/209972343.db2.gz LYLGXBISMKDCEM-QGZVFWFLSA-N 1 1 397.519 4.379 50 0 GIAAMO CCN(C[C@H]1CCC[N@@H+](CCc2cccc(F)c2)C1)C(=O)c1ccc(OC)cc1 ZINC000012299209 209931976 /nfs/dbraw/zinc/93/19/76/209931976.db2.gz OCWLGYFHXPJVND-FQEVSTJZSA-N 1 1 398.522 4.251 50 0 GIAAMO CN(C)CCC[NH2+]C[C@@H](O)Cn1c2ccc(Cl)cc2c2cc(Cl)ccc21 ZINC000002690148 209378409 /nfs/dbraw/zinc/37/84/09/209378409.db2.gz ZUXCZVPFDKRZKN-MRXNPFEDSA-N 1 1 394.346 4.004 50 0 GIAAMO FC(F)(F)c1ccc2oc(C[N@H+]3CCC[C@H](c4nnc(C5CC5)[nH]4)C3)nc2c1 ZINC000095980439 209240458 /nfs/dbraw/zinc/24/04/58/209240458.db2.gz COPQSDVEGOEIRF-LBPRGKRZSA-N 1 1 391.397 4.222 50 0 GIAAMO Cn1ccc2ccc(C(=O)N3CCCC4=C[C@H]5C[C@H](C[N@H+]6CCCC[C@H]56)[C@@H]43)cc21 ZINC000257198789 209223840 /nfs/dbraw/zinc/22/38/40/209223840.db2.gz IGUKVIWLZAHKCK-JVNMPXIPSA-N 1 1 389.543 4.214 50 0 GIAAMO CN(C[C@@H]1CCC[N@H+]2CCCC[C@H]12)C(=O)Cc1ccc2c(c1)CCC(C)(C)O2 ZINC000253413507 209218747 /nfs/dbraw/zinc/21/87/47/209218747.db2.gz UYNFAJIZQWJGJC-LEWJYISDSA-N 1 1 384.564 4.056 50 0 GIAAMO CC(C)Cn1ccc2c1cccc2OCC(=O)NC[C@@H]1CCC[N@H+]2CCCC[C@H]12 ZINC000253394528 209217334 /nfs/dbraw/zinc/21/73/34/209217334.db2.gz ADQYEARHKJBSSO-PZJWPPBQSA-N 1 1 397.563 4.057 50 0 GIAAMO CC(C)c1ccc2oc(=O)cc(C[NH+]3CCN(c4ccc(F)cc4)CC3)c2c1 ZINC000054105905 209213045 /nfs/dbraw/zinc/21/30/45/209213045.db2.gz XCGOSRWLVFOHDS-UHFFFAOYSA-N 1 1 380.463 4.378 50 0 GIAAMO CCOc1ccccc1CN(C)C[C@@H]1CCC[N@@H+](CCc2ccc(OC)cc2)C1 ZINC000055227856 212059414 /nfs/dbraw/zinc/05/94/14/212059414.db2.gz VLVSGKXHLHTPJU-QFIPXVFZSA-N 1 1 396.575 4.480 50 0 GIAAMO c1ccc([C@@H]2C[C@H](c3noc(CCc4nc5ccccc5[nH]4)n3)[C@H]3CCC[N@@H+]32)cc1 ZINC000299787172 212036773 /nfs/dbraw/zinc/03/67/73/212036773.db2.gz VKHKFTFKSUNLCS-WMQCIHAUSA-N 1 1 399.498 4.424 50 0 GIAAMO Clc1ccc(Cn2nc(C[NH2+]Cc3ccncc3)c(-c3ccccc3)n2)cc1 ZINC000261491949 212029411 /nfs/dbraw/zinc/02/94/11/212029411.db2.gz MEMVYYFBWBABQM-UHFFFAOYSA-N 1 1 389.890 4.332 50 0 GIAAMO COc1ccc(NC(=O)C2=C[NH2+]N(c3ccccc3)[C@H]2n2cccc2)cc1Cl ZINC000334160957 209177255 /nfs/dbraw/zinc/17/72/55/209177255.db2.gz PNOUIJPATJIQQB-LAUBAEHRSA-N 1 1 394.862 4.410 50 0 GIAAMO CC(C)(Oc1ccc(Cl)cc1)C(=O)NC[C@@H](c1ccco1)[NH+]1CCCCC1 ZINC000013010097 211695186 /nfs/dbraw/zinc/69/51/86/211695186.db2.gz SSRLLARLRIRSEB-SFHVURJKSA-N 1 1 390.911 4.434 50 0 GIAAMO Cc1nc(C)c(-c2nnc(SCC[N@H+](C)Cc3ccc(F)cc3)o2)s1 ZINC000097139634 211360241 /nfs/dbraw/zinc/36/02/41/211360241.db2.gz JRTCLUFIUBMYHZ-UHFFFAOYSA-N 1 1 378.498 4.173 50 0 GIAAMO CC[N@H+]1C[C@H](c2ccccc2)CC2(CCN(Cc3csc(NC)n3)CC2)C1 ZINC000096167126 211315556 /nfs/dbraw/zinc/31/55/56/211315556.db2.gz MEXLMRYPYHECIU-LJQANCHMSA-N 1 1 384.593 4.276 50 0 GIAAMO Cc1cccc(-c2nc3ccc(NC(=O)N4CCC[N@H+](C)C[C@@H]4C)cc3o2)c1 ZINC000096147862 211310219 /nfs/dbraw/zinc/31/02/19/211310219.db2.gz HJPQGSZLNDGGBQ-INIZCTEOSA-N 1 1 378.476 4.361 50 0 GIAAMO COc1cccc2c(NCc3ccccc3)nc(-n3c(N)[nH+]c4ccccc43)nc12 ZINC000096021026 211295221 /nfs/dbraw/zinc/29/52/21/211295221.db2.gz NHAMBLRUUJAFOY-UHFFFAOYSA-N 1 1 396.454 4.172 50 0 in-vitro GIAAMO c1cn(Cc2ccccc2)c(C[NH2+]C2(c3ccc4c(c3)OCCO4)CCCC2)n1 ZINC000095959500 211287708 /nfs/dbraw/zinc/28/77/08/211287708.db2.gz USXQZUVPWJZILN-UHFFFAOYSA-N 1 1 389.499 4.262 50 0 GIAAMO O=C(Nc1cccc(-c2ccc(F)cc2)c1)[C@@H]1CCC[N@@H+](CCc2ncc[nH]2)C1 ZINC000095519244 211264052 /nfs/dbraw/zinc/26/40/52/211264052.db2.gz PKFOHCZYRXSQKX-LJQANCHMSA-N 1 1 392.478 4.109 50 0 GIAAMO Cc1nc[nH]c1C[N@H+]1CCC[C@@H](C(=O)Nc2ccc(-c3cccc(F)c3)cc2)C1 ZINC000095530997 211275491 /nfs/dbraw/zinc/27/54/91/211275491.db2.gz SVPDPVQFUPNGBJ-LJQANCHMSA-N 1 1 392.478 4.375 50 0 GIAAMO CC(=O)c1cccc(-c2ccc(NC(=O)N3CC[C@@H]4CC[C@H](C3)[N@H+]4C)cc2)c1 ZINC000095525795 211271714 /nfs/dbraw/zinc/27/17/14/211271714.db2.gz BLOHBQGAYDSJIG-FCHUYYIVSA-N 1 1 377.488 4.257 50 0 GIAAMO CCc1ccc(C(=O)N(C)C[C@@H]2CCC[N@@H+](CCc3ccc(Cl)cc3)C2)[nH]1 ZINC000095524203 211271003 /nfs/dbraw/zinc/27/10/03/211271003.db2.gz MMGQIVXYTVXWFP-SFHVURJKSA-N 1 1 387.955 4.257 50 0 GIAAMO CC(=O)N[C@@H]1C[N@@H+](Cc2cccc(-c3ccc(C)o3)c2)C[C@H]1c1ccc(C)o1 ZINC000095524876 211268906 /nfs/dbraw/zinc/26/89/06/211268906.db2.gz KCQUKLCUBXULJF-NHCUHLMSSA-N 1 1 378.472 4.261 50 0 GIAAMO O=C(Nc1cccc(-c2ccc(F)cc2)c1)[C@H]1CCC[N@@H+](CCc2cn[nH]c2)C1 ZINC000095505136 211257973 /nfs/dbraw/zinc/25/79/73/211257973.db2.gz WCDXRBAFTYYVEK-FQEVSTJZSA-N 1 1 392.478 4.109 50 0 GIAAMO C[C@H](C(=O)Nc1ccc(Oc2ccccc2)cc1)[N@@H+]1CCC[C@H](c2ncc[nH]2)C1 ZINC000095405690 211238476 /nfs/dbraw/zinc/23/84/76/211238476.db2.gz YSCQDSZUPPIQJT-MSOLQXFVSA-N 1 1 390.487 4.409 50 0 GIAAMO C[C@H](C(=O)Nc1ccc(Oc2ccccc2)cc1)[N@H+]1CCC[C@H](c2ncc[nH]2)C1 ZINC000095405690 211238481 /nfs/dbraw/zinc/23/84/81/211238481.db2.gz YSCQDSZUPPIQJT-MSOLQXFVSA-N 1 1 390.487 4.409 50 0 GIAAMO COc1ccc(C)cc1NC(=O)[C@@H]1CCC[N@H+]1C1CC(c2ccc(F)cc2)C1 ZINC000095457113 211242815 /nfs/dbraw/zinc/24/28/15/211242815.db2.gz MQXDBTZIGDWGHF-XTXLOEGASA-N 1 1 382.479 4.492 50 0 GIAAMO Fc1ccc(C[N@H+]2C[C@@H]3CC[C@H](C2)N(Cc2cnn(-c4ccccc4)c2)C3)cc1 ZINC000095371376 211228388 /nfs/dbraw/zinc/22/83/88/211228388.db2.gz HDAIWIDEPQVENU-GBXCKJPGSA-N 1 1 390.506 4.108 50 0 GIAAMO CC(=O)c1cc(CN2C[C@H]3CC[C@@H]2C[N@H+](C2Cc4ccccc4C2)C3)cs1 ZINC000095365650 211226238 /nfs/dbraw/zinc/22/62/38/211226238.db2.gz BTRBVFJFNYUMDW-DYESRHJHSA-N 1 1 380.557 4.014 50 0 GIAAMO CCCc1ccc(C[N@H+]2CCC[C@@]3(CCC(=O)N(Cc4cccnc4)C3)C2)o1 ZINC000092022476 211212340 /nfs/dbraw/zinc/21/23/40/211212340.db2.gz FBBJDTLTLHHONO-HSZRJFAPSA-N 1 1 381.520 4.032 50 0 GIAAMO Cc1ccc2nc(-c3ccc(F)cc3)c(C[N@@H+]3CCC(=O)NC[C@@H]3C)cc2c1 ZINC000072421775 211115702 /nfs/dbraw/zinc/11/57/02/211115702.db2.gz SPWZQAWGGYJUOJ-INIZCTEOSA-N 1 1 377.463 4.060 50 0 GIAAMO CCNc1nc(Nc2ccc(NC(=O)Cc3ccc(OC)cc3)cc2)cc(C)[nH+]1 ZINC000072437060 211120514 /nfs/dbraw/zinc/12/05/14/211120514.db2.gz KWYLJVLWPDHFAK-UHFFFAOYSA-N 1 1 391.475 4.150 50 0 GIAAMO CCc1[nH+]ccn1CCNC(=O)c1cc(-c2ccc(C)cc2)nc2ccccc21 ZINC000072448244 211119980 /nfs/dbraw/zinc/11/99/80/211119980.db2.gz RGQBARCXKZXGFV-UHFFFAOYSA-N 1 1 384.483 4.399 50 0 GIAAMO CC[C@H]1CN(Cc2nc(-c3ccc(OC)cc3F)oc2C)CC[N@H+]1C(C)C ZINC000071661731 211051290 /nfs/dbraw/zinc/05/12/90/211051290.db2.gz KGHFPNZTWYNXSK-INIZCTEOSA-N 1 1 375.488 4.102 50 0 GIAAMO C[N@H+]1CCCN(c2ncccc2CNc2ccnc3cc(Cl)ccc32)CC1 ZINC000067741356 211019819 /nfs/dbraw/zinc/01/98/19/211019819.db2.gz DQWJNNRPXNJCKD-UHFFFAOYSA-N 1 1 381.911 4.037 50 0 GIAAMO CC(C)c1[nH+]ccn1CCCNC(=O)c1ccc(-c2c[nH]c3ccccc32)nc1 ZINC000067472753 211010871 /nfs/dbraw/zinc/01/08/71/211010871.db2.gz XGOPBLPWQGSULH-UHFFFAOYSA-N 1 1 387.487 4.370 50 0 GIAAMO COc1ccc(-c2n[nH]cc2C[N@H+]2CCC[C@@H]2c2c(C)noc2C)cc1OC ZINC000021719933 210391472 /nfs/dbraw/zinc/39/14/72/210391472.db2.gz VOCJPGXBMUBZCN-QGZVFWFLSA-N 1 1 382.464 4.036 50 0 GIAAMO CCc1onc(C)c1[C@@H]1CCC[N@H+]1Cc1c[nH]nc1-c1cc(OC)ccc1OC ZINC000021720810 210391490 /nfs/dbraw/zinc/39/14/90/210391490.db2.gz VNFRONDWFAGIJF-SFHVURJKSA-N 1 1 396.491 4.290 50 0 GIAAMO C[N@@H+](Cc1ccccc1NCC(=O)Nc1ccc2c(c1)OCO2)C1CCCCC1 ZINC000021133910 210378931 /nfs/dbraw/zinc/37/89/31/210378931.db2.gz NXHKAKCUCRKILH-UHFFFAOYSA-N 1 1 395.503 4.230 50 0 GIAAMO Clc1cccc(-c2n[nH]c3c2C[N@H+]([C@H]2CCN(c4ccccc4)C2)CC3)c1 ZINC000020855207 210363503 /nfs/dbraw/zinc/36/35/03/210363503.db2.gz IYLUEXCMQOKFFV-IBGZPJMESA-N 1 1 378.907 4.367 50 0 GIAAMO COc1ccc(/C=C/C(=O)N2CC[NH+](Cc3ccccc3)CC2)c2ccccc12 ZINC000020432556 210334175 /nfs/dbraw/zinc/33/41/75/210334175.db2.gz HBGAEYDFZHCBLH-WYMLVPIESA-N 1 1 386.495 4.206 50 0 GIAAMO S=C(NCc1ccco1)N1CC[NH+](C(c2ccccc2)c2ccccc2)CC1 ZINC000019973455 210310212 /nfs/dbraw/zinc/31/02/12/210310212.db2.gz MTXOAJNODHZMNY-UHFFFAOYSA-N 1 1 391.540 4.061 50 0 GIAAMO COc1ccc(-c2nn(-c3ccccc3)cc2C[NH2+]Cc2cc(C)no2)c(F)c1 ZINC000020209927 210321697 /nfs/dbraw/zinc/32/16/97/210321697.db2.gz GEEFJLDJMWQTLG-UHFFFAOYSA-N 1 1 392.434 4.273 50 0 GIAAMO CN(C)c1ncc(C[N@@H+]2CCC[C@@H](C(=O)c3cccc(C(F)(F)F)c3)C2)s1 ZINC000019835643 210301263 /nfs/dbraw/zinc/30/12/63/210301263.db2.gz ZBTZZHNZRCPCHJ-CQSZACIVSA-N 1 1 397.466 4.323 50 0 GIAAMO CN(C)c1ncc(C[N@H+]2CCC[C@@H](C(=O)c3cccc(C(F)(F)F)c3)C2)s1 ZINC000019835643 210301266 /nfs/dbraw/zinc/30/12/66/210301266.db2.gz ZBTZZHNZRCPCHJ-CQSZACIVSA-N 1 1 397.466 4.323 50 0 GIAAMO CCOc1ccc(C[NH+]2CCN(Cc3cccc(Br)c3)CC2)cc1 ZINC000019831819 210299989 /nfs/dbraw/zinc/29/99/89/210299989.db2.gz OCVJBKFVGZEBSJ-UHFFFAOYSA-N 1 1 389.337 4.166 50 0 GIAAMO Oc1ccccc1C(=S)N1CC[NH+](C(c2ccccc2)c2ccccc2)CC1 ZINC000019832011 210299436 /nfs/dbraw/zinc/29/94/36/210299436.db2.gz QFWLPEGTFPXASN-UHFFFAOYSA-N 1 1 388.536 4.475 50 0 GIAAMO CN1CC[NH+](CCO[C@@H]2c3ccccc3CSc3ccc(Cl)cc32)CC1 ZINC000019802422 210298307 /nfs/dbraw/zinc/29/83/07/210298307.db2.gz HTQNTTWSGOYWOJ-OAQYLSRUSA-N 1 1 388.964 4.299 50 0 aggregator GIAAMO CC(C)c1ccc(N[C@@H]2CCC[N@@H+](Cc3cccn3-c3ncccn3)C2)cc1 ZINC000011822139 221130374 /nfs/dbraw/zinc/13/03/74/221130374.db2.gz WTVJCYMOOSLBFC-OAQYLSRUSA-N 1 1 375.520 4.467 50 0 GIAAMO CCc1nc(C)c(C(=O)N[C@H]2CCC[N@@H+](Cc3ccc(CC(C)C)cc3)C2)o1 ZINC000011841473 221132893 /nfs/dbraw/zinc/13/28/93/221132893.db2.gz BUSQTORDAHQTQO-FQEVSTJZSA-N 1 1 383.536 4.138 50 0 GIAAMO Cc1cccc(N2CC[NH+](CCNC(=S)Nc3c(C)cccc3C)CC2)c1C ZINC000058021458 136154369 /nfs/dbraw/zinc/15/43/69/136154369.db2.gz DVFFKYZDFKDVGN-UHFFFAOYSA-N 1 1 396.604 4.029 50 0 GIAAMO Cc1nc(C[N@H+]2CCCC23CCN(c2ccc(C(F)(F)F)cn2)CC3)co1 ZINC000072418587 136169571 /nfs/dbraw/zinc/16/95/71/136169571.db2.gz RNYIDOSOWFLPDW-UHFFFAOYSA-N 1 1 380.414 4.032 50 0 GIAAMO CCOc1ccc(OCC)c(NC(=O)N2CC[N@H+](C)C[C@H]2c2ccccc2)c1 ZINC000048236307 570222138 /nfs/dbraw/zinc/22/21/38/570222138.db2.gz CFXMWLVTIRZCBX-FQEVSTJZSA-N 1 1 383.492 4.005 50 0 GIAAMO CCOc1ccc(OCC)c(NC(=O)N2CC[N@@H+](C)C[C@H]2c2ccccc2)c1 ZINC000048236307 570222141 /nfs/dbraw/zinc/22/21/41/570222141.db2.gz CFXMWLVTIRZCBX-FQEVSTJZSA-N 1 1 383.492 4.005 50 0 GIAAMO C[NH+](C)[C@H](CNC(=O)Nc1ccccc1N1CCCC1)c1ccccc1Cl ZINC000048303263 570231949 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GIAAMO Brc1ccccc1C[NH+]1CC(c2nc(-c3cccs3)no2)C1 ZINC000049484405 570267810 /nfs/dbraw/zinc/26/78/10/570267810.db2.gz LTXCKAGVEYJURR-UHFFFAOYSA-N 1 1 376.279 4.160 50 0 GIAAMO CC(C)(C)OC(=O)N1CCC([N@H+]2CC[C@@H](Oc3cccc(Cl)c3)C2)CC1 ZINC000526056015 570274851 /nfs/dbraw/zinc/27/48/51/570274851.db2.gz YDNIORZNPGKUIZ-GOSISDBHSA-N 1 1 380.916 4.193 50 0 GIAAMO Cc1c(Cl)cccc1NC(=O)[C@H](C)[N@@H+]1CCC[C@H](C(=O)Nc2ccccc2)C1 ZINC000035271116 570280155 /nfs/dbraw/zinc/28/01/55/570280155.db2.gz RLTSELQLVOGZBG-IRXDYDNUSA-N 1 1 399.922 4.326 50 0 GIAAMO Cc1c(Cl)cccc1NC(=O)[C@H](C)[N@H+]1CCC[C@H](C(=O)Nc2ccccc2)C1 ZINC000035271116 570280158 /nfs/dbraw/zinc/28/01/58/570280158.db2.gz RLTSELQLVOGZBG-IRXDYDNUSA-N 1 1 399.922 4.326 50 0 GIAAMO Cc1ccc(N2CC[NH+](Cc3cccc(C(=O)NCC(C)C)c3)CC2)cc1C ZINC000034668118 570292501 /nfs/dbraw/zinc/29/25/01/570292501.db2.gz APCQBXXEJZBJBA-UHFFFAOYSA-N 1 1 379.548 4.011 50 0 GIAAMO COc1ccc(C[N@H+](Cc2ccc(C(=O)NC3CC3)cc2)C2CC2)c(Cl)c1 ZINC000072309080 570303799 /nfs/dbraw/zinc/30/37/99/570303799.db2.gz KIQOILOIRJAFKA-UHFFFAOYSA-N 1 1 384.907 4.405 50 0 GIAAMO COc1ccc(C[N@@H+](Cc2ccc(C(=O)NC3CC3)cc2)C2CC2)c(Cl)c1 ZINC000072309080 570303801 /nfs/dbraw/zinc/30/38/01/570303801.db2.gz KIQOILOIRJAFKA-UHFFFAOYSA-N 1 1 384.907 4.405 50 0 GIAAMO CCN(c1ccccc1)c1ccc(C[NH2+]Cc2nc(-c3cccnc3)n[nH]2)cc1 ZINC000072310915 570305792 /nfs/dbraw/zinc/30/57/92/570305792.db2.gz MSXSKBHOCREGRS-UHFFFAOYSA-N 1 1 384.487 4.315 50 0 GIAAMO Cc1ccnc(NC(=O)c2ccc([C@@H]3CCC[N@@H+]3Cc3cccnc3)s2)c1 ZINC000023429721 570323552 /nfs/dbraw/zinc/32/35/52/570323552.db2.gz KPFJHLDKWALPTH-KRWDZBQOSA-N 1 1 378.501 4.436 50 0 GIAAMO Cc1ccnc(NC(=O)c2ccc([C@@H]3CCC[N@H+]3Cc3cccnc3)s2)c1 ZINC000023429721 570323555 /nfs/dbraw/zinc/32/35/55/570323555.db2.gz KPFJHLDKWALPTH-KRWDZBQOSA-N 1 1 378.501 4.436 50 0 GIAAMO COCC[NH+]1CCN([C@@H]2Cc3ccccc3Sc3ccc(Cl)cc32)CC1 ZINC000022862207 570332226 /nfs/dbraw/zinc/33/22/26/570332226.db2.gz RWVNNNIJTFVKHA-LJQANCHMSA-N 1 1 388.964 4.352 50 0 GIAAMO Cc1cccc(NC(=O)CN2CC[NH+](Cc3csc4ccccc34)CC2)c1C ZINC000022931455 570337227 /nfs/dbraw/zinc/33/72/27/570337227.db2.gz LQLHNPLEGDNRSX-UHFFFAOYSA-N 1 1 393.556 4.274 50 0 GIAAMO O=C(CCc1c[nH]c2ccccc12)N1CCC[N@@H+](Cc2ccc(Cl)cc2)CC1 ZINC000023193047 570349603 /nfs/dbraw/zinc/34/96/03/570349603.db2.gz CWDZYICVNIKGSO-UHFFFAOYSA-N 1 1 395.934 4.488 50 0 GIAAMO O=C(CCc1c[nH]c2ccccc12)N1CCC[N@H+](Cc2ccc(Cl)cc2)CC1 ZINC000023193047 570349606 /nfs/dbraw/zinc/34/96/06/570349606.db2.gz CWDZYICVNIKGSO-UHFFFAOYSA-N 1 1 395.934 4.488 50 0 GIAAMO CCN(Cc1nc2ccccc2[nH]1)C[C@H]1CCC[N@@H+](CCc2cccc(F)c2)C1 ZINC000023338813 570355490 /nfs/dbraw/zinc/35/54/90/570355490.db2.gz AOZNBJXTGOFGOA-HXUWFJFHSA-N 1 1 394.538 4.479 50 0 GIAAMO O=c1[nH]c(-c2cccc(C[N@H+]3CC[C@@H]3c3ccc(F)cc3)c2)nc2c1CCC2 ZINC000023379935 570358690 /nfs/dbraw/zinc/35/86/90/570358690.db2.gz WNWXCXCRVCQFRH-OAQYLSRUSA-N 1 1 375.447 4.012 50 0 GIAAMO O=c1[nH]c(-c2cccc(C[N@@H+]3CC[C@@H]3c3ccc(F)cc3)c2)nc2c1CCC2 ZINC000023379935 570358693 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GIAAMO COc1cc(CCC2CC[NH+](Cc3nc(C(C)(C)C)no3)CC2)cc(OC)c1 ZINC000025065594 570405155 /nfs/dbraw/zinc/40/51/55/570405155.db2.gz IRUPBSPMKHXOIU-UHFFFAOYSA-N 1 1 387.524 4.229 50 0 GIAAMO Cc1ccc(C)c(-n2cc(CN3CC[N@H+]4CCC[C@H]4C3)c(-c3ccccc3)n2)c1 ZINC000243892565 570432775 /nfs/dbraw/zinc/43/27/75/570432775.db2.gz AIXXHXRYNMQZRT-QHCPKHFHSA-N 1 1 386.543 4.436 50 0 GIAAMO Cc1c2cc(Cl)ccc2oc1C(=O)NCC1([NH+]2CCOCC2)CCCCC1 ZINC000027662831 570438752 /nfs/dbraw/zinc/43/87/52/570438752.db2.gz REXGZKRWFBDMHS-UHFFFAOYSA-N 1 1 390.911 4.160 50 0 GIAAMO Cc1c2ccc(C)c(C)c2oc1C(=O)NCC1(N2CC[NH+](C)CC2)CCCCC1 ZINC000027795577 570443469 /nfs/dbraw/zinc/44/34/69/570443469.db2.gz AIGSHMOEDGBEDC-UHFFFAOYSA-N 1 1 397.563 4.038 50 0 GIAAMO CCN1CC[NH+](C2(CNC(=O)c3oc4ccc(C)cc4c3C)CCCCC2)CC1 ZINC000028292918 570457136 /nfs/dbraw/zinc/45/71/36/570457136.db2.gz AUAAQJDPHJTSQJ-UHFFFAOYSA-N 1 1 397.563 4.120 50 0 GIAAMO CCOC(=O)c1c2c(sc1NC(=O)[C@@H](C)[NH+]1CCCCCC1)CCCC2 ZINC000006507424 570460725 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O=C(NCC1([NH+]2CCOCC2)CCCCC1)c1sccc1-c1ccccc1 ZINC000032967407 570550135 /nfs/dbraw/zinc/55/01/35/570550135.db2.gz XPGVMLOWAOHCJQ-UHFFFAOYSA-N 1 1 384.545 4.180 50 0 GIAAMO OC[C@@]1(Cc2ccccc2)CCC[N@@H+](Cc2c[nH]nc2-c2cccc(F)c2)C1 ZINC000011663276 570577928 /nfs/dbraw/zinc/57/79/28/570577928.db2.gz CTRVRMVSZLCKPX-HSZRJFAPSA-N 1 1 379.479 4.033 50 0 GIAAMO CCc1[nH+]ccn1CCC(=O)N1CCC[C@H](C(=O)c2cccc3ccccc32)C1 ZINC000011663597 570577963 /nfs/dbraw/zinc/57/79/63/570577963.db2.gz QXZGLRFOSSGDCW-IBGZPJMESA-N 1 1 389.499 4.110 50 0 GIAAMO O=C(N[C@@H]1CCC[N@H+](C2CCCCCC2)C1)c1c[nH]nc1-c1ccccc1F ZINC000011664277 570578449 /nfs/dbraw/zinc/57/84/49/570578449.db2.gz MNVRVAWCWKXZPV-MRXNPFEDSA-N 1 1 384.499 4.133 50 0 GIAAMO CCc1[nH+]ccn1CC1CCN(C(=O)Cc2coc3c2ccc(C)c3C)CC1 ZINC000062129900 570579269 /nfs/dbraw/zinc/57/92/69/570579269.db2.gz XPLSHROZDUGWAG-UHFFFAOYSA-N 1 1 379.504 4.290 50 0 GIAAMO CC(C)c1[nH+]ccn1CC1CCN(C(=O)c2cc(-c3ccccc3)on2)CC1 ZINC000062130058 570579388 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4.079 50 0 GIAAMO COc1ccc(CC[N@H+]2CCC[C@@H](CN(C)Cc3cc(CC(C)C)n[nH]3)C2)cc1 ZINC000011936274 570594057 /nfs/dbraw/zinc/59/40/57/570594057.db2.gz CEAGEJIYAWAGTP-NRFANRHFSA-N 1 1 398.595 4.003 50 0 GIAAMO COc1ccc(CC[N@@H+]2CCC[C@@H](CN(C)Cc3cc(CC(C)C)[nH]n3)C2)cc1 ZINC000011936274 570594058 /nfs/dbraw/zinc/59/40/58/570594058.db2.gz CEAGEJIYAWAGTP-NRFANRHFSA-N 1 1 398.595 4.003 50 0 GIAAMO COc1ccc(CC[N@H+]2CCC[C@@H](CN(C)Cc3cc(CC(C)C)[nH]n3)C2)cc1 ZINC000011936274 570594060 /nfs/dbraw/zinc/59/40/60/570594060.db2.gz CEAGEJIYAWAGTP-NRFANRHFSA-N 1 1 398.595 4.003 50 0 GIAAMO Cc1cccc(C[N@@H+]2CCC[C@]3(CCN(Cc4cnc(N(C)C)s4)C3)C2)c1 ZINC000011951366 570595769 /nfs/dbraw/zinc/59/57/69/570595769.db2.gz JCBSWKBOEUAZEI-QFIPXVFZSA-N 1 1 384.593 4.006 50 0 GIAAMO CCOC(=O)[C@@]1(C/C=C/c2ccccc2)CCC[N@@H+](Cc2cnn(CC)c2)C1 ZINC000011998174 570597189 /nfs/dbraw/zinc/59/71/89/570597189.db2.gz URRBDKDEXKLBGA-UJVYDMDKSA-N 1 1 381.520 4.152 50 0 GIAAMO C[NH+](C)CCNCc1cc(Br)ccc1OCc1cccc(Cl)c1 ZINC000040720424 570605511 /nfs/dbraw/zinc/60/55/11/570605511.db2.gz GXIFPXPXVFEISI-UHFFFAOYSA-N 1 1 397.744 4.333 50 0 GIAAMO Cn1cc(C[N@H+]2CCC[C@H](c3n[nH]cc3-c3cccc(C(F)(F)F)c3)C2)cn1 ZINC000042881765 570623731 /nfs/dbraw/zinc/62/37/31/570623731.db2.gz ZTBTWWADQDCIHL-INIZCTEOSA-N 1 1 389.425 4.209 50 0 GIAAMO COc1ccccc1/C=C/C[N@@H+]1CCC(=O)N(Cc2cccc(Cl)c2)CC1 ZINC000012212680 570627238 /nfs/dbraw/zinc/62/72/38/570627238.db2.gz MMHJBTVUXGMTGG-VMPITWQZSA-N 1 1 384.907 4.096 50 0 GIAAMO Cc1cccc(C2=NN(C(=O)C[NH+]3CCCCC3)[C@H](c3ccccc3F)C2)c1 ZINC000036345445 570627553 /nfs/dbraw/zinc/62/75/53/570627553.db2.gz YNTNTUSPPQQTMG-QFIPXVFZSA-N 1 1 379.479 4.298 50 0 GIAAMO C[C@H]1CCCC[N@H+]1CC(=O)N1N=C(c2ccccc2)C[C@H]1c1ccc(F)cc1 ZINC000036345200 570627622 /nfs/dbraw/zinc/62/76/22/570627622.db2.gz VJJMWQOGIZXVOQ-JTSKRJEESA-N 1 1 379.479 4.378 50 0 GIAAMO CCOC(=O)C[C@H]1CCCC[N@@H+]1Cc1nc(-c2ccc(F)cc2F)oc1C ZINC000012225147 570628519 /nfs/dbraw/zinc/62/85/19/570628519.db2.gz RMVGEPHGUUCSMW-OAHLLOKOSA-N 1 1 378.419 4.236 50 0 GIAAMO CCOC(=O)C[C@H]1CCCC[N@H+]1Cc1nc(-c2ccc(F)cc2F)oc1C ZINC000012225147 570628523 /nfs/dbraw/zinc/62/85/23/570628523.db2.gz RMVGEPHGUUCSMW-OAHLLOKOSA-N 1 1 378.419 4.236 50 0 GIAAMO CCOc1ccc(-c2nc(C[N@H+]3CCC[C@H](C(=O)N(CC)CC)C3)c(C)o2)cc1 ZINC000012302403 570637282 /nfs/dbraw/zinc/63/72/82/570637282.db2.gz UKLXFGXRSKHZLD-IBGZPJMESA-N 1 1 399.535 4.129 50 0 GIAAMO O=C(Nc1ccccc1Oc1cccnc1)[C@@H]1CCC[N@@H+](Cc2cccnc2)C1 ZINC000012308243 570640331 /nfs/dbraw/zinc/64/03/31/570640331.db2.gz DPDATRJYOZEEKZ-LJQANCHMSA-N 1 1 388.471 4.120 50 0 GIAAMO O=C(Nc1ccccc1Oc1cccnc1)[C@H]1CCC[N@@H+](Cc2cccnc2)C1 ZINC000012308244 570640340 /nfs/dbraw/zinc/64/03/40/570640340.db2.gz DPDATRJYOZEEKZ-IBGZPJMESA-N 1 1 388.471 4.120 50 0 GIAAMO COc1ccc(NC(=O)CC[C@H]2CCC[N@@H+](Cc3cccnc3)C2)cc1Cl ZINC000012320276 570642955 /nfs/dbraw/zinc/64/29/55/570642955.db2.gz YGUGVDPYXMLFQJ-MRXNPFEDSA-N 1 1 387.911 4.375 50 0 GIAAMO Cc1c2ccccc2oc1-c1noc(C(=O)NCCC[N@H+](C)C2CCCCC2)n1 ZINC000065009930 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4.159 50 0 GIAAMO O=C(Nc1cccc(-c2cnco2)c1)N1CCC[N@@H+](Cc2cccs2)CC1 ZINC000052470121 570671550 /nfs/dbraw/zinc/67/15/50/570671550.db2.gz CRUQJWYOIKHPEE-UHFFFAOYSA-N 1 1 382.489 4.143 50 0 GIAAMO O=C(CC[NH+]1CCN(c2ccc(O)cc2)CC1)c1ccc(-c2ccccc2)cc1 ZINC000052537674 570672017 /nfs/dbraw/zinc/67/20/17/570672017.db2.gz RBKLMELMUAALHV-UHFFFAOYSA-N 1 1 386.495 4.454 50 0 GIAAMO Cc1cc(C(=O)N2CC[C@@]3(C2)CCC[N@@H+](CCCc2ccccc2)C3)c(C)o1 ZINC000012471363 570672741 /nfs/dbraw/zinc/67/27/41/570672741.db2.gz ZSTHCILFGSAEFR-DEOSSOPVSA-N 1 1 380.532 4.457 50 0 GIAAMO Cc1cc(C)c2c(n1)sc1c2ncnc1N1CC[NH+](Cc2ccccc2)CC1 ZINC000054074900 570676274 /nfs/dbraw/zinc/67/62/74/570676274.db2.gz IFFJJNLDTRGYMT-UHFFFAOYSA-N 1 1 389.528 4.179 50 0 GIAAMO COc1c(C)cc(C(=O)[C@H]2CCC[N@H+](Cc3c(C)nc4sccn34)C2)cc1C ZINC000055099555 570682945 /nfs/dbraw/zinc/68/29/45/570682945.db2.gz JJVXZXKKKPJBJL-KRWDZBQOSA-N 1 1 397.544 4.425 50 0 GIAAMO COc1c(C)cc(C(=O)[C@H]2CCC[N@@H+](Cc3c(C)nc4sccn34)C2)cc1C ZINC000055099555 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380.492 4.205 50 0 GIAAMO CC(=O)c1cc(C[N@@H+]2CCC[C@H](CCC(=O)NCc3ccc(C)o3)C2)cs1 ZINC000012713246 570703196 /nfs/dbraw/zinc/70/31/96/570703196.db2.gz NVZRRHLOIISMDQ-QGZVFWFLSA-N 1 1 388.533 4.161 50 0 GIAAMO CC(=O)c1cc(C[N@H+]2CCC[C@H](CCC(=O)NCc3ccc(C)o3)C2)cs1 ZINC000012713246 570703200 /nfs/dbraw/zinc/70/32/00/570703200.db2.gz NVZRRHLOIISMDQ-QGZVFWFLSA-N 1 1 388.533 4.161 50 0 GIAAMO COc1ccc(-c2nc(C[N@H+](C)C[C@@H]3Cc4ccccc4O3)c(C)o2)cc1C ZINC000012713689 570703681 /nfs/dbraw/zinc/70/36/81/570703681.db2.gz AJMKQHBCAXBYKM-IBGZPJMESA-N 1 1 378.472 4.403 50 0 GIAAMO COc1ccc(-c2nc(C[N@@H+](C)C[C@@H]3Cc4ccccc4O3)c(C)o2)cc1C ZINC000012713689 570703684 /nfs/dbraw/zinc/70/36/84/570703684.db2.gz AJMKQHBCAXBYKM-IBGZPJMESA-N 1 1 378.472 4.403 50 0 GIAAMO CC[N@@H+](CCO)Cc1cn(Cc2ccccc2)nc1-c1cc2ccccc2o1 ZINC000012715814 570704434 /nfs/dbraw/zinc/70/44/34/570704434.db2.gz BVGSEONBVJHLCE-UHFFFAOYSA-N 1 1 375.472 4.159 50 0 GIAAMO Cn1cc([C@@H]2C[C@H]3CN(c4ccccc4)C(=O)[C@]34CCC[N@@H+]24)c(-c2ccccc2)n1 ZINC000012716981 570704981 /nfs/dbraw/zinc/70/49/81/570704981.db2.gz ZUPWGXFLHQRRIL-JTJYXVOQSA-N 1 1 398.510 4.030 50 0 GIAAMO COc1ccccc1-c1nc(C[N@H+](C)Cc2cccc(-n3cccn3)c2)c(C)o1 ZINC000012748344 570709272 /nfs/dbraw/zinc/70/92/72/570709272.db2.gz BFIUJCUSAGTPDV-UHFFFAOYSA-N 1 1 388.471 4.476 50 0 GIAAMO COc1ccccc1-c1nc(C[N@@H+](C)Cc2cccc(-n3cccn3)c2)c(C)o1 ZINC000012748344 570709277 /nfs/dbraw/zinc/70/92/77/570709277.db2.gz BFIUJCUSAGTPDV-UHFFFAOYSA-N 1 1 388.471 4.476 50 0 GIAAMO Cn1c(C[N@@H+]2CCC[C@H](C(=O)Nc3ccccc3Cl)C2)nc2ccccc21 ZINC000247961148 570717831 /nfs/dbraw/zinc/71/78/31/570717831.db2.gz DOYQAEJLBWIRQK-HNNXBMFYSA-N 1 1 382.895 4.077 50 0 GIAAMO Cn1c(C[N@H+]2CCC[C@H](C(=O)Nc3ccccc3Cl)C2)nc2ccccc21 ZINC000247961148 570717832 /nfs/dbraw/zinc/71/78/32/570717832.db2.gz DOYQAEJLBWIRQK-HNNXBMFYSA-N 1 1 382.895 4.077 50 0 GIAAMO Cn1c(C[N@@H+]2CCC[C@@H](C(=O)Nc3ccc(Cl)cc3)C2)nc2ccccc21 ZINC000248080330 570720412 /nfs/dbraw/zinc/72/04/12/570720412.db2.gz OXVFZRIWFJJYFQ-OAHLLOKOSA-N 1 1 382.895 4.077 50 0 GIAAMO Cn1c(C[N@H+]2CCC[C@@H](C(=O)Nc3ccc(Cl)cc3)C2)nc2ccccc21 ZINC000248080330 570720414 /nfs/dbraw/zinc/72/04/14/570720414.db2.gz OXVFZRIWFJJYFQ-OAHLLOKOSA-N 1 1 382.895 4.077 50 0 GIAAMO Cc1cccc(NC(=O)C[NH+]2CCC(c3nc(-c4cccc(F)c4)no3)CC2)c1 ZINC000065184144 570722424 /nfs/dbraw/zinc/72/24/24/570722424.db2.gz OUGCCTOLMWBFGM-UHFFFAOYSA-N 1 1 394.450 4.002 50 0 GIAAMO CCCCN(CCC)C(=O)[C@H]1CCC[N@@H+](Cc2nc3ccccc3n2CC)C1 ZINC000249681522 570722601 /nfs/dbraw/zinc/72/26/01/570722601.db2.gz BKZIIQCWHFKWLH-IBGZPJMESA-N 1 1 384.568 4.307 50 0 GIAAMO O=C(CN1CCC[N@@H+](CC2CCCCC2)CC1)Nc1ccc(F)c(Cl)c1 ZINC000058368497 570729348 /nfs/dbraw/zinc/72/93/48/570729348.db2.gz YCAFABFVCZSEKV-UHFFFAOYSA-N 1 1 381.923 4.006 50 0 GIAAMO Cc1ccccc1C[N@H+]1CCCN(C(=O)c2ccc3[nH]c(C(F)F)nc3c2)CC1 ZINC000058393065 570730664 /nfs/dbraw/zinc/73/06/64/570730664.db2.gz QGBASIBYJDQRDW-UHFFFAOYSA-N 1 1 398.457 4.157 50 0 GIAAMO Cc1ccc(NC(=O)[C@H]2CCC[N@H+](Cc3nc4ccccc4n3C)C2)c(C)c1 ZINC000253612916 570735625 /nfs/dbraw/zinc/73/56/25/570735625.db2.gz OIXYAVLOGBVEBQ-SFHVURJKSA-N 1 1 376.504 4.041 50 0 GIAAMO Cc1ccc(NC(=O)[C@@H]2CCC[N@H+](Cc3nc4ccccc4n3C)C2)c(C)c1 ZINC000253612915 570735647 /nfs/dbraw/zinc/73/56/47/570735647.db2.gz OIXYAVLOGBVEBQ-GOSISDBHSA-N 1 1 376.504 4.041 50 0 GIAAMO C[N@@H+](CCCNC(=O)c1sc2ncccc2c1-n1cccc1)C1CCCCC1 ZINC000033059859 570746916 /nfs/dbraw/zinc/74/69/16/570746916.db2.gz LJSHBTFJMSHPQF-UHFFFAOYSA-N 1 1 396.560 4.471 50 0 GIAAMO Cc1cc(Nc2ccc(NC(=O)c3cccs3)cc2)nc(N2CCCC2)[nH+]1 ZINC000065362062 570759712 /nfs/dbraw/zinc/75/97/12/570759712.db2.gz NKNTYHIADJSUGY-UHFFFAOYSA-N 1 1 379.489 4.443 50 0 GIAAMO C[C@H](c1nc2ccccc2n1C(F)F)N1CC[NH+](Cc2ccsc2)CC1 ZINC000036723525 570805612 /nfs/dbraw/zinc/80/56/12/570805612.db2.gz NNRDEHUSLBANIG-CQSZACIVSA-N 1 1 376.476 4.372 50 0 GIAAMO COc1ccc(NC(=S)N2CCC([N@@H+](C)[C@H]3CCCC[C@H]3C)CC2)cc1 ZINC000004668294 570814479 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385.533 4.276 50 0 GIAAMO O=C(NC[C@@H](c1ccco1)[NH+]1CCCC1)c1cccnc1SC1CCCC1 ZINC000054799556 822913894 /nfs/dbraw/zinc/91/38/94/822913894.db2.gz CPKUTWBEFNVPGP-SFHVURJKSA-N 1 1 385.533 4.276 50 0 GIAAMO O=C(C1CCCC1)N1CCC2(CC1)C[C@@H]([N@@H+](Cc1ccccc1)C1CC1)CCO2 ZINC000169776779 823915704 /nfs/dbraw/zinc/91/57/04/823915704.db2.gz VEIKMLYEZFACCK-QHCPKHFHSA-N 1 1 396.575 4.381 50 0 GIAAMO COc1cccc(C[N@H+]2CCC[C@@H](Cn3c(C)cnc3C3CCOCC3)C2)c1 ZINC000575547751 823976342 /nfs/dbraw/zinc/97/63/42/823976342.db2.gz VFTHUADGSCOJDW-HXUWFJFHSA-N 1 1 383.536 4.006 50 0 GIAAMO CCCCCOc1ccc([C@@H](O)[C@@H](C[NH+]2CCOCC2)c2ccccc2)cc1 ZINC000019314204 210239962 /nfs/dbraw/zinc/23/99/62/210239962.db2.gz TXAXLUUOZDHBRR-BJKOFHAPSA-N 1 1 383.532 4.405 50 0 GIAAMO C[C@@H]([NH2+]CC(=O)Nc1cccc2nsnc21)c1ccc(Cl)cc1Cl ZINC000019110529 210225452 /nfs/dbraw/zinc/22/54/52/210225452.db2.gz WVHBZUZWOLFFID-SECBINFHSA-N 1 1 381.288 4.287 50 0 GIAAMO C[N@@H+](CC(=O)N(Cc1ccco1)CC(F)(F)F)[C@@H]1CCCc2ccccc21 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C[C@@H]1C[C@H](C)C[N@H+](CCCNC(=O)c2ccc3c(c2)nc2c(c3Cl)CCC2)C1 ZINC000005035013 570403620 /nfs/dbraw/zinc/40/36/20/570403620.db2.gz IOZPOLXFWTYGRT-IYBDPMFKSA-N 1 1 399.966 4.475 50 0 GIAAMO COc1ccc([C@H]2CCC[N@@H+]2CC(=O)N[C@@H](C)c2ccc(C)c(C)c2)c(OC)c1 ZINC000012984507 570408403 /nfs/dbraw/zinc/40/84/03/570408403.db2.gz IVXZFRCWVYTUAF-PGRDOPGGSA-N 1 1 396.531 4.335 50 0 GIAAMO COc1ccc([C@H]2CCC[N@H+]2CC(=O)N[C@@H](C)c2ccc(C)c(C)c2)c(OC)c1 ZINC000012984507 570408406 /nfs/dbraw/zinc/40/84/06/570408406.db2.gz IVXZFRCWVYTUAF-PGRDOPGGSA-N 1 1 396.531 4.335 50 0 GIAAMO O=C(C[NH+]1CCC([C@@H](O)c2ccccc2)CC1)Nc1ccccc1C(F)(F)F ZINC000026116362 570422486 /nfs/dbraw/zinc/42/24/86/570422486.db2.gz IZLLUIGLVLWSKT-FQEVSTJZSA-N 1 1 392.421 4.090 50 0 GIAAMO CCOC(=O)c1c(C[NH+]2CCC(O)CC2)nc2ccccc2c1-c1ccccc1 ZINC000029700456 570477955 /nfs/dbraw/zinc/47/79/55/570477955.db2.gz BPXTVHWTQWFZKV-UHFFFAOYSA-N 1 1 390.483 4.035 50 0 GIAAMO Cc1c2cc(F)ccc2oc1C(=O)N1CCC[N@H+](Cc2ccc(F)cc2)CC1 ZINC000029773368 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ZINC000057418574 823293489 /nfs/dbraw/zinc/29/34/89/823293489.db2.gz LLLKKKBOYHFKAD-UHFFFAOYSA-N 1 1 389.474 4.400 50 0 GIAAMO C[C@H]1CCc2sc3ncnc(N4CC[NH+](Cc5ccc(F)cc5)CC4)c3c2C1 ZINC000057469335 823300692 /nfs/dbraw/zinc/30/06/92/823300692.db2.gz ZXAOWKQUPXIAHO-HNNXBMFYSA-N 1 1 396.535 4.277 50 0 GIAAMO CCc1ccc(C[N@H+](C)CC(=O)Nc2c(C)nn(-c3ccccc3)c2C)cc1 ZINC000007790507 817915781 /nfs/dbraw/zinc/91/57/81/817915781.db2.gz BONGZHCUXHTNHA-UHFFFAOYSA-N 1 1 376.504 4.122 50 0 GIAAMO CCc1ccc(C[N@@H+](C)CC(=O)Nc2c(C)nn(-c3ccccc3)c2C)cc1 ZINC000007790507 817915787 /nfs/dbraw/zinc/91/57/87/817915787.db2.gz BONGZHCUXHTNHA-UHFFFAOYSA-N 1 1 376.504 4.122 50 0 GIAAMO Cn1cccc1[C@@H]1CCC[N@@H+]1CC(=O)Nc1ccc(OCc2ccccc2)cc1 ZINC000007853507 817939108 /nfs/dbraw/zinc/93/91/08/817939108.db2.gz FFHPHGQWNSOGDZ-QHCPKHFHSA-N 1 1 389.499 4.380 50 0 GIAAMO Cn1cccc1[C@@H]1CCC[N@H+]1CC(=O)Nc1ccc(OCc2ccccc2)cc1 ZINC000007853507 817939113 /nfs/dbraw/zinc/93/91/13/817939113.db2.gz FFHPHGQWNSOGDZ-QHCPKHFHSA-N 1 1 389.499 4.380 50 0 GIAAMO Cc1onc(-c2ccccc2)c1-c1nnc(C[N@H+]2CCC[C@H]2c2cccn2C)o1 ZINC000007855841 817939819 /nfs/dbraw/zinc/93/98/19/817939819.db2.gz IFWOFSOFRFGEOB-SFHVURJKSA-N 1 1 389.459 4.376 50 0 GIAAMO Cc1onc(-c2ccccc2)c1-c1nnc(C[N@@H+]2CCC[C@H]2c2cccn2C)o1 ZINC000007855841 817939822 /nfs/dbraw/zinc/93/98/22/817939822.db2.gz IFWOFSOFRFGEOB-SFHVURJKSA-N 1 1 389.459 4.376 50 0 GIAAMO O=C(C[N@@H+]1CCC[C@H](c2nc3ccccc3s2)C1)N1CCCc2ccccc21 ZINC000008261895 818026505 /nfs/dbraw/zinc/02/65/05/818026505.db2.gz XTPLYGHUNYEKLD-SFHVURJKSA-N 1 1 391.540 4.455 50 0 GIAAMO O=C(C[N@H+]1CCC[C@H](c2nc3ccccc3s2)C1)N1CCCc2ccccc21 ZINC000008261895 818026514 /nfs/dbraw/zinc/02/65/14/818026514.db2.gz XTPLYGHUNYEKLD-SFHVURJKSA-N 1 1 391.540 4.455 50 0 GIAAMO COc1cccc(C[C@]2(CO)CCC[N@@H+](Cc3cccc4cnccc43)C2)c1 ZINC000011814094 818123418 /nfs/dbraw/zinc/12/34/18/818123418.db2.gz HOBRDOPYGVKRNP-XMMPIXPASA-N 1 1 376.500 4.061 50 0 GIAAMO FC(F)(F)c1cccc(-c2c[nH]nc2C2CC[NH+](Cc3cc[nH]n3)CC2)c1 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Cc1csc(C[N@H+](C)[C@@H]2CCC(=O)N(Cc3ccccc3Cl)CC2)n1 ZINC000020449040 818622392 /nfs/dbraw/zinc/62/23/92/818622392.db2.gz COEDAPAMSDHDHY-MRXNPFEDSA-N 1 1 377.941 4.118 50 0 GIAAMO Fc1ccc(Nc2ncc(C[N@H+]3CCC[C@H](Cn4ccnc4)C3)s2)c(F)c1 ZINC000023340432 818924169 /nfs/dbraw/zinc/92/41/69/818924169.db2.gz YWVWFLHZTUQFNJ-AWEZNQCLSA-N 1 1 389.475 4.274 50 0 GIAAMO CC(C)[N@@H+](C)Cc1cccc(-c2nc([C@@H](C)Oc3ccccc3)cc(=O)[nH]2)c1 ZINC000023505728 818950486 /nfs/dbraw/zinc/95/04/86/818950486.db2.gz SNAIWOZKYNHJBC-QGZVFWFLSA-N 1 1 377.488 4.417 50 0 GIAAMO CC[N@@H+]1CCc2nc(NC(=O)/C=C/c3ccc(Cl)cc3Cl)sc2C1 ZINC000025436666 819979443 /nfs/dbraw/zinc/97/94/43/819979443.db2.gz MRBCULXPDYNUEJ-GQCTYLIASA-N 1 1 382.316 4.480 50 0 GIAAMO CC[N@H+]1CCc2nc(NC(=O)/C=C/c3ccc(Cl)cc3Cl)sc2C1 ZINC000025436666 819979446 /nfs/dbraw/zinc/97/94/46/819979446.db2.gz MRBCULXPDYNUEJ-GQCTYLIASA-N 1 1 382.316 4.480 50 0 GIAAMO C[NH+]1CCN(C(=O)C[C@](C)(c2cccs2)c2cccc(C(F)(F)F)c2)CC1 ZINC000031808776 820863083 /nfs/dbraw/zinc/86/30/83/820863083.db2.gz XFROIOJZXKIHLR-IBGZPJMESA-N 1 1 396.478 4.237 50 0 GIAAMO C[C@@H]1C[C@H](C)C[N@H+](Cc2ccccc2CNC(=O)Nc2nnc(C3CC3)s2)C1 ZINC000040119126 821141529 /nfs/dbraw/zinc/14/15/29/821141529.db2.gz CAZKFHAMSCAPJM-GASCZTMLSA-N 1 1 399.564 4.215 50 0 GIAAMO CCN(C(=O)c1cc2ccc(OC)cc2[nH]1)[C@@H]1CC[N@H+]([C@@H](C)c2ccccc2)C1 ZINC000040158081 821152718 /nfs/dbraw/zinc/15/27/18/821152718.db2.gz ZSOIKDLXWXGAML-FXAWDEMLSA-N 1 1 391.515 4.474 50 0 GIAAMO CC(C)CC[N@@H+](C1CCOCC1)C1CCN(C(=O)Nc2cccc(F)c2)CC1 ZINC000169760592 823912669 /nfs/dbraw/zinc/91/26/69/823912669.db2.gz YCNZCAUQHPINSL-UHFFFAOYSA-N 1 1 391.531 4.349 50 0 GIAAMO O=C(C1CCCC1)N1CCC2(CC1)C[C@H]([N@@H+](Cc1ccccc1)C1CC1)CCO2 ZINC000169776780 823915674 /nfs/dbraw/zinc/91/56/74/823915674.db2.gz VEIKMLYEZFACCK-HSZRJFAPSA-N 1 1 396.575 4.381 50 0 GIAAMO C[N@@H+](Cc1ccccc1)[C@@H]1CCOC2(CCN(C(=O)c3ccsc3)CC2)C1 ZINC000169792414 823916782 /nfs/dbraw/zinc/91/67/82/823916782.db2.gz VKRWNJYFIPTEEQ-HXUWFJFHSA-N 1 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ZINC000015732283 210166062 /nfs/dbraw/zinc/16/60/62/210166062.db2.gz HFXGOUPZTVEGHV-UHFFFAOYSA-N 1 1 383.561 4.437 50 0 GIAAMO CCOc1ccc(C[N@H+]2CCC[C@@](CO)(CCCc3ccccc3)C2)cc1CO ZINC000015074443 210150842 /nfs/dbraw/zinc/15/08/42/210150842.db2.gz HXIWFRRTVGLMSL-VWLOTQADSA-N 1 1 397.559 4.175 50 0 GIAAMO O=C1N(Cc2cccc(Cl)c2)C[C@@H]2C[C@@H](c3ccccc3F)[N@@H+]3CCC[C@@]123 ZINC000015078185 210150460 /nfs/dbraw/zinc/15/04/60/210150460.db2.gz NYUDBOCWGIOCIM-BUKVSMQUSA-N 1 1 384.882 4.417 50 0 GIAAMO COc1cccc(-c2cc3c(c(OC)c2)OCC[N@@H+](C[C@@H]2CC=CCC2)C3)n1 ZINC000014978398 210137524 /nfs/dbraw/zinc/13/75/24/210137524.db2.gz PRDHFNUBDIGVHC-QGZVFWFLSA-N 1 1 380.488 4.317 50 0 GIAAMO O=C1CC[N@@H+](Cc2ccccc2C(F)(F)F)CCN1Cc1cccc(F)c1 ZINC000014969219 210137051 /nfs/dbraw/zinc/13/70/51/210137051.db2.gz AALPXODXGSZCRO-UHFFFAOYSA-N 1 1 380.385 4.079 50 0 GIAAMO O=C1CC[N@H+](Cc2ccccc2C(F)(F)F)CCN1Cc1cccc(F)c1 ZINC000014969219 210137055 /nfs/dbraw/zinc/13/70/55/210137055.db2.gz AALPXODXGSZCRO-UHFFFAOYSA-N 1 1 380.385 4.079 50 0 GIAAMO C[N@H+]1CCC[C@H](COc2cccc(CN(C(=O)c3cccs3)C3CC3)c2)C1 ZINC000014963910 210133206 /nfs/dbraw/zinc/13/32/06/210133206.db2.gz DGUFNJYHQORVIP-SFHVURJKSA-N 1 1 384.545 4.274 50 0 GIAAMO CC(=O)c1ccc(OC[C@H](O)C[N@@H+](C)Cc2ccc(Cl)c(Cl)c2)cc1 ZINC000014238158 210113047 /nfs/dbraw/zinc/11/30/47/210113047.db2.gz XQMOQCBLQQLPBH-MRXNPFEDSA-N 1 1 382.287 4.068 50 0 GIAAMO CC(=O)c1ccc(OC[C@H](O)C[N@H+](C)Cc2ccc(Cl)c(Cl)c2)cc1 ZINC000014238158 210113050 /nfs/dbraw/zinc/11/30/50/210113050.db2.gz XQMOQCBLQQLPBH-MRXNPFEDSA-N 1 1 382.287 4.068 50 0 GIAAMO Cc1nc(-c2cccs2)sc1C(=O)NC[C@@H](c1ccco1)[NH+]1CCCC1 ZINC000014235370 210111873 /nfs/dbraw/zinc/11/18/73/210111873.db2.gz SEJQOEFYNGEUKX-AWEZNQCLSA-N 1 1 387.530 4.340 50 0 GIAAMO O=C(c1ccc[nH]c1=S)N1CC[NH+](Cc2ccc(-c3ccccc3)s2)CC1 ZINC000012971248 210035358 /nfs/dbraw/zinc/03/53/58/210035358.db2.gz TZRKJUMHKJKFSH-UHFFFAOYSA-N 1 1 395.553 4.057 50 0 GIAAMO C[N@H+](CCC(=O)Nc1cccc(F)c1)CC(=O)Nc1c(Cl)cccc1Cl ZINC000012938233 210034049 /nfs/dbraw/zinc/03/40/49/210034049.db2.gz UBTUNYYHAOBPNZ-UHFFFAOYSA-N 1 1 398.265 4.032 50 0 GIAAMO C[N@@H+](CCC(=O)Nc1cccc(F)c1)CC(=O)Nc1c(Cl)cccc1Cl ZINC000012938233 210034054 /nfs/dbraw/zinc/03/40/54/210034054.db2.gz UBTUNYYHAOBPNZ-UHFFFAOYSA-N 1 1 398.265 4.032 50 0 GIAAMO COc1ccc([C@H]2CCCCC[N@H+]2Cc2cc(=O)n3cc(C)ccc3n2)cc1 ZINC000012973944 210037057 /nfs/dbraw/zinc/03/70/57/210037057.db2.gz CIWAWHLWWPDTOK-OAQYLSRUSA-N 1 1 377.488 4.129 50 0 GIAAMO Cc1ccc(NC(=O)C[N@H+](C)CCC(=O)Nc2c(Cl)cccc2Cl)cc1 ZINC000012915781 210027656 /nfs/dbraw/zinc/02/76/56/210027656.db2.gz NJAPHCBZKYXNEN-UHFFFAOYSA-N 1 1 394.302 4.201 50 0 GIAAMO Cc1ccc(NC(=O)C[N@@H+](C)CCC(=O)Nc2c(Cl)cccc2Cl)cc1 ZINC000012915781 210027663 /nfs/dbraw/zinc/02/76/63/210027663.db2.gz NJAPHCBZKYXNEN-UHFFFAOYSA-N 1 1 394.302 4.201 50 0 GIAAMO CC(C)[C@H]([NH2+][C@H](C(=O)N1CCCC1)c1ccccc1)c1ccc2c(c1)OCCO2 ZINC000012913287 210027708 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50 0 GIAAMO COc1ccc(NC(=O)c2ccc(C[N@@H+]3CCn4cccc4[C@H]3C)cc2)cc1 ZINC000012866670 210021096 /nfs/dbraw/zinc/02/10/96/210021096.db2.gz SNFSMIUQHWMWGO-QGZVFWFLSA-N 1 1 375.472 4.326 50 0 GIAAMO COc1ccc(NC(=O)c2ccc(C[N@H+]3CCn4cccc4[C@H]3C)cc2)cc1 ZINC000012866670 210021101 /nfs/dbraw/zinc/02/11/01/210021101.db2.gz SNFSMIUQHWMWGO-QGZVFWFLSA-N 1 1 375.472 4.326 50 0 GIAAMO O[C@@H](Cc1ccccc1)C1CC[NH+](Cc2nc(-c3ccc(Cl)cc3)no2)CC1 ZINC000012835780 210016630 /nfs/dbraw/zinc/01/66/30/210016630.db2.gz KSBTVASEMCEOTO-FQEVSTJZSA-N 1 1 397.906 4.206 50 0 GIAAMO CCOc1ccccc1-c1nc(C[NH+]2CCC(C(=O)N(CC)CC)CC2)c(C)o1 ZINC000012072974 209903201 /nfs/dbraw/zinc/90/32/01/209903201.db2.gz HTIZYAMBBWKAIM-UHFFFAOYSA-N 1 1 399.535 4.129 50 0 GIAAMO COc1ccc(C(=O)[C@H]2CCC[N@@H+](Cc3cccc4cccnc43)C2)cc1OC ZINC000011879665 209890059 /nfs/dbraw/zinc/89/00/59/209890059.db2.gz KTVBVZBHMAXCQW-FQEVSTJZSA-N 1 1 390.483 4.347 50 0 GIAAMO CCn1cc(C[N@H+]2CCC[C@H](C(=O)Nc3ccc(-c4ccco4)cc3)C2)c(C)n1 ZINC000011815688 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396.299 4.362 50 0 GIAAMO CCOC(=O)c1cc(Br)cnc1[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000097436604 211365204 /nfs/dbraw/zinc/36/52/04/211365204.db2.gz JKSPKNPZSFTHNK-OAHLLOKOSA-N 1 1 389.293 4.010 50 0 GIAAMO CC[NH+]1CCN(C(=O)C[C@H](CCc2ccccc2)c2c[nH]c3ccccc32)CC1 ZINC000096275652 211328489 /nfs/dbraw/zinc/32/84/89/211328489.db2.gz KTKWTZMWSPOBEM-NRFANRHFSA-N 1 1 389.543 4.439 50 0 GIAAMO COc1ccccc1-c1ccc(NC(=O)N2CC([N@H+]3CCCC[C@H]3C)C2)cc1 ZINC000096165075 211316791 /nfs/dbraw/zinc/31/67/91/211316791.db2.gz WCAILFKOZCKYNN-QGZVFWFLSA-N 1 1 379.504 4.453 50 0 GIAAMO CN(C[C@]1(C)CC[N@@H+](C)C1)C(=O)Nc1ccc2oc(-c3ccccc3)nc2c1 ZINC000096151024 211311399 /nfs/dbraw/zinc/31/13/99/211311399.db2.gz HMUXOMZTMDBCAX-JOCHJYFZSA-N 1 1 378.476 4.300 50 0 GIAAMO C[C@@H]1CCCC[N@H+]1Cc1cccc(NC(=O)N2CCC(c3cc[nH]n3)CC2)c1 ZINC000096151459 211311145 /nfs/dbraw/zinc/31/11/45/211311145.db2.gz PVERKIKIRYWBSN-QGZVFWFLSA-N 1 1 381.524 4.196 50 0 GIAAMO C[C@@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)c1ccc(Sc2ccc(Cl)cc2)o1 ZINC000096012407 211294915 /nfs/dbraw/zinc/29/49/15/211294915.db2.gz XPAAYKNJEAYROX-UKRRQHHQSA-N 1 1 376.909 4.393 50 0 GIAAMO CCc1ccc(C(=O)N(C)C[C@H]2CCC[N@@H+](CCc3ccc(Cl)cc3)C2)[nH]1 ZINC000095524204 211270947 /nfs/dbraw/zinc/27/09/47/211270947.db2.gz MMGQIVXYTVXWFP-GOSISDBHSA-N 1 1 387.955 4.257 50 0 GIAAMO CCOc1ccc(C[N@H+]2C[C@@H](c3ccc(OC)cc3)[C@@H]3[C@H]2C2CCN3CC2)cc1 ZINC000095386554 211234354 /nfs/dbraw/zinc/23/43/54/211234354.db2.gz ZYLBIPFSTIAOQP-ISJGIBHGSA-N 1 1 392.543 4.156 50 0 GIAAMO COc1cccc(C[N@H+]2C[C@@H](c3cccc(F)c3F)[C@@H]3[C@H]2C2CCN3CC2)c1 ZINC000095365795 211225059 /nfs/dbraw/zinc/22/50/59/211225059.db2.gz UDNWPPHATIVKCY-WWPVKYPJSA-N 1 1 384.470 4.036 50 0 GIAAMO O=C1N(CC2CC2)CCC[C@]12CC[N@H+](Cc1ccc(F)c(C(F)(F)F)c1)C2 ZINC000091757482 211206340 /nfs/dbraw/zinc/20/63/40/211206340.db2.gz LIXDJMYYJZHLLJ-LJQANCHMSA-N 1 1 384.417 4.069 50 0 GIAAMO O=C(c1cccc(Br)c1)c1ccccc1C[NH+]1CCSCC1 ZINC000085651649 211177834 /nfs/dbraw/zinc/17/78/34/211177834.db2.gz DZJQNFBDGQKAKN-UHFFFAOYSA-N 1 1 376.319 4.229 50 0 GIAAMO O=C(c1ccc(F)cc1Cl)c1ccccc1C[NH+]1CCC2(CC1)OCCO2 ZINC000085651598 211177326 /nfs/dbraw/zinc/17/73/26/211177326.db2.gz DMNWIIKKZPUCKP-UHFFFAOYSA-N 1 1 389.854 4.049 50 0 GIAAMO CCN(C(=O)Nc1ccc2c(c1)OCCO2)[C@@H]1CC[N@H+]([C@@H](C)c2ccccc2)C1 ZINC000079021028 211153173 /nfs/dbraw/zinc/15/31/73/211153173.db2.gz YIFOZCADIQZFJR-FXAWDEMLSA-N 1 1 395.503 4.147 50 0 GIAAMO COc1ccc(-c2nc3cc(C)ccc3cc2C[N@H+]2CCC[C@@H]2CO)cc1OC ZINC000072479654 211123666 /nfs/dbraw/zinc/12/36/66/211123666.db2.gz MVMARCIXPCISRU-HXUWFJFHSA-N 1 1 392.499 4.184 50 0 GIAAMO CN(Cc1cn(-c2ccc(F)cc2)nc1-c1ccccc1Cl)[C@H]1CC[N@@H+](C)C1 ZINC000072457388 211123241 /nfs/dbraw/zinc/12/32/41/211123241.db2.gz FZYJMLBWFIIACQ-IBGZPJMESA-N 1 1 398.913 4.468 50 0 GIAAMO CN1CC[C@H]([N@H+](C)Cc2cn(-c3ccc(F)cc3)nc2-c2ccccc2Cl)C1 ZINC000072457388 211123242 /nfs/dbraw/zinc/12/32/42/211123242.db2.gz FZYJMLBWFIIACQ-IBGZPJMESA-N 1 1 398.913 4.468 50 0 GIAAMO CN1CC[C@H]([N@@H+](C)Cc2cn(-c3ccc(F)cc3)nc2-c2ccccc2Cl)C1 ZINC000072457388 211123248 /nfs/dbraw/zinc/12/32/48/211123248.db2.gz FZYJMLBWFIIACQ-IBGZPJMESA-N 1 1 398.913 4.468 50 0 GIAAMO COc1ccc(-c2nc3cc(C)ccc3cc2C[N@@H+](C)[C@@H]2CCN(C)C2)cc1 ZINC000072467824 211122722 /nfs/dbraw/zinc/12/27/22/211122722.db2.gz HNAQXLLADYWAMS-OAQYLSRUSA-N 1 1 375.516 4.355 50 0 GIAAMO COc1ccc(-c2nc3cc(C)ccc3cc2CN(C)[C@@H]2CC[N@H+](C)C2)cc1 ZINC000072467824 211122728 /nfs/dbraw/zinc/12/27/28/211122728.db2.gz HNAQXLLADYWAMS-OAQYLSRUSA-N 1 1 375.516 4.355 50 0 GIAAMO COc1ccc(-c2nc3cc(C)ccc3cc2CN(C)[C@@H]2CC[N@@H+](C)C2)cc1 ZINC000072467824 211122732 /nfs/dbraw/zinc/12/27/32/211122732.db2.gz HNAQXLLADYWAMS-OAQYLSRUSA-N 1 1 375.516 4.355 50 0 GIAAMO COc1cccc(-c2nc3cc(SC)ccc3cc2C[NH+]2CCN(C)CC2)c1 ZINC000072435365 211120485 /nfs/dbraw/zinc/12/04/85/211120485.db2.gz OHBCAYPQFUDTQO-UHFFFAOYSA-N 1 1 393.556 4.380 50 0 GIAAMO COc1ccc([C@H]2CCCN2C(=O)[C@@H]2CC[N@H+](C3CCCCC3)C2)c(OC)c1 ZINC000072312738 211089071 /nfs/dbraw/zinc/08/90/71/211089071.db2.gz PALRWKDXEPKPEB-DYESRHJHSA-N 1 1 386.536 4.022 50 0 GIAAMO COc1ccnc(C[N@H+]2CCC[C@H](CCc3ccc(F)cc3F)C2)c1OC ZINC000072157450 211077270 /nfs/dbraw/zinc/07/72/70/211077270.db2.gz RBDYWHHZAKBSIE-OAHLLOKOSA-N 1 1 376.447 4.222 50 0 GIAAMO Cc1[nH+]ccn1CC(=O)N1CCC[C@@H](CCc2ccccc2C(F)(F)F)C1 ZINC000071721388 211052436 /nfs/dbraw/zinc/05/24/36/211052436.db2.gz KWPASRLNHJQDGP-INIZCTEOSA-N 1 1 379.426 4.082 50 0 GIAAMO CCc1nc(C)c(C(=O)N2CCC[N@@H+](Cc3ccc(F)cc3)[C@H](C(C)C)C2)o1 ZINC000071708032 211051858 /nfs/dbraw/zinc/05/18/58/211051858.db2.gz WIMBIIYMAGBZFM-IBGZPJMESA-N 1 1 387.499 4.057 50 0 GIAAMO Cc1c(O)cccc1C(=O)N1CCC[N@@H+](Cc2ccc(F)cc2)[C@@H](C(C)C)C1 ZINC000071750698 211056300 /nfs/dbraw/zinc/05/63/00/211056300.db2.gz UPPYEDZMKNFILA-OAQYLSRUSA-N 1 1 384.495 4.212 50 0 GIAAMO CCc1ccc(C[N@H+]2CCC(=O)N(Cc3ccc(F)cc3)[C@H](C(C)C)C2)nc1 ZINC000071615144 211050507 /nfs/dbraw/zinc/05/05/07/211050507.db2.gz ZDDUJCBGESMWND-QFIPXVFZSA-N 1 1 383.511 4.042 50 0 GIAAMO COc1ccc2cc([C@H]3C[N@H+](Cc4ccc(O)c(OC)c4)CCO3)ccc2c1 ZINC000071439958 211049612 /nfs/dbraw/zinc/04/96/12/211049612.db2.gz XSBDDQVYXLZKDQ-HSZRJFAPSA-N 1 1 379.456 4.136 50 0 GIAAMO COc1ccc2cc([C@H]3C[N@@H+](Cc4ccc(O)c(OC)c4)CCO3)ccc2c1 ZINC000071439958 211049614 /nfs/dbraw/zinc/04/96/14/211049614.db2.gz XSBDDQVYXLZKDQ-HSZRJFAPSA-N 1 1 379.456 4.136 50 0 GIAAMO Cc1cc(Cl)ccc1C(=O)[C@@H]1CCC[N@@H+](Cc2ccccc2OCCO)C1 ZINC000071422261 211049183 /nfs/dbraw/zinc/04/91/83/211049183.db2.gz KBVLOMNWEZQBSL-GOSISDBHSA-N 1 1 387.907 4.114 50 0 GIAAMO OCCOc1ccccc1C[N@H+]1CCC[C@@H](CCc2ccc(F)c(F)c2)C1 ZINC000071479535 211048436 /nfs/dbraw/zinc/04/84/36/211048436.db2.gz MJNWGEKTGZOYMO-SFHVURJKSA-N 1 1 375.459 4.181 50 0 GIAAMO Cc1nn(-c2ccccc2)c(C)c1NC(=O)CC[N@H+]1CC[C@@H](c2ccccc2)C1 ZINC000069873521 211040488 /nfs/dbraw/zinc/04/04/88/211040488.db2.gz ZBCXYZWMEIHNOF-OAQYLSRUSA-N 1 1 388.515 4.307 50 0 GIAAMO Cc1ccc(/C=C/S(=O)(=O)N2CCC(Cn3cc[nH+]c3C(C)C)CC2)cc1 ZINC000090560550 211035561 /nfs/dbraw/zinc/03/55/61/211035561.db2.gz ZIHIWAPNRCSOMY-XNTDXEJSSA-N 1 1 387.549 4.028 50 0 GIAAMO Cc1ccc([C@@H](Cn2cnc(-c3ccccc3)c2-c2[nH]cnc2C)[NH+](C)C)o1 ZINC000067820491 211023422 /nfs/dbraw/zinc/02/34/22/211023422.db2.gz DKKCQJAJLPKUGB-GOSISDBHSA-N 1 1 375.476 4.453 50 0 GIAAMO COc1ccc(C[N@@H+](Cc2ccco2)C[C@@H](O)COc2ccccc2C)cc1 ZINC000036102125 210709602 /nfs/dbraw/zinc/70/96/02/210709602.db2.gz DKHOWSXAQCXVJL-HXUWFJFHSA-N 1 1 381.472 4.039 50 0 GIAAMO COc1ccc(C[N@H+](Cc2ccco2)C[C@@H](O)COc2ccccc2C)cc1 ZINC000036102125 210709605 /nfs/dbraw/zinc/70/96/05/210709605.db2.gz DKHOWSXAQCXVJL-HXUWFJFHSA-N 1 1 381.472 4.039 50 0 GIAAMO Cc1c(-c2ccccc2)sc2ncnc(NCC(C)(C)[NH+]3CCOCC3)c12 ZINC000023995895 210457025 /nfs/dbraw/zinc/45/70/25/210457025.db2.gz BVLRLZPRVSXQIZ-UHFFFAOYSA-N 1 1 382.533 4.189 50 0 GIAAMO Cc1ccc([C@H](CNC(=O)c2cc(-c3ccc(Cl)cc3)on2)[NH+]2CCCC2)o1 ZINC000021659808 210387737 /nfs/dbraw/zinc/38/77/37/210387737.db2.gz SVVVACKYOPFZAN-SFHVURJKSA-N 1 1 399.878 4.463 50 0 GIAAMO Cc1cccc([C@H](CC(=O)N2CC[NH+](Cc3ccccc3)CC2)n2cccc2)c1 ZINC000020999051 210374549 /nfs/dbraw/zinc/37/45/49/210374549.db2.gz TTYFAQLBJITCIH-DEOSSOPVSA-N 1 1 387.527 4.120 50 0 GIAAMO CC(C)[C@](O)(c1ccc(F)cc1)[C@@H](C[NH+]1CCOCC1)c1ccc(Cl)cc1 ZINC000020868382 210365001 /nfs/dbraw/zinc/36/50/01/210365001.db2.gz SEXQPFLANHPCNH-VXKWHMMOSA-N 1 1 391.914 4.439 50 0 GIAAMO CC(C)NC(=O)c1ccc([C@@H]2CCC[N@@H+]2Cc2ccc3nsnc3c2)s1 ZINC000020868035 210364750 /nfs/dbraw/zinc/36/47/50/210364750.db2.gz PFXLWWMFIRCNLI-INIZCTEOSA-N 1 1 386.546 4.228 50 0 GIAAMO CC(C)NC(=O)c1ccc([C@@H]2CCC[N@H+]2Cc2ccc3nsnc3c2)s1 ZINC000020868035 210364751 /nfs/dbraw/zinc/36/47/51/210364751.db2.gz PFXLWWMFIRCNLI-INIZCTEOSA-N 1 1 386.546 4.228 50 0 GIAAMO CC[C@@](O)(c1ccc(F)cc1)[C@H](C[NH+]1CCOCC1)c1ccc(Cl)cc1 ZINC000020868365 210364246 /nfs/dbraw/zinc/36/42/46/210364246.db2.gz QQJSDJFZMAJBAI-NHCUHLMSSA-N 1 1 377.887 4.193 50 0 GIAAMO Cc1c2cccc(C)c2[nH]c1CN1CCC[C@H]([N@@H+](C)CCc2ccccn2)C1 ZINC000020775741 210361300 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50 0 GIAAMO Cc1ccccc1-c1ncc(CN[C@@H]2CCC[N@H+](C3Cc4ccccc4C3)C2)cn1 ZINC000020598751 210350189 /nfs/dbraw/zinc/35/01/89/210350189.db2.gz MJFKAWLBTWYJCK-HSZRJFAPSA-N 1 1 398.554 4.173 50 0 GIAAMO FC(F)(F)c1cccc(-c2c[nH]nc2[C@H]2CCC[N@@H+](Cc3cc[nH]n3)C2)c1 ZINC000020540831 210346110 /nfs/dbraw/zinc/34/61/10/210346110.db2.gz QPSCAMWDJWRAMJ-AWEZNQCLSA-N 1 1 375.398 4.198 50 0 GIAAMO Cc1c(Cl)ccc2c(C(=O)N3CC[NH+](C)CC3)cc(-c3ccccc3)nc12 ZINC000020295470 210326840 /nfs/dbraw/zinc/32/68/40/210326840.db2.gz IEMJVVQLLFNUDS-UHFFFAOYSA-N 1 1 379.891 4.251 50 0 GIAAMO C[C@H](NC(=O)c1ccco1)[C@@H](c1cccs1)[NH+]1CCN(c2ccccc2)CC1 ZINC000020288495 210326554 /nfs/dbraw/zinc/32/65/54/210326554.db2.gz WHNZMWHKFAUTNW-UWJYYQICSA-N 1 1 395.528 4.023 50 0 GIAAMO c1ccc(N2CCN([C@@H]3CCC[N@@H+](C4C5CC6CC(C5)CC4C6)C3)CC2)cc1 ZINC000020231871 210324380 /nfs/dbraw/zinc/32/43/80/210324380.db2.gz NYHSYLLWJIOOLU-OZNCPOJCSA-N 1 1 379.592 4.098 50 0 GIAAMO Fc1ccccc1N1CCN([C@H]2CCC[N@H+](C3C4CC5CC(C4)CC3C5)C2)CC1 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Cc1csc(C[N@H+](C)C2CCN(c3cccc(-c4ccnc(C)n4)c3)CC2)n1 ZINC000063857122 136156555 /nfs/dbraw/zinc/15/65/55/136156555.db2.gz WFMNEWSUWOEGDB-UHFFFAOYSA-N 1 1 393.560 4.318 50 0 GIAAMO Cc1ccc(N2CCC3(CCC[N@H+]3Cc3ccc([C@@H]4CCCO4)s3)CC2)nn1 ZINC000072424262 136169802 /nfs/dbraw/zinc/16/98/02/136169802.db2.gz LQQFKZBPZLMXEH-IBGZPJMESA-N 1 1 398.576 4.333 50 0 GIAAMO c1cn(Cc2cscn2)c([C@H]2CCCN(c3ccc4ccccc4n3)C2)[nH+]1 ZINC000095526395 136181517 /nfs/dbraw/zinc/18/15/17/136181517.db2.gz ULWBIFXYTFCGHN-KRWDZBQOSA-N 1 1 375.501 4.320 50 0 GIAAMO Cc1ccc(N2CC[NH+](Cc3cccc(C(=O)NCc4ccccc4)c3)CC2)cc1 ZINC000096280591 136186054 /nfs/dbraw/zinc/18/60/54/136186054.db2.gz YHUNATRXUJIMKK-UHFFFAOYSA-N 1 1 399.538 4.247 50 0 GIAAMO Cn1c(C(=O)N2CCCC3=C[C@@H]4C[C@@H](C[N@H+]5CCCC[C@H]45)[C@@H]32)cc2ccccc21 ZINC000409413538 534678624 /nfs/dbraw/zinc/67/86/24/534678624.db2.gz BZWKNVPOTFOSOP-DAVFGYKESA-N 1 1 389.543 4.214 50 0 GIAAMO COc1ccc(C[NH+]2CCN(c3cccc(C(F)(F)F)c3)CC2)cc1OC ZINC000000752289 524034128 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C[NH+](C)[C@@H](CNC(=O)Nc1ccccc1N1CCCC1)c1ccccc1Cl ZINC000048303262 570231501 /nfs/dbraw/zinc/23/15/01/570231501.db2.gz YPRRHOJJPKVPMS-FQEVSTJZSA-N 1 1 386.927 4.365 50 0 GIAAMO C[N@H+](CC(=O)N1CCc2sccc2[C@H]1c1ccccc1)Cc1ccccc1 ZINC000048340666 570239021 /nfs/dbraw/zinc/23/90/21/570239021.db2.gz CAXXTYFJDOVGPL-HSZRJFAPSA-N 1 1 376.525 4.354 50 0 GIAAMO C[N@@H+](CC(=O)N1CCc2sccc2[C@H]1c1ccccc1)Cc1ccccc1 ZINC000048340666 570239022 /nfs/dbraw/zinc/23/90/22/570239022.db2.gz CAXXTYFJDOVGPL-HSZRJFAPSA-N 1 1 376.525 4.354 50 0 GIAAMO COc1cccc(C[N@@H+](C)C[C@@H](O)COc2ccc(-c3ccccc3)cc2)c1 ZINC000022240782 570309900 /nfs/dbraw/zinc/30/99/00/570309900.db2.gz FQLINUOWZIKRRO-JOCHJYFZSA-N 1 1 377.484 4.234 50 0 GIAAMO CCOc1ccccc1C(=O)N1CC[NH+](Cc2csc3ccccc23)CC1 ZINC000022426807 570316767 /nfs/dbraw/zinc/31/67/67/570316767.db2.gz VRPCBQOETRXQNS-UHFFFAOYSA-N 1 1 380.513 4.258 50 0 GIAAMO CC(C)C[N@@H+](Cc1ccc(F)cc1)Cc1cc(=O)n2nc(C(C)C)sc2n1 ZINC000035509774 570381945 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399.491 4.084 50 0 GIAAMO Cc1c(C(=O)NCC2([NH+]3CCOCC3)CCCCC2)oc2cc(C)cc(C)c12 ZINC000027580370 570436228 /nfs/dbraw/zinc/43/62/28/570436228.db2.gz UWCSUKIUGRGHAW-UHFFFAOYSA-N 1 1 384.520 4.123 50 0 GIAAMO CN(C)C(=O)c1cccc(CN2CCC[C@@H]2[C@H]2CCC[N@H+]2Cc2ccccc2)c1 ZINC000248036362 570436299 /nfs/dbraw/zinc/43/62/99/570436299.db2.gz UVYRWEOXXMGJIK-DNQXCXABSA-N 1 1 391.559 4.017 50 0 GIAAMO CCC(=O)N(c1ccc(OC)cc1)C1CC[NH+](Cc2ccc(F)cc2F)CC1 ZINC000037587650 570444073 /nfs/dbraw/zinc/44/40/73/570444073.db2.gz JNSASXFIGZMMOV-UHFFFAOYSA-N 1 1 388.458 4.381 50 0 GIAAMO Cc1ccc2nc(C)cc(C(=O)N3CCC[N@@H+](Cc4cccs4)CC3)c2c1 ZINC000028036602 570449878 /nfs/dbraw/zinc/44/98/78/570449878.db2.gz XGAMXHPMJNVCIX-UHFFFAOYSA-N 1 1 379.529 4.261 50 0 GIAAMO Cc1cccc(C(=O)Nc2ccc(N3CC[NH+](Cc4cccs4)CC3)nc2)c1 ZINC000035843126 570463780 /nfs/dbraw/zinc/46/37/80/570463780.db2.gz IONSTOIAZFLCBY-UHFFFAOYSA-N 1 1 392.528 4.026 50 0 GIAAMO COc1cc(C(=O)Nc2nc(C[NH+]3CCCCCC3)cs2)cc(OC)c1C ZINC000029634210 570477122 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/nfs/dbraw/zinc/15/32/53/210153253.db2.gz RQCALOABTPWURX-IBGZPJMESA-N 1 1 381.520 4.338 50 0 GIAAMO O=C(c1cccc2ccccc21)[C@H]1CCC[N@H+](Cc2cccc(OCCO)c2)C1 ZINC000015080669 210153220 /nfs/dbraw/zinc/15/32/20/210153220.db2.gz YSBFQNNGFKVDSV-NRFANRHFSA-N 1 1 389.495 4.306 50 0 GIAAMO COc1cccc(CN2C[C@@H]3C[C@@H](c4ccc(C)s4)[N@H+]4CCC[C@@]34C2=O)c1 ZINC000015073577 210150903 /nfs/dbraw/zinc/15/09/03/210150903.db2.gz UCBHGVRMVFVOQY-JLMWRMLUSA-N 1 1 382.529 4.003 50 0 GIAAMO Cn1cc(C[N@H+]2CCC[C@H](OCc3cccnc3)C2)c(-c2cccc(Cl)c2)n1 ZINC000015068475 210148680 /nfs/dbraw/zinc/14/86/80/210148680.db2.gz XLGOWSSFDCHHSE-NRFANRHFSA-N 1 1 396.922 4.317 50 0 GIAAMO CCn1nc(C)c(C[N@H+]2CCC[C@@H](c3n[nH]cc3-c3ccc(F)cc3)C2)c1C ZINC000015005274 210143060 /nfs/dbraw/zinc/14/30/60/210143060.db2.gz JVZLQFYVGDWTFX-GOSISDBHSA-N 1 1 381.499 4.429 50 0 GIAAMO COc1cccc(-c2nn(-c3ccccc3)cc2C[N@H+]2CCCC[C@H]2CCO)c1 ZINC000014973369 210136756 /nfs/dbraw/zinc/13/67/56/210136756.db2.gz JABSCELYNYQHTQ-NRFANRHFSA-N 1 1 391.515 4.285 50 0 GIAAMO O=C(Nc1cccc(-n2cccn2)c1)[C@@H]1CCC[N@@H+](C/C=C/c2ccccc2)C1 ZINC000014961601 210133672 /nfs/dbraw/zinc/13/36/72/210133672.db2.gz MBXWHVBZEXRQPK-BSDIHXDHSA-N 1 1 386.499 4.236 50 0 GIAAMO CSc1ccc(C(=O)[C@@H]2CCC[N@@H+](Cc3cccn3-c3ncccn3)C2)cc1 ZINC000014950017 210131261 /nfs/dbraw/zinc/13/12/61/210131261.db2.gz YIRQQYUUJGADEN-GOSISDBHSA-N 1 1 392.528 4.084 50 0 GIAAMO COc1ccccc1C[N@H+]1CCCN(c2nc(C)c3cc(C)c(C)cc3n2)CC1 ZINC000014879546 210128631 /nfs/dbraw/zinc/12/86/31/210128631.db2.gz NZFKATGLDNTUOM-UHFFFAOYSA-N 1 1 390.531 4.276 50 0 GIAAMO C[C@H]([NH2+]CC(=O)Nc1ccccc1C(=O)NC1CCCC1)c1ccccc1Cl ZINC000014135179 210104892 /nfs/dbraw/zinc/10/48/92/210104892.db2.gz OPNHCRJYXUAWSU-HNNXBMFYSA-N 1 1 399.922 4.302 50 0 GIAAMO COc1ccc(C[N@H+](C)[C@H](C)C(=O)Nc2ccc(C(F)(F)F)cc2)cc1OC ZINC000013096217 210051660 /nfs/dbraw/zinc/05/16/60/210051660.db2.gz ZWAMYOIIQXIOPU-CYBMUJFWSA-N 1 1 396.409 4.182 50 0 GIAAMO COc1ccc(C[N@@H+](C)[C@H](C)C(=O)Nc2ccc(C(F)(F)F)cc2)cc1OC ZINC000013096217 210051663 /nfs/dbraw/zinc/05/16/63/210051663.db2.gz ZWAMYOIIQXIOPU-CYBMUJFWSA-N 1 1 396.409 4.182 50 0 GIAAMO COc1cc(/C=C/C(=O)N2CC[N@H+](C)C[C@H]2c2ccccc2)ccc1OC(C)C ZINC000013013076 210047561 /nfs/dbraw/zinc/04/75/61/210047561.db2.gz SODQXTOCIBGQEP-KONDSOJQSA-N 1 1 394.515 4.011 50 0 GIAAMO COc1cc(/C=C/C(=O)N2CC[N@@H+](C)C[C@H]2c2ccccc2)ccc1OC(C)C ZINC000013013076 210047564 /nfs/dbraw/zinc/04/75/64/210047564.db2.gz SODQXTOCIBGQEP-KONDSOJQSA-N 1 1 394.515 4.011 50 0 GIAAMO Cc1ccc(NC(=O)C[N@@H+]2CCC[C@H]2c2ccc3c(c2)OCCCO3)cc1C ZINC000012992606 210042143 /nfs/dbraw/zinc/04/21/43/210042143.db2.gz TZFXUFCVOYUZAB-FQEVSTJZSA-N 1 1 380.488 4.240 50 0 GIAAMO Cc1ccc(NC(=O)C[N@H+]2CCC[C@H]2c2ccc3c(c2)OCCCO3)cc1C ZINC000012992606 210042149 /nfs/dbraw/zinc/04/21/49/210042149.db2.gz TZFXUFCVOYUZAB-FQEVSTJZSA-N 1 1 380.488 4.240 50 0 GIAAMO C[N@H+](CC(=O)NCCc1ccc(F)cc1)[C@H](c1ccccc1)c1ccc(F)cc1 ZINC000012987708 210041505 /nfs/dbraw/zinc/04/15/05/210041505.db2.gz AFPGAUVBOWGXNO-XMMPIXPASA-N 1 1 394.465 4.345 50 0 GIAAMO C[N@@H+](CC(=O)NCCc1ccc(F)cc1)[C@H](c1ccccc1)c1ccc(F)cc1 ZINC000012987708 210041509 /nfs/dbraw/zinc/04/15/09/210041509.db2.gz AFPGAUVBOWGXNO-XMMPIXPASA-N 1 1 394.465 4.345 50 0 GIAAMO C[C@H](C(=O)Nc1cc(Cl)ccc1Cl)[N@H+](C)Cc1ccc2c(c1)OCCO2 ZINC000012985263 210040881 /nfs/dbraw/zinc/04/08/81/210040881.db2.gz VIIHMBCUELFOBD-GFCCVEGCSA-N 1 1 395.286 4.224 50 0 GIAAMO C[C@H](C(=O)Nc1cc(Cl)ccc1Cl)[N@@H+](C)Cc1ccc2c(c1)OCCO2 ZINC000012985263 210040887 /nfs/dbraw/zinc/04/08/87/210040887.db2.gz VIIHMBCUELFOBD-GFCCVEGCSA-N 1 1 395.286 4.224 50 0 GIAAMO Cc1cccc(NC(=O)NC(=O)C[N@@H+]2CCc3sccc3[C@H]2C2CC2)c1C ZINC000012916899 210027170 /nfs/dbraw/zinc/02/71/70/210027170.db2.gz YHCYQSYIUSHIPN-HXUWFJFHSA-N 1 1 383.517 4.022 50 0 GIAAMO Cc1cccc(NC(=O)NC(=O)C[N@H+]2CCc3sccc3[C@H]2C2CC2)c1C ZINC000012916899 210027177 /nfs/dbraw/zinc/02/71/77/210027177.db2.gz YHCYQSYIUSHIPN-HXUWFJFHSA-N 1 1 383.517 4.022 50 0 GIAAMO COc1ccc([C@@H]([NH2+]CC(=O)Nc2cc(C)ccc2OC)c2ccccc2)cc1 ZINC000012858375 210019302 /nfs/dbraw/zinc/01/93/02/210019302.db2.gz OQQQLURBZFZZAK-DEOSSOPVSA-N 1 1 390.483 4.330 50 0 GIAAMO Cc1cc(NC(=O)C[NH2+][C@@H](C)c2ccccc2Cl)n(-c2ccccc2C)n1 ZINC000012800424 210011392 /nfs/dbraw/zinc/01/13/92/210011392.db2.gz DZSAFAFCOCVFFG-INIZCTEOSA-N 1 1 382.895 4.432 50 0 GIAAMO O=C(N[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1cccc(OCc2ccccc2)c1 ZINC000012798325 210010806 /nfs/dbraw/zinc/01/08/06/210010806.db2.gz PXVHOKCXVKBPLI-HSZRJFAPSA-N 1 1 386.495 4.270 50 0 GIAAMO COc1ccc(C[NH2+][C@H](C)c2cnn(-c3ccc(F)cc3F)c2C)c(F)c1 ZINC000011662974 209876320 /nfs/dbraw/zinc/87/63/20/209876320.db2.gz XVGIUIWBEXXSIZ-GFCCVEGCSA-N 1 1 375.394 4.457 50 0 GIAAMO CC(=O)c1cc(CCC(=O)NCc2ccc(C[N@@H+]3CCCC[C@@H]3C)cc2)oc1C ZINC000036397836 209840878 /nfs/dbraw/zinc/84/08/78/209840878.db2.gz BXNRJBDEXZNHQB-KRWDZBQOSA-N 1 1 396.531 4.414 50 0 GIAAMO Cc1ccccc1CNC(=O)C[NH+]1CCC(c2nc3ccccc3s2)CC1 ZINC000006978712 209712464 /nfs/dbraw/zinc/71/24/64/209712464.db2.gz MNKAKTGSWNADIZ-UHFFFAOYSA-N 1 1 379.529 4.101 50 0 GIAAMO COc1ccc([C@@H]2C3=C([NH+]=C4N=CNN42)c2ccccc2O[C@@H]3CC(C)C)cc1 ZINC000002542253 209369849 /nfs/dbraw/zinc/36/98/49/209369849.db2.gz HBYDFRGNCNYXCZ-DENIHFKCSA-N 1 1 388.471 4.173 50 0 GIAAMO O=C(c1ccco1)N1CC[NH+](CCCCOc2cccc3ccccc32)CC1 ZINC000002286868 209354587 /nfs/dbraw/zinc/35/45/87/209354587.db2.gz RVPPAJXVGWAKOL-UHFFFAOYSA-N 1 1 378.472 4.050 50 0 GIAAMO O=C(C[NH+]1CCCCC1)Nc1c2c(nc3ccccc31)N(c1ccccc1)CC2 ZINC000000823157 209269721 /nfs/dbraw/zinc/26/97/21/209269721.db2.gz AWRKIIVJEZHVHI-UHFFFAOYSA-N 1 1 386.499 4.353 50 0 GIAAMO COc1ccc(CC[N@@H+](C)CCC(=O)Nc2c(C)cc(C)cc2C)cc1OC ZINC000000754621 209263738 /nfs/dbraw/zinc/26/37/38/209263738.db2.gz XRRKZFOXIIRDEC-UHFFFAOYSA-N 1 1 384.520 4.132 50 0 GIAAMO CC(C)c1sc(-n2cccc2)nc1C(=O)NC[C@@H]1CCC[N@H+]2CCCC[C@H]12 ZINC000253410360 209219207 /nfs/dbraw/zinc/21/92/07/209219207.db2.gz NGAAIYYNVCWXMC-DLBZAZTESA-N 1 1 386.565 4.052 50 0 GIAAMO Cc1ccccc1[C@H]1CC(=O)N(C[N@@H+]2CCC[C@@H](c3nc4ccccc4o3)C2)C1 ZINC000229765375 209186573 /nfs/dbraw/zinc/18/65/73/209186573.db2.gz OBOFGLUVINSUBG-MOPGFXCFSA-N 1 1 389.499 4.289 50 0 GIAAMO Cc1ccccc1[C@H]1CC(=O)N(C[N@H+]2CCC[C@@H](c3nc4ccccc4o3)C2)C1 ZINC000229765375 209186581 /nfs/dbraw/zinc/18/65/81/209186581.db2.gz OBOFGLUVINSUBG-MOPGFXCFSA-N 1 1 389.499 4.289 50 0 GIAAMO Cc1nc(C(=O)N(Cc2cccc(OCC[C@@H]3CCC[N@@H+]3C)c2)C2CC2)cs1 ZINC000299788700 212038577 /nfs/dbraw/zinc/03/85/77/212038577.db2.gz ZOBOGWOAHYTONH-SFHVURJKSA-N 1 1 399.560 4.119 50 0 GIAAMO FC(F)C(F)(F)COCc1nc([C@H]2C[C@@H](c3ccccc3)[N@H+]3CCC[C@H]23)no1 ZINC000299773034 212035878 /nfs/dbraw/zinc/03/58/78/212035878.db2.gz CYQPJHMRBHGWMK-ZNMIVQPWSA-N 1 1 399.388 4.180 50 0 GIAAMO CC[N@H+](Cc1ccccc1)Cc1nc2ccc(C)cc2c(NCCCOC)n1 ZINC000299759741 212033308 /nfs/dbraw/zinc/03/33/08/212033308.db2.gz OOEGLOSODQXCQE-UHFFFAOYSA-N 1 1 378.520 4.409 50 0 GIAAMO CC[N@@H+](Cc1ccccc1)Cc1nc2ccc(C)cc2c(NCCCOC)n1 ZINC000299759741 212033312 /nfs/dbraw/zinc/03/33/12/212033312.db2.gz OOEGLOSODQXCQE-UHFFFAOYSA-N 1 1 378.520 4.409 50 0 GIAAMO CCOc1ccc([C@H](C)[NH2+][C@H](C)c2nc3ccccc3c(=O)[nH]2)cc1OCC ZINC000049581353 211460793 /nfs/dbraw/zinc/46/07/93/211460793.db2.gz HZQZXLBGHNRKRP-LSDHHAIUSA-N 1 1 381.476 4.132 50 0 GIAAMO CCOC(=O)c1cc(Br)cnc1[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000097436605 211363912 /nfs/dbraw/zinc/36/39/12/211363912.db2.gz JKSPKNPZSFTHNK-HNNXBMFYSA-N 1 1 389.293 4.010 50 0 GIAAMO C[C@H](c1nc2ccccc2n1C(F)F)N1CC[NH+](Cc2cccs2)CC1 ZINC000096983481 211355347 /nfs/dbraw/zinc/35/53/47/211355347.db2.gz CZGRUGKJPKNWPS-CQSZACIVSA-N 1 1 376.476 4.372 50 0 GIAAMO C[N@@H+]1CCN(C(=O)Nc2ccc(OC(F)(F)F)cc2)[C@H](c2ccccc2)C1 ZINC000096797746 211347094 /nfs/dbraw/zinc/34/70/94/211347094.db2.gz JQCCULMYXWDYBF-KRWDZBQOSA-N 1 1 379.382 4.106 50 0 GIAAMO C[N@H+]1CCN(C(=O)Nc2ccc(OC(F)(F)F)cc2)[C@H](c2ccccc2)C1 ZINC000096797746 211347096 /nfs/dbraw/zinc/34/70/96/211347096.db2.gz JQCCULMYXWDYBF-KRWDZBQOSA-N 1 1 379.382 4.106 50 0 GIAAMO Cc1sc(NC(=O)c2cnn(-c3cc[nH+]cc3)c2C)nc1-c1ccc(F)cc1 ZINC000095976741 211291559 /nfs/dbraw/zinc/29/15/59/211291559.db2.gz MMMJBNHVQGDUNM-UHFFFAOYSA-N 1 1 393.447 4.399 50 0 GIAAMO Cc1ccccc1CC[N@@H+]1CCC[C@H](CN(C)C(=O)c2cc(Cl)cn2C)C1 ZINC000095503165 211255335 /nfs/dbraw/zinc/25/53/35/211255335.db2.gz IMRIZBNBJHPSSB-GOSISDBHSA-N 1 1 387.955 4.014 50 0 GIAAMO c1cn(Cc2cccnc2)c(C2CCN(c3nc4ccccc4s3)CC2)[nH+]1 ZINC000095498874 211253734 /nfs/dbraw/zinc/25/37/34/211253734.db2.gz VOEYYMVUHBIEDT-UHFFFAOYSA-N 1 1 375.501 4.320 50 0 GIAAMO CN(Cc1cccc2ccccc21)C(=O)C[C@H]1C[N@H+](Cc2ccccc2)CCO1 ZINC000095400094 211238948 /nfs/dbraw/zinc/23/89/48/211238948.db2.gz VNAILGJWTVLJJJ-QHCPKHFHSA-N 1 1 388.511 4.089 50 0 GIAAMO CN(Cc1cccc2ccccc21)C(=O)C[C@H]1C[N@@H+](Cc2ccccc2)CCO1 ZINC000095400094 211238953 /nfs/dbraw/zinc/23/89/53/211238953.db2.gz VNAILGJWTVLJJJ-QHCPKHFHSA-N 1 1 388.511 4.089 50 0 GIAAMO CCn1nc(C)cc1C(=O)Nc1ccc(C[N@@H+](C[C@@H]2CCCCO2)C(C)C)cc1 ZINC000095461572 211244327 /nfs/dbraw/zinc/24/43/27/211244327.db2.gz JFELAJBOBUEQRZ-NRFANRHFSA-N 1 1 398.551 4.243 50 0 GIAAMO COc1cccc(CNc2c(C)cnn2[C@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000095455320 211241948 /nfs/dbraw/zinc/24/19/48/211241948.db2.gz NFJSSWGRKMOKRU-NRFANRHFSA-N 1 1 376.504 4.259 50 0 GIAAMO CSc1ccc(C(=O)N2C[C@H]3CC[C@@H]2C[N@@H+](Cc2ccc(F)cc2)C3)cc1 ZINC000095359936 211223859 /nfs/dbraw/zinc/22/38/59/211223859.db2.gz NYDMLNAGUHFOHB-FXAWDEMLSA-N 1 1 384.520 4.284 50 0 GIAAMO CCCc1ccc(C[N@H+]2CCC[C@]3(CCC(=O)N(Cc4cccnc4)C3)C2)o1 ZINC000092022473 211212000 /nfs/dbraw/zinc/21/20/00/211212000.db2.gz FBBJDTLTLHHONO-QHCPKHFHSA-N 1 1 381.520 4.032 50 0 GIAAMO O=C(c1ccc2[nH]ccc2c1)N1C[C@H]2CC[C@@H]1C[N@@H+](Cc1ccc(F)cc1)C2 ZINC000091915312 211210512 /nfs/dbraw/zinc/21/05/12/211210512.db2.gz SZKJVBQGWNRTAF-LAUBAEHRSA-N 1 1 377.463 4.044 50 0 GIAAMO CC[N@H+]1C[C@H](c2ccccc2)CC2(CCN(C(=O)c3cnccc3C)CC2)C1 ZINC000091657195 211202077 /nfs/dbraw/zinc/20/20/77/211202077.db2.gz HOVFZWJSNRJOOF-OAQYLSRUSA-N 1 1 377.532 4.122 50 0 GIAAMO Cc1noc(C)c1C[N@H+]1C[C@@H]2CC[C@H](C1)N(Cc1ccc(Cl)cc1F)C2 ZINC000091643850 211199008 /nfs/dbraw/zinc/19/90/08/211199008.db2.gz VEBFXZICWVXGJJ-MAUKXSAKSA-N 1 1 377.891 4.180 50 0 GIAAMO FC(F)(F)c1ccccc1C[N@H+]1C[C@H]2CC[C@@H]1CN(Cc1ccncc1)C2 ZINC000091625703 211198556 /nfs/dbraw/zinc/19/85/56/211198556.db2.gz AUADBWVQAAIIRC-PKOBYXMFSA-N 1 1 375.438 4.197 50 0 GIAAMO FC(F)(F)c1ccccc1CN1C[C@H]2CC[C@@H]1C[N@H+](Cc1ccncc1)C2 ZINC000091625703 211198560 /nfs/dbraw/zinc/19/85/60/211198560.db2.gz AUADBWVQAAIIRC-PKOBYXMFSA-N 1 1 375.438 4.197 50 0 GIAAMO FC(F)(F)c1ccccc1CN1C[C@H]2CC[C@@H]1C[N@@H+](Cc1ccncc1)C2 ZINC000091625703 211198563 /nfs/dbraw/zinc/19/85/63/211198563.db2.gz AUADBWVQAAIIRC-PKOBYXMFSA-N 1 1 375.438 4.197 50 0 GIAAMO CCCCN(CCO)c1nc(C[NH+](C)C)nc2scc(-c3ccccc3)c21 ZINC000084744402 211173650 /nfs/dbraw/zinc/17/36/50/211173650.db2.gz GHMKKFJNWDWRRL-UHFFFAOYSA-N 1 1 384.549 4.019 50 0 GIAAMO CCCCN1C(=O)CC[C@H]2C[N@H+](Cc3cccc(-c4ccccn4)c3)CC[C@H]21 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O=C(c1ccc2cccc(Cl)c2n1)N1CC[C@]2(C1)CCC[N@@H+](CC1CC1)C2 ZINC000072168505 211080717 /nfs/dbraw/zinc/08/07/17/211080717.db2.gz HZDVYKPFTIKDMO-JOCHJYFZSA-N 1 1 383.923 4.226 50 0 GIAAMO O=C(c1ccc(-c2ccccc2)c(F)c1)[C@H]1CCC[N@@H+](CCN2CCCC2=O)C1 ZINC000071498074 211049224 /nfs/dbraw/zinc/04/92/24/211049224.db2.gz IISFXVYMDORKEJ-FQEVSTJZSA-N 1 1 394.490 4.010 50 0 GIAAMO CCc1[nH+]ccn1CC(=O)N1CCC[C@@H](CCc2ccccc2C(F)(F)F)C1 ZINC000071661737 211051091 /nfs/dbraw/zinc/05/10/91/211051091.db2.gz WGXFOVVWLQQDOC-INIZCTEOSA-N 1 1 393.453 4.336 50 0 GIAAMO CC(C)NC(=O)CC[N@H+]1CCc2onc(-c3ccc(-c4ccccc4)cc3)c2C1 ZINC000067967526 211030675 /nfs/dbraw/zinc/03/06/75/211030675.db2.gz YXCMJLCQJQRVOZ-UHFFFAOYSA-N 1 1 389.499 4.281 50 0 GIAAMO Cc1oc(-c2cccc(Cl)c2)nc1C[N@H+]1CCC[C@@H](CN2CCCC2=O)C1 ZINC000067983574 211032937 /nfs/dbraw/zinc/03/29/37/211032937.db2.gz JVBQAMQPPKOISJ-MRXNPFEDSA-N 1 1 387.911 4.138 50 0 GIAAMO CNC(=O)CC1CC[NH+](Cc2nc(-c3cccc(C(F)(F)F)c3)oc2C)CC1 ZINC000067871339 211027722 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CC[C@@H]1CCCC[N@H+]1CCCNc1ncnc2onc(-c3ccccc3OC)c21 ZINC000021715084 210389246 /nfs/dbraw/zinc/38/92/46/210389246.db2.gz ZMLOMQUBYGWQSU-MRXNPFEDSA-N 1 1 395.507 4.360 50 0 GIAAMO C[C@@H](C(=O)Nc1ccc(Cl)cc1Cl)N1CC[NH+](Cc2ccccc2)CC1 ZINC000021822204 210395506 /nfs/dbraw/zinc/39/55/06/210395506.db2.gz PPFKQUGSHKKUCF-HNNXBMFYSA-N 1 1 392.330 4.138 50 0 GIAAMO Fc1ccccc1N1CCN([C@@H]2CCC[N@@H+](Cc3ccc(Cl)cc3)C2)CC1 ZINC000020992963 210373043 /nfs/dbraw/zinc/37/30/43/210373043.db2.gz FERXVTXJCNVALG-HXUWFJFHSA-N 1 1 387.930 4.266 50 0 GIAAMO Fc1ccccc1N1CC[NH+]([C@@H]2CCCN(Cc3ccc(Cl)cc3)C2)CC1 ZINC000020992963 210373049 /nfs/dbraw/zinc/37/30/49/210373049.db2.gz FERXVTXJCNVALG-HXUWFJFHSA-N 1 1 387.930 4.266 50 0 GIAAMO Cc1ccc(NC(=O)NCc2c3c(sc2-n2cccc2)C[N@@H+](C)CC3)c(C)c1 ZINC000020927294 210370246 /nfs/dbraw/zinc/37/02/46/210370246.db2.gz WVAIGCRWFJVCOR-UHFFFAOYSA-N 1 1 394.544 4.465 50 0 GIAAMO CC[C@](O)(c1ccc(F)cc1)[C@@H](C[NH+]1CCOCC1)c1ccc(Cl)cc1 ZINC000020868355 210365414 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OCC[C@H]1C[N@H+](Cc2ccccc2-c2ccco2)CCN1Cc1ccccc1 ZINC000020206863 210321730 /nfs/dbraw/zinc/32/17/30/210321730.db2.gz WNDDPMIWMQWPDI-QFIPXVFZSA-N 1 1 376.500 4.015 50 0 GIAAMO OCC[C@H]1C[N@@H+](Cc2ccccc2-c2ccco2)CCN1Cc1ccccc1 ZINC000020206863 210321734 /nfs/dbraw/zinc/32/17/34/210321734.db2.gz WNDDPMIWMQWPDI-QFIPXVFZSA-N 1 1 376.500 4.015 50 0 GIAAMO CCCn1ncc(CN(C)C[C@@H]2CCC[N@@H+](CCc3ccc(F)cc3)C2)c1C ZINC000020203669 210321459 /nfs/dbraw/zinc/32/14/59/210321459.db2.gz OECUMCAFNRGZMB-NRFANRHFSA-N 1 1 386.559 4.127 50 0 GIAAMO CCn1c2ccccc2c2cc(C[NH+]3CCN(C(=O)c4ccncc4)CC3)ccc21 ZINC000019855168 210303025 /nfs/dbraw/zinc/30/30/25/210303025.db2.gz JKTQJZRMFJDNHX-UHFFFAOYSA-N 1 1 398.510 4.167 50 0 GIAAMO Cc1ccc(N2C(=O)C[C@@H]([NH+]3CCC(Cc4ccccc4)CC3)C2=O)cc1Cl ZINC000019782509 210295468 /nfs/dbraw/zinc/29/54/68/210295468.db2.gz JAYVGJKBBSFMKH-OAQYLSRUSA-N 1 1 396.918 4.235 50 0 GIAAMO C[C@H](c1ccco1)[N@@H+](C)Cc1cccc(-c2nc(-c3cccnc3)cc(=O)[nH]2)c1 ZINC000019791379 210295487 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Cc1cccc(N2CC[N@H+](CCCNc3nc(-c4ccccc4)no3)C[C@H]2C)c1 ZINC000021629844 136203205 /nfs/dbraw/zinc/20/32/05/136203205.db2.gz ZJKQOGUILIXPRV-LJQANCHMSA-N 1 1 391.519 4.058 50 0 GIAAMO COc1ccc(OCCC(=O)NCc2ccc(C[N@H+]3CCCC[C@H]3C)cc2)cc1 ZINC000048355914 570244418 /nfs/dbraw/zinc/24/44/18/570244418.db2.gz ZUTVBUHMHPJHFW-LJQANCHMSA-N 1 1 396.531 4.155 50 0 GIAAMO Cc1cccc(NC(=O)C[NH+]2CCC(c3nc(-c4cccc(C)c4)no3)CC2)c1 ZINC000049403196 570264128 /nfs/dbraw/zinc/26/41/28/570264128.db2.gz WYNTWGCVAGYZIS-UHFFFAOYSA-N 1 1 390.487 4.172 50 0 GIAAMO CCOc1ccc([C@@H](C)[NH2+][C@H](C)c2nc3ccccc3c(=O)[nH]2)cc1OCC ZINC000049581352 570271519 /nfs/dbraw/zinc/27/15/19/570271519.db2.gz HZQZXLBGHNRKRP-HUUCEWRRSA-N 1 1 381.476 4.132 50 0 GIAAMO COc1ccc(-c2nc(C[N@@H+]3[C@@H]4CC[C@H]3C[C@@H](O)C4)c(C)o2)c2ccccc12 ZINC000102093446 570287070 /nfs/dbraw/zinc/28/70/70/570287070.db2.gz RVJSYPXVNLVLON-FVQHAEBGSA-N 1 1 378.472 4.300 50 0 GIAAMO Cc1ccc(Cl)cc1NC(=O)[C@@H](C)[N@@H+]1CCC[C@@H](C(=O)Nc2ccccc2)C1 ZINC000012917736 570292997 /nfs/dbraw/zinc/29/29/97/570292997.db2.gz VQCLFBRLTHMMTO-IAGOWNOFSA-N 1 1 399.922 4.326 50 0 GIAAMO Cc1ccc(Cl)cc1NC(=O)[C@@H](C)[N@H+]1CCC[C@@H](C(=O)Nc2ccccc2)C1 ZINC000012917736 570293000 /nfs/dbraw/zinc/29/30/00/570293000.db2.gz VQCLFBRLTHMMTO-IAGOWNOFSA-N 1 1 399.922 4.326 50 0 GIAAMO C[C@@H]1C[C@@H](C)C[NH+](Cc2csc(NC(=O)Cc3ccc(Cl)cc3)n2)C1 ZINC000022293990 570312768 /nfs/dbraw/zinc/31/27/68/570312768.db2.gz RGJVVOGUBMYIDI-ZIAGYGMSSA-N 1 1 377.941 4.456 50 0 GIAAMO CC[N@H+]1CC[C@@H](CNC(=O)c2oc3ccccc3c2COc2ccccc2)C1 ZINC000121560918 570316460 /nfs/dbraw/zinc/31/64/60/570316460.db2.gz JMFFHKKZDFIHMR-KRWDZBQOSA-N 1 1 378.472 4.083 50 0 GIAAMO Cc1cccc([C@@H]2C[C@@H](C(=O)N3CCSCC3)C[N@@H+](Cc3ccccc3)C2)c1 ZINC000034733618 570325754 /nfs/dbraw/zinc/32/57/54/570325754.db2.gz BPEQZQSWFLUXPW-DHIUTWEWSA-N 1 1 394.584 4.176 50 0 GIAAMO CC(C)(C)c1ccc(C[NH+]2CCN(CC(=O)NCCC3=CCCCC3)CC2)cc1 ZINC000022751941 570326249 /nfs/dbraw/zinc/32/62/49/570326249.db2.gz PKOWDXLKDGLMIJ-UHFFFAOYSA-N 1 1 397.607 4.108 50 0 GIAAMO COc1ccc(C[N@@H+](C[C@H](O)CO[C@H]2CCCc3ccccc32)C2CC2)cc1 ZINC000247868317 570327626 /nfs/dbraw/zinc/32/76/26/570327626.db2.gz BZQPCJYBMDOZBG-URXFXBBRSA-N 1 1 381.516 4.115 50 0 GIAAMO CSc1cccc(C[N@H+]2CCC[C@@H](N3CCN(c4ccc(F)cc4)CC3)C2)c1 ZINC000022914648 570334674 /nfs/dbraw/zinc/33/46/74/570334674.db2.gz UZKBCLCWWDLMNR-JOCHJYFZSA-N 1 1 399.579 4.334 50 0 GIAAMO CSc1cccc(CN2CCC[C@@H]([NH+]3CCN(c4ccc(F)cc4)CC3)C2)c1 ZINC000022914648 570334676 /nfs/dbraw/zinc/33/46/76/570334676.db2.gz UZKBCLCWWDLMNR-JOCHJYFZSA-N 1 1 399.579 4.334 50 0 GIAAMO C[C@@H]1CCCC[N@H+]1Cc1ccc(NC(=O)c2csc(-c3cnn(C)c3)n2)cc1 ZINC000053722152 570338954 /nfs/dbraw/zinc/33/89/54/570338954.db2.gz PGMGARVICNTPMV-OAHLLOKOSA-N 1 1 395.532 4.170 50 0 GIAAMO CC[N@H+](Cc1ccc(OC)c(F)c1)C[C@@H](O)CO[C@H]1CCCc2ccccc21 ZINC000247882524 570340403 /nfs/dbraw/zinc/34/04/03/570340403.db2.gz JSTULRYVORSFOB-KNQAVFIVSA-N 1 1 387.495 4.111 50 0 GIAAMO COc1cccc(C[NH+]2CCN(Cc3csc(-c4cccc(C)c4)n3)CC2)c1 ZINC000023095771 570343420 /nfs/dbraw/zinc/34/34/20/570343420.db2.gz IIVLWNZTQFNWME-UHFFFAOYSA-N 1 1 393.556 4.445 50 0 GIAAMO C[C@@H]1CCCc2[nH+]cc([C@H](CC(=O)NCc3ccco3)c3cccc(F)c3)n21 ZINC000034919993 570345248 /nfs/dbraw/zinc/34/52/48/570345248.db2.gz JHGSGZYMODVNGC-DNVCBOLYSA-N 1 1 381.451 4.351 50 0 GIAAMO C[N@@H+]1C[C@H](c2ccccc2)[C@@H](C(=O)c2ccccc2)[C@@]12c1ccccc1NC2=O ZINC000035375601 570345557 /nfs/dbraw/zinc/34/55/57/570345557.db2.gz CGXUJYPOELUYIG-RZTXVSJASA-N 1 1 382.463 4.062 50 0 GIAAMO C[N@H+]1C[C@H](c2ccccc2)[C@@H](C(=O)c2ccccc2)[C@@]12c1ccccc1NC2=O ZINC000035375601 570345563 /nfs/dbraw/zinc/34/55/63/570345563.db2.gz CGXUJYPOELUYIG-RZTXVSJASA-N 1 1 382.463 4.062 50 0 GIAAMO CCOc1cc2c(cc1CNC[C@H](c1cccs1)[NH+]1CCCC1)O[C@H](C)C2 ZINC000023257840 570353107 /nfs/dbraw/zinc/35/31/07/570353107.db2.gz YDXKPWSNXKLSLD-VQIMIIECSA-N 1 1 386.561 4.397 50 0 GIAAMO CCOc1cc2c(cc1CNC[C@@H](c1cccs1)[NH+]1CCCC1)O[C@@H](C)C2 ZINC000023257849 570353332 /nfs/dbraw/zinc/35/33/32/570353332.db2.gz YDXKPWSNXKLSLD-LPHOPBHVSA-N 1 1 386.561 4.397 50 0 GIAAMO CCCO[C@@H]1CCC[N@@H+](Cc2ccc(-c3nc(C(F)(F)F)cc(=O)[nH]3)cc2)C1 ZINC000023431076 570362355 /nfs/dbraw/zinc/36/23/55/570362355.db2.gz QTYQSGDCJBPTTO-MRXNPFEDSA-N 1 1 395.425 4.259 50 0 GIAAMO CC[N@H+]1CCC[C@H]1CNC(=O)c1c(C)onc1-c1c(Cl)cccc1Cl ZINC000004322925 570367813 /nfs/dbraw/zinc/36/78/13/570367813.db2.gz BSCCVUAAVZMDBG-LBPRGKRZSA-N 1 1 382.291 4.171 50 0 GIAAMO C[N@H+](CCOc1ccccc1)Cc1nnc(-c2ccccc2Br)o1 ZINC000023706358 570369538 /nfs/dbraw/zinc/36/95/38/570369538.db2.gz XHPBNDUNMYUDSV-UHFFFAOYSA-N 1 1 388.265 4.010 50 0 GIAAMO C[N@@H+](CCOc1ccccc1)Cc1nnc(-c2ccccc2Br)o1 ZINC000023706358 570369540 /nfs/dbraw/zinc/36/95/40/570369540.db2.gz XHPBNDUNMYUDSV-UHFFFAOYSA-N 1 1 388.265 4.010 50 0 GIAAMO Cc1cccn2c(=O)cc(C[N@@H+]3CCc4sccc4[C@@H]3c3cccs3)nc12 ZINC000023864628 570373933 /nfs/dbraw/zinc/37/39/33/570373933.db2.gz KJTNKEBGTQHFIZ-HXUWFJFHSA-N 1 1 393.537 4.274 50 0 GIAAMO Cc1cccn2c(=O)cc(C[N@H+]3CCc4sccc4[C@@H]3c3cccs3)nc12 ZINC000023864628 570373938 /nfs/dbraw/zinc/37/39/38/570373938.db2.gz KJTNKEBGTQHFIZ-HXUWFJFHSA-N 1 1 393.537 4.274 50 0 GIAAMO COc1cc2c(cc1OC)[C@H](c1ccccc1)[N@@H+](C[C@H](O)c1ccccc1)CC2 ZINC000023882208 570374560 /nfs/dbraw/zinc/37/45/60/570374560.db2.gz VVHYMQWHTKCPDC-DHLKQENFSA-N 1 1 389.495 4.385 50 0 GIAAMO Fc1ccc(CNC2CC[NH+](Cc3ccccc3)CC2)cc1Br ZINC000058165458 570377516 /nfs/dbraw/zinc/37/75/16/570377516.db2.gz ZNUWZQAOJBHMHM-UHFFFAOYSA-N 1 1 377.301 4.342 50 0 GIAAMO CCOC(=O)[C@@H]1CCC[N@@H+](Cc2c[nH]nc2-c2ccc(Cl)cc2Cl)C1 ZINC000006419947 570405887 /nfs/dbraw/zinc/40/58/87/570405887.db2.gz SYJMEGKHXWYAPG-GFCCVEGCSA-N 1 1 382.291 4.159 50 0 GIAAMO CC[N@@H+](Cc1ccc(OC)c(OC)c1)Cc1cc(Cl)c2c(c1)OCCO2 ZINC000025357730 570411757 /nfs/dbraw/zinc/41/17/57/570411757.db2.gz GXQHKJHQGPYLFM-UHFFFAOYSA-N 1 1 377.868 4.151 50 0 GIAAMO COc1ccc(OCC[N@@H+](C)Cc2ccc(C(=O)Nc3ccccc3)cc2)cc1 ZINC000011011399 570431383 /nfs/dbraw/zinc/43/13/83/570431383.db2.gz YGKMUPAEBZBAQR-UHFFFAOYSA-N 1 1 390.483 4.458 50 0 GIAAMO COc1ccc([C@@H]2CCC[N@@H+]2CC(=O)N2CCC[C@H]3CCCC[C@H]32)cc1OC ZINC000248149259 570443929 /nfs/dbraw/zinc/44/39/29/570443929.db2.gz ZUQOJHTXIMMSKN-YZGWKJHDSA-N 1 1 386.536 4.022 50 0 GIAAMO COc1ccc([C@@H]2CCC[N@H+]2CC(=O)N2CCC[C@H]3CCCC[C@H]32)cc1OC ZINC000248149259 570443933 /nfs/dbraw/zinc/44/39/33/570443933.db2.gz ZUQOJHTXIMMSKN-YZGWKJHDSA-N 1 1 386.536 4.022 50 0 GIAAMO O=C(NNc1cccc(Cl)c1)[C@H]1C[N@H+](Cc2ccccc2)C[C@H]1C(F)(F)F ZINC000252532972 570451942 /nfs/dbraw/zinc/45/19/42/570451942.db2.gz FPLAFVNSOBJOGV-DLBZAZTESA-N 1 1 397.828 4.094 50 0 GIAAMO O[C@H](C[N@H+]1CCCN(Cc2ccc(C(F)(F)F)cc2)CC1)c1ccc(F)cc1 ZINC000028260659 570453604 /nfs/dbraw/zinc/45/36/04/570453604.db2.gz JBHHHGAIYZWTAK-HXUWFJFHSA-N 1 1 396.428 4.086 50 0 GIAAMO O[C@H](CN1CCC[N@H+](Cc2ccc(C(F)(F)F)cc2)CC1)c1ccc(F)cc1 ZINC000028260659 570453608 /nfs/dbraw/zinc/45/36/08/570453608.db2.gz JBHHHGAIYZWTAK-HXUWFJFHSA-N 1 1 396.428 4.086 50 0 GIAAMO O[C@H](CN1CCC[N@@H+](Cc2ccc(C(F)(F)F)cc2)CC1)c1ccc(F)cc1 ZINC000028260659 570453613 /nfs/dbraw/zinc/45/36/13/570453613.db2.gz JBHHHGAIYZWTAK-HXUWFJFHSA-N 1 1 396.428 4.086 50 0 GIAAMO Cc1cc(C)n2ncc(C(=O)Nc3ccccc3C[N@H+](C)C3CCCCC3)c2n1 ZINC000029880262 570482083 /nfs/dbraw/zinc/48/20/83/570482083.db2.gz JFPSUTCQTZOSPP-UHFFFAOYSA-N 1 1 391.519 4.363 50 0 GIAAMO Cc1ccn2c(=O)cc(C[N@H+](Cc3ccccc3)Cc3ccc(F)cc3)nc2c1 ZINC000064590832 570490088 /nfs/dbraw/zinc/49/00/88/570490088.db2.gz IHBGFJGZQQWOQL-UHFFFAOYSA-N 1 1 387.458 4.344 50 0 GIAAMO Cc1ccn2c(=O)cc(C[N@@H+](Cc3ccccc3)Cc3ccc(F)cc3)nc2c1 ZINC000064590832 570490090 /nfs/dbraw/zinc/49/00/90/570490090.db2.gz IHBGFJGZQQWOQL-UHFFFAOYSA-N 1 1 387.458 4.344 50 0 GIAAMO COc1cc(C[N@H+]2CCCCC[C@H]2c2ccc(C)s2)ccc1OCC(N)=O ZINC000033087215 570519956 /nfs/dbraw/zinc/51/99/56/570519956.db2.gz ZACQSTKMQRNZRV-KRWDZBQOSA-N 1 1 388.533 4.047 50 0 GIAAMO Cc1noc(C(F)(F)F)c1C(=O)Nc1ccc(C[N@@H+]2CCC[C@@H](C)C2)cc1 ZINC000072307024 570524872 /nfs/dbraw/zinc/52/48/72/570524872.db2.gz COASFCGNTUPJEE-GFCCVEGCSA-N 1 1 381.398 4.486 50 0 GIAAMO COc1ccc(OC[C@H](O)C[N@@H+](Cc2ccco2)Cc2cccc(C)c2)cc1 ZINC000036098664 570536383 /nfs/dbraw/zinc/53/63/83/570536383.db2.gz SCHWJJBYLQKSNJ-HXUWFJFHSA-N 1 1 381.472 4.039 50 0 GIAAMO COc1cccc(C[N@H+](Cc2ccccc2)C[C@@H](O)COCc2ccccc2)c1 ZINC000036098259 570536569 /nfs/dbraw/zinc/53/65/69/570536569.db2.gz ASDPXKNSBOKTEP-XMMPIXPASA-N 1 1 391.511 4.275 50 0 GIAAMO O[C@H](COCc1ccco1)C[N@H+](Cc1ccc(F)cc1)Cc1ccccc1F ZINC000036102632 570539717 /nfs/dbraw/zinc/53/97/17/570539717.db2.gz AJVQYVKHJHPSNM-FQEVSTJZSA-N 1 1 387.426 4.138 50 0 GIAAMO O[C@H](COCc1ccco1)C[N@@H+](Cc1ccc(F)cc1)Cc1ccccc1F ZINC000036102632 570539721 /nfs/dbraw/zinc/53/97/21/570539721.db2.gz AJVQYVKHJHPSNM-FQEVSTJZSA-N 1 1 387.426 4.138 50 0 GIAAMO O=C(NC[C@@H](c1ccsc1)[N@@H+]1CCc2ccccc2C1)c1ccccc1F ZINC000022766059 570543621 /nfs/dbraw/zinc/54/36/21/570543621.db2.gz WDQFKDDUQJYAQC-NRFANRHFSA-N 1 1 380.488 4.417 50 0 GIAAMO O=C(NC[C@@H](c1ccsc1)[N@H+]1CCc2ccccc2C1)c1ccccc1F ZINC000022766059 570543623 /nfs/dbraw/zinc/54/36/23/570543623.db2.gz WDQFKDDUQJYAQC-NRFANRHFSA-N 1 1 380.488 4.417 50 0 GIAAMO O=C(NCc1ccccc1C(F)(F)F)C1=CC[N@@H+](Cc2ccc(F)cc2)CC1 ZINC000064818050 570553552 /nfs/dbraw/zinc/55/35/52/570553552.db2.gz ARPARWJUOFMNIK-UHFFFAOYSA-N 1 1 392.396 4.293 50 0 GIAAMO O=C(COc1ccccc1)NC[C@@H](c1cccs1)[N@@H+]1CCc2ccccc2C1 ZINC000022907723 570564212 /nfs/dbraw/zinc/56/42/12/570564212.db2.gz SERBJDHHKYIDIF-NRFANRHFSA-N 1 1 392.524 4.043 50 0 GIAAMO O=C(COc1ccccc1)NC[C@@H](c1cccs1)[N@H+]1CCc2ccccc2C1 ZINC000022907723 570564215 /nfs/dbraw/zinc/56/42/15/570564215.db2.gz SERBJDHHKYIDIF-NRFANRHFSA-N 1 1 392.524 4.043 50 0 GIAAMO COc1ccc(CC[N@@H+]2CCC[C@H](CN(C)Cc3cccc(OC)c3)C2)cc1 ZINC000011662019 570577031 /nfs/dbraw/zinc/57/70/31/570577031.db2.gz PYLLKFZVPVVKEW-JOCHJYFZSA-N 1 1 382.548 4.090 50 0 GIAAMO COc1ccc(CC[N@H+]2CCC[C@H](CN(C)Cc3cccc(OC)c3)C2)cc1 ZINC000011662019 570577032 /nfs/dbraw/zinc/57/70/32/570577032.db2.gz PYLLKFZVPVVKEW-JOCHJYFZSA-N 1 1 382.548 4.090 50 0 GIAAMO COc1ccc2cc(-c3n[nH]cc3C[N@H+]3CCC[C@@H](CCCO)C3)ccc2c1 ZINC000011663377 570577846 /nfs/dbraw/zinc/57/78/46/570577846.db2.gz MCYUADPBXVEUKP-KRWDZBQOSA-N 1 1 379.504 4.223 50 0 GIAAMO OC[C@@]1(CCc2ccccc2)CCC[N@@H+](Cc2c[nH]nc2-c2ccccc2)C1 ZINC000011663187 570577967 /nfs/dbraw/zinc/57/79/67/570577967.db2.gz LXNGDJFWAFLRCO-XMMPIXPASA-N 1 1 375.516 4.284 50 0 GIAAMO CC(=O)c1cc(C[N@@H+]2CCC[C@](CO)(Cc3cccc(Cl)c3)C2)cs1 ZINC000011753366 570581187 /nfs/dbraw/zinc/58/11/87/570581187.db2.gz AQEHWZBSNPEIMM-FQEVSTJZSA-N 1 1 377.937 4.421 50 0 GIAAMO CC(=O)c1cc(C[N@H+]2CCC[C@](CO)(Cc3cccc(Cl)c3)C2)cs1 ZINC000011753366 570581188 /nfs/dbraw/zinc/58/11/88/570581188.db2.gz AQEHWZBSNPEIMM-FQEVSTJZSA-N 1 1 377.937 4.421 50 0 GIAAMO COc1cccc(C(=O)[C@@H]2CCC[N@@H+](Cc3ccc(OC)c(C)c3OC)C2)c1 ZINC000011770877 570582022 /nfs/dbraw/zinc/58/20/22/570582022.db2.gz UBKUETDDEWXNGT-GOSISDBHSA-N 1 1 383.488 4.116 50 0 GIAAMO O=C(Nc1ccccc1Oc1cccnc1)[C@H]1CCC[N@H+]1C1Cc2ccccc2C1 ZINC000011817192 570584243 /nfs/dbraw/zinc/58/42/43/570584243.db2.gz TXOCFEJHCZNRHD-HSZRJFAPSA-N 1 1 399.494 4.444 50 0 GIAAMO Cc1ccc(C(=O)N(C)C[C@H]2CCC[N@@H+](CCc3ccc(Cl)cc3)C2)cn1 ZINC000011956781 570595839 /nfs/dbraw/zinc/59/58/39/570595839.db2.gz JESXHZMGGJXDQI-LJQANCHMSA-N 1 1 385.939 4.070 50 0 GIAAMO Cc1cc(C)c(C(=O)N2CC[C@@]3(C2)CCC[N@H+](Cc2cccc(F)c2F)C3)o1 ZINC000011958320 570596236 /nfs/dbraw/zinc/59/62/36/570596236.db2.gz BCZGBTSUIGRVQR-QFIPXVFZSA-N 1 1 388.458 4.303 50 0 GIAAMO Cc1cc(C)c(C(=O)N2CC[C@@]3(C2)CCC[N@@H+](Cc2cccc(F)c2F)C3)o1 ZINC000011958320 570596238 /nfs/dbraw/zinc/59/62/38/570596238.db2.gz BCZGBTSUIGRVQR-QFIPXVFZSA-N 1 1 388.458 4.303 50 0 GIAAMO Cc1c2cc(Br)ccc2oc1C(=O)NC[C@H](c1ccco1)[NH+](C)C ZINC000005451902 570597196 /nfs/dbraw/zinc/59/71/96/570597196.db2.gz DHCAQXFOJBKFDK-CQSZACIVSA-N 1 1 391.265 4.129 50 0 GIAAMO CCn1cc(C[N@H+]2CCC[C@H](C(=O)c3ccc4cc(OC)ccc4c3)C2)c(C)n1 ZINC000012056798 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50 0 GIAAMO C[N@@H+](Cc1nccn1Cc1ccccc1)CC1CCN(C(=O)OC(C)(C)C)CC1 ZINC000084200161 571008964 /nfs/dbraw/zinc/00/89/64/571008964.db2.gz BRZZZGKDDHZNJG-UHFFFAOYSA-N 1 1 398.551 4.010 50 0 GIAAMO C[N@H+](Cc1nccn1Cc1ccccc1)CC1CCN(C(=O)OC(C)(C)C)CC1 ZINC000084200161 571008965 /nfs/dbraw/zinc/00/89/65/571008965.db2.gz BRZZZGKDDHZNJG-UHFFFAOYSA-N 1 1 398.551 4.010 50 0 GIAAMO O=c1c2ccccc2ncn1CC[N@@H+]1CCc2sccc2[C@@H]1c1cccs1 ZINC000084587440 571024696 /nfs/dbraw/zinc/02/46/96/571024696.db2.gz LXFUVBHLVFRQGE-HXUWFJFHSA-N 1 1 393.537 4.167 50 0 GIAAMO O=c1c2ccccc2ncn1CC[N@H+]1CCc2sccc2[C@@H]1c1cccs1 ZINC000084587440 571024697 /nfs/dbraw/zinc/02/46/97/571024697.db2.gz LXFUVBHLVFRQGE-HXUWFJFHSA-N 1 1 393.537 4.167 50 0 GIAAMO [NH2+]=C(Nc1ccc(Oc2ccccc2)cc1)Nc1nc(C(F)(F)F)cc(=O)[nH]1 ZINC000006424058 817689891 /nfs/dbraw/zinc/68/98/91/817689891.db2.gz ISFUJLHRLURVJP-UHFFFAOYSA-N 1 1 389.337 4.452 50 0 GIAAMO Cc1ccc2c(c1)[C@@H]1C[N@H+](C)CC[C@@H]1N2S(=O)(=O)c1ccc(C(C)C)cc1 ZINC000008262373 818026212 /nfs/dbraw/zinc/02/62/12/818026212.db2.gz KJRDIKRIJPDFGK-UNMCSNQZSA-N 1 1 384.545 4.115 50 0 GIAAMO Cn1cc(C[N@@H+](C)CCc2cn[nH]c2)c(-c2ccc(Oc3ccccc3)cc2)n1 ZINC000011765813 818118068 /nfs/dbraw/zinc/11/80/68/818118068.db2.gz CBZHMAQBQSTSMJ-UHFFFAOYSA-N 1 1 387.487 4.277 50 0 GIAAMO COCc1ccc(C(=O)N2CC[C@@]3(C2)CCC[N@@H+](Cc2cccc(C)c2)C3)s1 ZINC000011763357 818118132 /nfs/dbraw/zinc/11/81/32/818118132.db2.gz KRJVBYNTHOYFAN-QHCPKHFHSA-N 1 1 398.572 4.331 50 0 GIAAMO Cc1cc(C(=O)N[C@H]2CCC[N@H+](Cc3ccccc3F)C2)c2ccccc2n1 ZINC000011844323 818125513 /nfs/dbraw/zinc/12/55/13/818125513.db2.gz UUMLLUJVECTTIY-SFHVURJKSA-N 1 1 377.463 4.077 50 0 GIAAMO Cc1cc(C(=O)N[C@H]2CCC[N@@H+](Cc3ccccc3F)C2)c2ccccc2n1 ZINC000011844323 818125517 /nfs/dbraw/zinc/12/55/17/818125517.db2.gz UUMLLUJVECTTIY-SFHVURJKSA-N 1 1 377.463 4.077 50 0 GIAAMO COc1ccc(CC[N@H+]2CCC[C@@H](CN(C)C(=O)Nc3ccc(F)cc3)C2)cc1 ZINC000011878350 818126510 /nfs/dbraw/zinc/12/65/10/818126510.db2.gz INMTUVSZISSIMV-IBGZPJMESA-N 1 1 399.510 4.253 50 0 GIAAMO O=C(Cc1cccs1)N1CC[C@H]2[C@H](CCC[N@H+]2CCCc2ccccc2)C1 ZINC000011998432 818135519 /nfs/dbraw/zinc/13/55/19/818135519.db2.gz LMRJOOKPEULNRG-IRLDBZIGSA-N 1 1 382.573 4.236 50 0 GIAAMO O=C(N[C@H]1CCC[N@H+](C2Cc3ccccc3C2)C1)C1(c2ccc(Cl)cc2)CC1 ZINC000011999273 818136052 /nfs/dbraw/zinc/13/60/52/818136052.db2.gz CFXFMJGUVJBUQF-NRFANRHFSA-N 1 1 394.946 4.120 50 0 GIAAMO Cc1ccc(O)c(C(=O)N2CC[C@@]3(C2)CCC[N@@H+](CCCc2ccccc2)C3)c1 ZINC000012201791 818146656 /nfs/dbraw/zinc/14/66/56/818146656.db2.gz DMQKMETWZNDIPH-VWLOTQADSA-N 1 1 392.543 4.262 50 0 GIAAMO COc1ccc2cc(-c3n[nH]cc3C[N@H+]3CCCC[C@@H]3CCCO)ccc2c1 ZINC000012302883 818153645 /nfs/dbraw/zinc/15/36/45/818153645.db2.gz NBMWERYCOMGFOA-OAQYLSRUSA-N 1 1 379.504 4.366 50 0 GIAAMO O=C([C@@H]1CCC[N@H+](C2CCN(Cc3ccccc3)CC2)C1)N1CCCCCCC1 ZINC000012430865 818158704 /nfs/dbraw/zinc/15/87/04/818158704.db2.gz WCBJMZIHKIGWPX-HSZRJFAPSA-N 1 1 397.607 4.156 50 0 GIAAMO Cc1nn(C(C)C)c(C)c1C[N@@H+](CCc1ccccc1)C[C@@H]1CCCN(C)C1 ZINC000012429245 818158788 /nfs/dbraw/zinc/15/87/88/818158788.db2.gz FRRSNTOABUHAPZ-HSZRJFAPSA-N 1 1 382.596 4.467 50 0 GIAAMO Cc1nn(C(C)C)c(C)c1CN(CCc1ccccc1)C[C@@H]1CCC[N@H+](C)C1 ZINC000012429245 818158811 /nfs/dbraw/zinc/15/88/11/818158811.db2.gz FRRSNTOABUHAPZ-HSZRJFAPSA-N 1 1 382.596 4.467 50 0 GIAAMO Cc1nn(C(C)C)c(C)c1CN(CCc1ccccc1)C[C@@H]1CCC[N@@H+](C)C1 ZINC000012429245 818158817 /nfs/dbraw/zinc/15/88/17/818158817.db2.gz FRRSNTOABUHAPZ-HSZRJFAPSA-N 1 1 382.596 4.467 50 0 GIAAMO COC[C@H]1CC[N@@H+](Cc2cn(-c3ccc(OC)cc3)nc2-c2cccc(F)c2)C1 ZINC000012579197 818167860 /nfs/dbraw/zinc/16/78/60/818167860.db2.gz KDOSTDGASPOIMS-KRWDZBQOSA-N 1 1 395.478 4.155 50 0 GIAAMO CCSc1ncc(CN2CC[C@]3(C2)CCC[N@@H+](Cc2cccc(C)c2)C3)cn1 ZINC000014951033 818278828 /nfs/dbraw/zinc/27/88/28/818278828.db2.gz AUYGRKMUALZSCT-HSZRJFAPSA-N 1 1 396.604 4.385 50 0 GIAAMO COc1ccccc1C[C@@H](C)[N@@H+]1CCC(=O)N(Cc2cccc(Cl)c2)CC1 ZINC000014968372 818279749 /nfs/dbraw/zinc/27/97/49/818279749.db2.gz YVTRQVBQWVOJAU-QGZVFWFLSA-N 1 1 386.923 4.014 50 0 GIAAMO CC(C)=CCC[C@H](C)[N@@H+]1CCC(=O)N(Cc2cc3c(cc2Cl)OCO3)CC1 ZINC000014965563 818279863 /nfs/dbraw/zinc/27/98/63/818279863.db2.gz XQWSPKRNWWKYHD-INIZCTEOSA-N 1 1 392.927 4.238 50 0 GIAAMO Fc1ccccc1-c1noc(C[N@H+](Cc2ccccc2)CC2CCOCC2)n1 ZINC000189022224 823343142 /nfs/dbraw/zinc/34/31/42/823343142.db2.gz WPHCHVOXRMQIDU-UHFFFAOYSA-N 1 1 381.451 4.305 50 0 GIAAMO COCc1ccc(C[N@H+]2CCC[C@H](c3n[nH]cc3-c3cc(F)ccc3F)C2)o1 ZINC000019773679 818605095 /nfs/dbraw/zinc/60/50/95/818605095.db2.gz QACBWRADOTZUPE-AWEZNQCLSA-N 1 1 387.430 4.474 50 0 GIAAMO O=C(Nc1ccc2c(c1)C[N@@H+](Cc1ccncc1)CC2)C1(c2ccccc2)CC1 ZINC000019789184 818605193 /nfs/dbraw/zinc/60/51/93/818605193.db2.gz YHTDERAYZZPDQI-UHFFFAOYSA-N 1 1 383.495 4.310 50 0 GIAAMO O=C(Nc1ccc2c(c1)C[N@H+](Cc1ccncc1)CC2)C1(c2ccccc2)CC1 ZINC000019789184 818605200 /nfs/dbraw/zinc/60/52/00/818605200.db2.gz YHTDERAYZZPDQI-UHFFFAOYSA-N 1 1 383.495 4.310 50 0 GIAAMO COc1ccc2c(c1)C[C@@H]([N@H+]1CCc3[nH]nc(-c4ccccc4F)c3C1)CC2 ZINC000020455085 818622303 /nfs/dbraw/zinc/62/23/03/818622303.db2.gz SNVQGYMYTOOWNH-KRWDZBQOSA-N 1 1 377.463 4.140 50 0 GIAAMO Cc1ccc2nc(-c3cccnc3)cc(C(=O)NCC[N@@H+]3CCCC[C@H]3C)c2c1 ZINC000021934779 818757568 /nfs/dbraw/zinc/75/75/68/818757568.db2.gz YCAWPGURXZVGPJ-GOSISDBHSA-N 1 1 388.515 4.209 50 0 GIAAMO C[C@H]1CCCN(C(=O)CC[N@@H+]2Cc3ccccc3O[C@H](c3ccccc3F)C2)C1 ZINC000023144512 818903867 /nfs/dbraw/zinc/90/38/67/818903867.db2.gz WOCICRNEBKPSHM-MBSDFSHPSA-N 1 1 396.506 4.410 50 0 GIAAMO Cc1cccc(C[N@@H+]2CCC[C@]3(CCN(Cc4nc5ccccc5n4C)C3)C2)c1 ZINC000023312280 818922804 /nfs/dbraw/zinc/92/28/04/818922804.db2.gz XSHBJJRGKZCMLS-VWLOTQADSA-N 1 1 388.559 4.370 50 0 GIAAMO CC[C@@H](CNC(=O)c1ccccc1C(F)(F)F)[N@H+]1CCc2ccccc2C1 ZINC000032447329 820946818 /nfs/dbraw/zinc/94/68/18/820946818.db2.gz OOIFALWSYRGTBX-KRWDZBQOSA-N 1 1 376.422 4.272 50 0 GIAAMO COc1cccc(C2=NN(C(=O)C[N@@H+](C)C(C)C)[C@@H](c3ccccc3Cl)C2)c1 ZINC000036341063 821071223 /nfs/dbraw/zinc/07/12/23/821071223.db2.gz UONHHGLGIJGGOE-OAQYLSRUSA-N 1 1 399.922 4.367 50 0 GIAAMO C[C@H](C(=O)NCc1ccccc1C[N@H+]1CCC[C@H](C)C1)n1cnc2ccccc21 ZINC000040112298 821140235 /nfs/dbraw/zinc/14/02/35/821140235.db2.gz BKSKKYZKRVDZJK-RBUKOAKNSA-N 1 1 390.531 4.146 50 0 GIAAMO O=C(NC1CCCCC1)c1ccc(C[NH+]2CCN(c3ccccc3F)CC2)cc1 ZINC000040413570 821159186 /nfs/dbraw/zinc/15/91/86/821159186.db2.gz MJTXTXTWJGRNDQ-UHFFFAOYSA-N 1 1 395.522 4.210 50 0 GIAAMO CC(C)(C)C(=O)N1CCC(C[N@@H+](CCCO)[C@H]2CCCc3ccccc32)CC1 ZINC000181734401 821967292 /nfs/dbraw/zinc/96/72/92/821967292.db2.gz VBYXEALXZLDLQH-QFIPXVFZSA-N 1 1 386.580 4.033 50 0 GIAAMO COc1ccccc1-c1csc(C2CCN(CC[C@H]3CCC[N@@H+]3C)CC2)n1 ZINC000191513003 823694043 /nfs/dbraw/zinc/69/40/43/823694043.db2.gz JQAOFKWBJAWPCH-GOSISDBHSA-N 1 1 385.577 4.482 50 0 GIAAMO COc1ccccc1-c1csc(C2CCN(CC[C@H]3CCC[N@H+]3C)CC2)n1 ZINC000191513003 823694044 /nfs/dbraw/zinc/69/40/44/823694044.db2.gz JQAOFKWBJAWPCH-GOSISDBHSA-N 1 1 385.577 4.482 50 0 GIAAMO C[N@@H+](CCCc1cc(-c2ccccc2)no1)[C@H]1CCc2ccccc2NC1=O ZINC000191980647 823830824 /nfs/dbraw/zinc/83/08/24/823830824.db2.gz PCKGFHFALCZYEC-QFIPXVFZSA-N 1 1 375.472 4.160 50 0 GIAAMO c1ccc(-c2nc(-c3ccc(O[C@@H]4CC[N@H+](Cc5ccncc5)C4)cc3)no2)cc1 ZINC000575313276 823952549 /nfs/dbraw/zinc/95/25/49/823952549.db2.gz FLACMTOVSKHSHC-JOCHJYFZSA-N 1 1 398.466 4.452 50 0 GIAAMO Fc1ccc(CN2CC[NH+](C/C=C/c3ccccc3)CC2)cc1Br ZINC000019536881 210258514 /nfs/dbraw/zinc/25/85/14/210258514.db2.gz IOPVNOLAKFISIL-QPJJXVBHSA-N 1 1 389.312 4.419 50 0 GIAAMO CC1(C)C[C@@]2(CCCN(CC[N@H+]3CCC[C@]4(CCOC(C)(C)C4)C3)C2)CCO1 ZINC000019367981 210244675 /nfs/dbraw/zinc/24/46/75/210244675.db2.gz VOSHMDSOMREFNT-DNQXCXABSA-N 1 1 392.628 4.329 50 0 GIAAMO COc1c(C)cc(C(=O)[C@H]2CCC[N@@H+](Cc3cccc4c3OCO4)C2)cc1C ZINC000015068550 210149050 /nfs/dbraw/zinc/14/90/50/210149050.db2.gz FLRQJZRKQGFKMG-KRWDZBQOSA-N 1 1 381.472 4.136 50 0 GIAAMO C[C@H](CNC(=O)C1CCCCC1)Oc1cccc(C[N@@H+](C)Cc2ccoc2)c1 ZINC000015072201 210147952 /nfs/dbraw/zinc/14/79/52/210147952.db2.gz AUGPJLGKBFLNHP-GOSISDBHSA-N 1 1 384.520 4.375 50 0 GIAAMO COc1ccc(F)cc1C(=O)[C@@H]1CCC[N@@H+](Cc2cccc(-n3cccn3)c2)C1 ZINC000015066953 210147854 /nfs/dbraw/zinc/14/78/54/210147854.db2.gz NLCNLQRCXGNIJG-GOSISDBHSA-N 1 1 393.462 4.115 50 0 GIAAMO Cc1cccc(-c2c[nH]nc2[C@H]2CCC[N@@H+](Cc3ccc4c(c3)OCO4)C2)c1 ZINC000014986476 210140715 /nfs/dbraw/zinc/14/07/15/210140715.db2.gz COUWCGVTYWITPG-IBGZPJMESA-N 1 1 375.472 4.493 50 0 GIAAMO CC(=O)Nc1ccc(CN(C)C[C@@H]2CCC[N@H+](CCc3ccccc3C)C2)cc1 ZINC000014975668 210137910 /nfs/dbraw/zinc/13/79/10/210137910.db2.gz RKSDVDMDUOHFCA-QHCPKHFHSA-N 1 1 393.575 4.340 50 0 GIAAMO CC(=O)Nc1ccc(CN(C)C[C@@H]2CCC[N@@H+](CCc3ccccc3C)C2)cc1 ZINC000014975668 210137915 /nfs/dbraw/zinc/13/79/15/210137915.db2.gz RKSDVDMDUOHFCA-QHCPKHFHSA-N 1 1 393.575 4.340 50 0 GIAAMO COc1ccc(C(=O)N(C)[C@@H]2CCC[N@@H+](CCCc3ccccc3)C2)cc1F ZINC000014957439 210133931 /nfs/dbraw/zinc/13/39/31/210133931.db2.gz AJUZKPSQZKTMAS-HXUWFJFHSA-N 1 1 384.495 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/nfs/dbraw/zinc/38/00/77/210380077.db2.gz KUHZUXDRTGLCGK-UHFFFAOYSA-N 1 1 381.501 4.352 50 0 GIAAMO CC[N@@H+]1CCc2nc(NC(=O)CCc3ccc(-c4ccccc4)o3)sc2C1 ZINC000021294792 210380074 /nfs/dbraw/zinc/38/00/74/210380074.db2.gz KUHZUXDRTGLCGK-UHFFFAOYSA-N 1 1 381.501 4.352 50 0 GIAAMO COc1cccc(C[N@@H+](C)Cc2ccc(-c3nc(C(F)F)cc(=O)[nH]3)cc2)c1 ZINC000020908344 210368491 /nfs/dbraw/zinc/36/84/91/210368491.db2.gz GATDPVBGZZEKKV-UHFFFAOYSA-N 1 1 385.414 4.427 50 0 GIAAMO COc1cc(Nc2ncc3c(n2)CC[N@@H+](Cc2ccccc2C)C3)cc(OC)c1 ZINC000021038757 210374491 /nfs/dbraw/zinc/37/44/91/210374491.db2.gz YIHYUIOKACGSQW-UHFFFAOYSA-N 1 1 390.487 4.104 50 0 GIAAMO COc1cc(Nc2ncc3c(n2)CC[N@H+](Cc2ccccc2C)C3)cc(OC)c1 ZINC000021038757 210374497 /nfs/dbraw/zinc/37/44/97/210374497.db2.gz YIHYUIOKACGSQW-UHFFFAOYSA-N 1 1 390.487 4.104 50 0 GIAAMO Cc1ncc(C[N@@H+]2CCC[C@@H]2c2ccc(C(=O)NCc3ccoc3)s2)s1 ZINC000020868663 210365450 /nfs/dbraw/zinc/36/54/50/210365450.db2.gz BBDGNIULVDQNQA-MRXNPFEDSA-N 1 1 387.530 4.373 50 0 GIAAMO Cc1ncc(C[N@H+]2CCC[C@@H]2c2ccc(C(=O)NCc3ccoc3)s2)s1 ZINC000020868663 210365455 /nfs/dbraw/zinc/36/54/55/210365455.db2.gz BBDGNIULVDQNQA-MRXNPFEDSA-N 1 1 387.530 4.373 50 0 GIAAMO O=C(Nc1cc[nH]n1)c1ccc([C@H]2CCC[N@H+]2C2Cc3ccccc3C2)s1 ZINC000020858647 210364904 /nfs/dbraw/zinc/36/49/04/210364904.db2.gz CIZUKYSPKNHJRE-QGZVFWFLSA-N 1 1 378.501 4.028 50 0 GIAAMO CCc1noc(C[NH2+]C2CCN(c3cccc(-c4cccc(F)c4)c3)CC2)n1 ZINC000020785012 210362027 /nfs/dbraw/zinc/36/20/27/210362027.db2.gz XKMVVABXHIJCSI-UHFFFAOYSA-N 1 1 380.467 4.197 50 0 GIAAMO CC(C)n1ncc(NC(=O)c2ccc([C@@H]3CCC[N@@H+]3Cc3ccco3)s2)n1 ZINC000020586630 210351357 /nfs/dbraw/zinc/35/13/57/210351357.db2.gz LUYAYFOFMLNTOQ-HNNXBMFYSA-N 1 1 385.493 4.103 50 0 GIAAMO CC(C)n1ncc(NC(=O)c2ccc([C@@H]3CCC[N@H+]3Cc3ccco3)s2)n1 ZINC000020586630 210351360 /nfs/dbraw/zinc/35/13/60/210351360.db2.gz LUYAYFOFMLNTOQ-HNNXBMFYSA-N 1 1 385.493 4.103 50 0 GIAAMO O=C(Nc1ccc(Cl)cc1)N(CCC[NH+]1CCOCC1)Cc1ccccc1 ZINC000020522307 210344224 /nfs/dbraw/zinc/34/42/24/210344224.db2.gz VUZKXTJEYJJPHN-UHFFFAOYSA-N 1 1 387.911 4.096 50 0 GIAAMO COc1ccccc1C(=O)Nc1ccc2c(c1)C[N@@H+](Cc1cnc(C)s1)CC2 ZINC000020515428 210343029 /nfs/dbraw/zinc/34/30/29/210343029.db2.gz BVDSQMSTJUJVIH-UHFFFAOYSA-N 1 1 393.512 4.271 50 0 GIAAMO COc1ccccc1C(=O)Nc1ccc2c(c1)C[N@H+](Cc1cnc(C)s1)CC2 ZINC000020515428 210343034 /nfs/dbraw/zinc/34/30/34/210343034.db2.gz BVDSQMSTJUJVIH-UHFFFAOYSA-N 1 1 393.512 4.271 50 0 GIAAMO CC(=O)CCc1ccc(OCCCCN2CC[NH+](Cc3ccccc3)CC2)cc1 ZINC000020500015 210342131 /nfs/dbraw/zinc/34/21/31/210342131.db2.gz UISUBEGXAWUGEQ-UHFFFAOYSA-N 1 1 394.559 4.185 50 0 GIAAMO c1ccc(CN2CC[NH+](CCOCCOc3cccc4ccccc43)CC2)cc1 ZINC000020500128 210341151 /nfs/dbraw/zinc/34/11/51/210341151.db2.gz UBSIOKKUUBUUDQ-UHFFFAOYSA-N 1 1 390.527 4.053 50 0 GIAAMO FC(F)(F)c1cccc(N2CCN([C@@H]3CCC[N@@H+](CC4CCCC4)C3)CC2)c1 ZINC000020539143 210345471 /nfs/dbraw/zinc/34/54/71/210345471.db2.gz ICHVNAMBASXGKY-OAQYLSRUSA-N 1 1 395.513 4.482 50 0 GIAAMO Cc1c(=O)[nH]c(-c2ccc(C[N@@H+](C)Cc3ccco3)cc2)nc1C(F)(F)F ZINC000020351489 210329628 /nfs/dbraw/zinc/32/96/28/210329628.db2.gz UTCPOPNKUPSJCV-UHFFFAOYSA-N 1 1 377.366 4.401 50 0 GIAAMO O=C(/C=C/c1ccc(Cl)cc1Cl)N1CC[NH+](Cc2ccccc2)CC1 ZINC000020240065 210324076 /nfs/dbraw/zinc/32/40/76/210324076.db2.gz HJRVIXBPLNBTHS-VQHVLOKHSA-N 1 1 375.299 4.351 50 0 GIAAMO CNc1cc(C(=O)N2CC[C@@]3(C2)CCC[N@@H+](CCC2CCCCC2)C3)ccn1 ZINC000020453670 210335471 /nfs/dbraw/zinc/33/54/71/210335471.db2.gz INTXMWORZMGEFJ-QHCPKHFHSA-N 1 1 384.568 4.022 50 0 GIAAMO CC(C)Oc1ccc(-c2cc(C(=O)N3CC[NH+](C)CC3)c3ccccc3n2)cc1 ZINC000020149348 210319430 /nfs/dbraw/zinc/31/94/30/210319430.db2.gz LOHJKACEHHGXLJ-UHFFFAOYSA-N 1 1 389.499 4.077 50 0 GIAAMO OC[C@@H]1CCC[N@H+]1Cc1cn(Cc2ccccc2)nc1-c1cc2ccccc2o1 ZINC000019772237 210294751 /nfs/dbraw/zinc/29/47/51/210294751.db2.gz QYOCUOJGKBUPOF-NRFANRHFSA-N 1 1 387.483 4.301 50 0 GIAAMO O=C(/C=C/c1ccc(Cl)c(Cl)c1)N1CC[NH+](Cc2ccccc2)CC1 ZINC000019760158 210294530 /nfs/dbraw/zinc/29/45/30/210294530.db2.gz YHSACPZDASKGQX-VQHVLOKHSA-N 1 1 375.299 4.351 50 0 GIAAMO COc1ccccc1/C=C/C[N@H+]1CCC[C@](CO)(CCOc2ccccc2)C1 ZINC000011816500 221128476 /nfs/dbraw/zinc/12/84/76/221128476.db2.gz NGNXLIAMXUWCKN-REXAPNPKSA-N 1 1 381.516 4.252 50 0 GIAAMO COc1ccc(-c2n[nH]cc2C[N@@H+](C)[C@@H](C)c2ccc3c(c2)OCCO3)c(F)c1 ZINC000011935313 221139195 /nfs/dbraw/zinc/13/91/95/221139195.db2.gz IDOOFEYJKNMNIY-AWEZNQCLSA-N 1 1 397.450 4.189 50 0 GIAAMO CC(=O)N1CCC([N@H+]2CCC[C@@H](CCc3cccc(C(F)(F)F)c3)C2)CC1 ZINC000011935030 221139596 /nfs/dbraw/zinc/13/95/96/221139596.db2.gz QYMQOGLHXQUBCF-SFHVURJKSA-N 1 1 382.470 4.361 50 0 GIAAMO O=C1Nc2ccccc2NC12CCN(c1cc[nH+]c3cc(Cl)ccc31)CC2 ZINC000082137678 136173936 /nfs/dbraw/zinc/17/39/36/136173936.db2.gz HNSSIMGMDNHAKS-UHFFFAOYSA-N 1 1 378.863 4.291 50 0 GIAAMO CCCc1cc(N2CCC([N@@H+](C)Cc3cccc4cnccc43)CC2)nc(C)n1 ZINC000095504602 136180233 /nfs/dbraw/zinc/18/02/33/136180233.db2.gz MAHFKCSPIXYANQ-UHFFFAOYSA-N 1 1 389.547 4.387 50 0 GIAAMO C[C@@H]1C[N@@H+](Cc2ccc(C(=O)N3CCC[C@@H]3c3ccsc3)cc2)C[C@H](C)O1 ZINC000048251674 570226968 /nfs/dbraw/zinc/22/69/68/570226968.db2.gz CXLRGMFDVFXTRE-LLGFUMIMSA-N 1 1 384.545 4.335 50 0 GIAAMO C[C@@H]1C[N@H+](Cc2ccc(C(=O)N3CCC[C@@H]3c3ccsc3)cc2)C[C@H](C)O1 ZINC000048251674 570226971 /nfs/dbraw/zinc/22/69/71/570226971.db2.gz CXLRGMFDVFXTRE-LLGFUMIMSA-N 1 1 384.545 4.335 50 0 GIAAMO C[C@@H]1C[NH+](Cc2ccccc2CNC(=O)c2ccc(F)cc2Cl)C[C@@H](C)O1 ZINC000048358454 570243093 /nfs/dbraw/zinc/24/30/93/570243093.db2.gz RAIPOBNRNINIJE-HUUCEWRRSA-N 1 1 390.886 4.018 50 0 GIAAMO Cc1ccc(Cl)cc1NC(=O)[C@@H](C)[N@@H+]1CCC[C@H](C(=O)Nc2ccccc2)C1 ZINC000035262666 570278541 /nfs/dbraw/zinc/27/85/41/570278541.db2.gz VQCLFBRLTHMMTO-SJORKVTESA-N 1 1 399.922 4.326 50 0 GIAAMO Cc1ccc(Cl)cc1NC(=O)[C@@H](C)[N@H+]1CCC[C@H](C(=O)Nc2ccccc2)C1 ZINC000035262666 570278542 /nfs/dbraw/zinc/27/85/42/570278542.db2.gz VQCLFBRLTHMMTO-SJORKVTESA-N 1 1 399.922 4.326 50 0 GIAAMO CC(C)[C@@H](NC(=O)C[N@@H+]1CCC[C@H]1c1ccc2c(c1)OCCO2)c1ccccc1 ZINC000248144685 570287954 /nfs/dbraw/zinc/28/79/54/570287954.db2.gz DNQBMRHURNTACY-GBXCKJPGSA-N 1 1 394.515 4.108 50 0 GIAAMO CC(C)[C@@H](NC(=O)C[N@H+]1CCC[C@H]1c1ccc2c(c1)OCCO2)c1ccccc1 ZINC000248144685 570287959 /nfs/dbraw/zinc/28/79/59/570287959.db2.gz DNQBMRHURNTACY-GBXCKJPGSA-N 1 1 394.515 4.108 50 0 GIAAMO CC(C)CNC(=O)c1ccc(C[NH+]2CCN(c3ccccc3Cl)CC2)cc1 ZINC000034684418 570301510 /nfs/dbraw/zinc/30/15/10/570301510.db2.gz YKCRMELLUBEPAU-UHFFFAOYSA-N 1 1 385.939 4.048 50 0 GIAAMO C[N@H+]1CCC[C@@H]1Cc1c[nH]c2ccc(/C=C/S(=O)(=O)c3ccccc3)cc12 ZINC000022049749 570303165 /nfs/dbraw/zinc/30/31/65/570303165.db2.gz MJICWWOZPCLNBP-XSSIKURBSA-N 1 1 380.513 4.249 50 0 in-vitro GIAAMO C[NH+](C)CCNCc1cc(Br)ccc1OCc1ccc(Cl)cc1 ZINC000022075466 570305375 /nfs/dbraw/zinc/30/53/75/570305375.db2.gz GSAUWCVYXSOJOL-UHFFFAOYSA-N 1 1 397.744 4.333 50 0 GIAAMO Cc1cc([C@H]2C[C@@H](C(=O)NC3CC3)C[N@@H+](Cc3ccc(F)cc3)C2)ccc1F ZINC000034716649 570319504 /nfs/dbraw/zinc/31/95/04/570319504.db2.gz IEWAIOTWEUUXAC-RBUKOAKNSA-N 1 1 384.470 4.158 50 0 GIAAMO Cc1ccc2c(C[NH+]3CCN(Cc4cccc(Cl)c4)CC3)cc(=O)oc2c1 ZINC000022752964 570326370 /nfs/dbraw/zinc/32/63/70/570326370.db2.gz WRHWVCAYGJOCSG-UHFFFAOYSA-N 1 1 382.891 4.073 50 0 biogenic,in-vitro GIAAMO O[C@H](c1cc2n(n1)CCC[N@H+](C1CCc3ccccc3CC1)C2)c1ccccc1 ZINC000219345046 570356123 /nfs/dbraw/zinc/35/61/23/570356123.db2.gz YNYDQLSCCXNTDW-VWLOTQADSA-N 1 1 387.527 4.118 50 0 GIAAMO COc1ccc(C[NH2+][C@H](C)c2ccccc2Br)c(OC)c1OC ZINC000022777518 570377265 /nfs/dbraw/zinc/37/72/65/570377265.db2.gz VVOJRJPWWQZHSD-GFCCVEGCSA-N 1 1 380.282 4.326 50 0 GIAAMO CCc1ccc(CN2CCC([NH+]3CCN(c4ccccc4OC)CC3)CC2)cc1 ZINC000004703451 570395407 /nfs/dbraw/zinc/39/54/07/570395407.db2.gz FIKKZAYVXCIXNP-UHFFFAOYSA-N 1 1 393.575 4.044 50 0 GIAAMO O=C([C@H]1CCC[N@H+](Cc2cccc(Br)c2)C1)N1CCCCCC1 ZINC000004744869 570401736 /nfs/dbraw/zinc/40/17/36/570401736.db2.gz BAKKADZPEIAHBZ-KRWDZBQOSA-N 1 1 379.342 4.064 50 0 GIAAMO O=C([C@@H]1CCC[N@H+](Cc2ccc(Br)cc2)C1)N1CCCCCC1 ZINC000004744904 570401765 /nfs/dbraw/zinc/40/17/65/570401765.db2.gz GRORKUIIVUJROL-QGZVFWFLSA-N 1 1 379.342 4.064 50 0 GIAAMO COc1cccc(C2=NN(C(=O)C[NH+]3CCCCC3)[C@@H](c3ccc(C)cc3)C2)c1 ZINC000035783338 570448336 /nfs/dbraw/zinc/44/83/36/570448336.db2.gz BMJZAZIEAWWHHL-HSZRJFAPSA-N 1 1 391.515 4.167 50 0 GIAAMO COc1cccc(-c2nc(C)c(C(=O)NC[C@@H]3CCC[N@H+]4CCCC[C@@H]34)s2)c1 ZINC000028349624 570458713 /nfs/dbraw/zinc/45/87/13/570458713.db2.gz ZLIOQFUWHUSKEL-HKUYNNGSSA-N 1 1 399.560 4.121 50 0 GIAAMO O[C@]12CCCC[C@@H]1[C@@H](c1ccc3c(c1)OCO3)[N@@H+](Cc1ccc(F)cc1)CC2 ZINC000006576847 570480904 /nfs/dbraw/zinc/48/09/04/570480904.db2.gz NHBIUSXQFCMSRS-PTUXOGIPSA-N 1 1 383.463 4.423 50 0 GIAAMO c1[nH]nc(-c2ccc3c(c2)OCO3)c1C[NH2+]CC1(N2CCCCC2)CCCCC1 ZINC000032516076 570510722 /nfs/dbraw/zinc/51/07/22/570510722.db2.gz NGITXEPPJYAJDQ-UHFFFAOYSA-N 1 1 396.535 4.084 50 0 GIAAMO CCOc1ccc(C[N@H+](Cc2nc(C(=O)N3CCCC3)co2)[C@H](C)C(C)C)cc1 ZINC000036063953 570526006 /nfs/dbraw/zinc/52/60/06/570526006.db2.gz LLGOLCGTYUYLQM-GOSISDBHSA-N 1 1 399.535 4.356 50 0 GIAAMO CCOc1ccc(C[N@@H+](Cc2nc(C(=O)N3CCCC3)co2)[C@H](C)C(C)C)cc1 ZINC000036063953 570526008 /nfs/dbraw/zinc/52/60/08/570526008.db2.gz LLGOLCGTYUYLQM-GOSISDBHSA-N 1 1 399.535 4.356 50 0 GIAAMO COc1ccc(C[N@H+](Cc2ccccc2F)C[C@H](O)Cc2ccccc2)cc1 ZINC000036095346 570534215 /nfs/dbraw/zinc/53/42/15/570534215.db2.gz KOGAMEKGHPGXQG-JOCHJYFZSA-N 1 1 379.475 4.440 50 0 GIAAMO COc1ccc(C[N@H+](Cc2cccc(C)c2)C[C@@H](O)COCc2ccco2)cc1 ZINC000036095321 570534455 /nfs/dbraw/zinc/53/44/55/570534455.db2.gz JYKSFNCIJUIKLZ-JOCHJYFZSA-N 1 1 395.499 4.177 50 0 GIAAMO COc1ccc(OC[C@H](O)C[N@@H+](Cc2ccccc2)Cc2ccc(C)cc2)cc1 ZINC000036101751 570538376 /nfs/dbraw/zinc/53/83/76/570538376.db2.gz UYJTVYLMHLVSAQ-HSZRJFAPSA-N 1 1 391.511 4.446 50 0 GIAAMO COc1ccc(OC[C@@H](O)C[N@@H+](Cc2cccs2)Cc2ccccc2)cc1 ZINC000036103331 570540080 /nfs/dbraw/zinc/54/00/80/570540080.db2.gz SIWDHDQMIIEUDM-IBGZPJMESA-N 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ZINC000012386147 221187614 /nfs/dbraw/zinc/18/76/14/221187614.db2.gz HELHHASANJPLAU-IBGZPJMESA-N 1 1 385.577 4.436 50 0 GIAAMO CC(=O)c1cc(C(=O)N2CC[C@@]3(C2)CCC[N@@H+](CC2CCCCC2)C3)cs1 ZINC000012595247 221213342 /nfs/dbraw/zinc/21/33/42/221213342.db2.gz RMUUCZKOLOTWRJ-QFIPXVFZSA-N 1 1 388.577 4.459 50 0 GIAAMO C[NH+](C)[C@@H](CNC(=O)c1cc(F)ccc1Br)c1ccccc1Cl ZINC000012748294 221223591 /nfs/dbraw/zinc/22/35/91/221223591.db2.gz PYEFHOQLVQGRDC-INIZCTEOSA-N 1 1 399.691 4.274 50 0 GIAAMO OC[C@@]1(Cc2ccccc2)CCC[N@@H+](Cc2ccc(OC(F)(F)F)cc2)C1 ZINC000012708920 221219162 /nfs/dbraw/zinc/21/91/62/221219162.db2.gz LLPVVEBKMYZRMZ-HXUWFJFHSA-N 1 1 379.422 4.402 50 0 GIAAMO COc1ccc(C(=O)[C@@H]2CCC[N@@H+](Cc3cccc4cnccc43)C2)cc1OC ZINC000012715642 221221019 /nfs/dbraw/zinc/22/10/19/221221019.db2.gz QBINGCHOTFZKRW-HXUWFJFHSA-N 1 1 390.483 4.347 50 0 GIAAMO COCC[C@@H]1CCCC[N@H+]1Cc1nc(-c2ccc(OC)c(C)c2OC)oc1C ZINC000012718722 221221703 /nfs/dbraw/zinc/22/17/03/221221703.db2.gz ZTVJXDROYPJYES-KRWDZBQOSA-N 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COc1ccc([C@@H]2CCC[N@@H+]2CC(=O)N[C@@H](C)c2ccc(C)c(C)c2)c(OC)c1 ZINC000012984505 221252628 /nfs/dbraw/zinc/25/26/28/221252628.db2.gz IVXZFRCWVYTUAF-AVRDEDQJSA-N 1 1 396.531 4.335 50 0 GIAAMO COc1ccc([C@@H]2CCC[N@H+]2CC(=O)N[C@@H](C)c2ccc(C)c(C)c2)c(OC)c1 ZINC000012984505 221252634 /nfs/dbraw/zinc/25/26/34/221252634.db2.gz IVXZFRCWVYTUAF-AVRDEDQJSA-N 1 1 396.531 4.335 50 0 GIAAMO COc1ccccc1NC(=O)[C@@H](C)[N@H+]1CC=C(c2c[nH]c3ccccc32)CC1 ZINC000013004818 221256391 /nfs/dbraw/zinc/25/63/91/221256391.db2.gz HIYIWDNSHNGWHH-MRXNPFEDSA-N 1 1 375.472 4.293 50 0 GIAAMO COc1ccccc1NC(=O)[C@@H](C)[N@@H+]1CC=C(c2c[nH]c3ccccc32)CC1 ZINC000013004818 221256393 /nfs/dbraw/zinc/25/63/93/221256393.db2.gz HIYIWDNSHNGWHH-MRXNPFEDSA-N 1 1 375.472 4.293 50 0 GIAAMO Cc1cccc(C)c1NC(=O)C[N@@H+](Cc1ccc2c(c1)OCO2)C1CCCC1 ZINC000012995390 221254649 /nfs/dbraw/zinc/25/46/49/221254649.db2.gz XZHNZVJGROEYRH-UHFFFAOYSA-N 1 1 380.488 4.415 50 0 GIAAMO Cc1cccc(C(C)C)c1NC(=O)C[N@H+](C)[C@@H](C)c1ccc(-n2cncn2)cc1 ZINC000013020910 221257430 /nfs/dbraw/zinc/25/74/30/221257430.db2.gz LXNHQPBYZXFOTJ-SFHVURJKSA-N 1 1 391.519 4.331 50 0 GIAAMO Cc1cccc(C(C)C)c1NC(=O)C[N@@H+](C)[C@@H](C)c1ccc(-n2cncn2)cc1 ZINC000013020910 221257433 /nfs/dbraw/zinc/25/74/33/221257433.db2.gz LXNHQPBYZXFOTJ-SFHVURJKSA-N 1 1 391.519 4.331 50 0 GIAAMO CCOC(=O)N1CCC([N@H+]2CCC[C@@H](C(=O)c3ccc(Cl)cc3C)C2)CC1 ZINC000014964251 221321253 /nfs/dbraw/zinc/32/12/53/221321253.db2.gz PFWLKNQUMOAGNM-MRXNPFEDSA-N 1 1 392.927 4.164 50 0 GIAAMO CC(C)c1ccc(C[N@H+]2CCC[C@@]3(CCN(C(=O)C(=O)c4ccco4)C3)C2)cc1 ZINC000014961628 221322166 /nfs/dbraw/zinc/32/21/66/221322166.db2.gz UBOBQBHCXMYZRH-XMMPIXPASA-N 1 1 394.515 4.100 50 0 GIAAMO COc1ccc(CC[N@H+]2CCC[C@H](C[NH+](C)Cc3cc(C)c(O)c(C)c3)C2)cc1 ZINC000014971896 221322200 /nfs/dbraw/zinc/32/22/00/221322200.db2.gz HPAMTKGDMBICGY-JOCHJYFZSA-N 1 1 396.575 4.404 50 0 GIAAMO COc1ccc(CC[NH+]2CCC[C@H](C[N@H+](C)Cc3cc(C)c(O)c(C)c3)C2)cc1 ZINC000014971896 221322202 /nfs/dbraw/zinc/32/22/02/221322202.db2.gz HPAMTKGDMBICGY-JOCHJYFZSA-N 1 1 396.575 4.404 50 0 GIAAMO COc1ccc(CC[NH+]2CCC[C@H](C[N@@H+](C)Cc3cc(C)c(O)c(C)c3)C2)cc1 ZINC000014971896 221322203 /nfs/dbraw/zinc/32/22/03/221322203.db2.gz HPAMTKGDMBICGY-JOCHJYFZSA-N 1 1 396.575 4.404 50 0 GIAAMO COc1ccc(CC[N@@H+]2CCC[C@H](CN(C)Cc3cc(C)c(O)c(C)c3)C2)cc1 ZINC000014971896 221322205 /nfs/dbraw/zinc/32/22/05/221322205.db2.gz HPAMTKGDMBICGY-JOCHJYFZSA-N 1 1 396.575 4.404 50 0 GIAAMO COc1ccc(CC[N@H+]2CCC[C@H](CN(C)Cc3cc(C)c(O)c(C)c3)C2)cc1 ZINC000014971896 221322206 /nfs/dbraw/zinc/32/22/06/221322206.db2.gz HPAMTKGDMBICGY-JOCHJYFZSA-N 1 1 396.575 4.404 50 0 GIAAMO COc1ccc(CCN2CCC[C@H](C[N@H+](C)Cc3cc(C)c(O)c(C)c3)C2)cc1 ZINC000014971896 221322208 /nfs/dbraw/zinc/32/22/08/221322208.db2.gz HPAMTKGDMBICGY-JOCHJYFZSA-N 1 1 396.575 4.404 50 0 GIAAMO COc1ccc(CCN2CCC[C@H](C[N@@H+](C)Cc3cc(C)c(O)c(C)c3)C2)cc1 ZINC000014971896 221322210 /nfs/dbraw/zinc/32/22/10/221322210.db2.gz HPAMTKGDMBICGY-JOCHJYFZSA-N 1 1 396.575 4.404 50 0 GIAAMO O=C(Nc1cccc(-c2cc3ccccc3[nH]2)c1)[C@H]1CCC[N@H+]1C1CCOCC1 ZINC000014962017 221322576 /nfs/dbraw/zinc/32/25/76/221322576.db2.gz BTSDTFWSRKBEBU-HSZRJFAPSA-N 1 1 389.499 4.417 50 0 GIAAMO O=C(c1cccc2ccccc21)[C@@H]1CCC[N@H+](Cc2ccc(OCCO)cc2)C1 ZINC000014955990 221320473 /nfs/dbraw/zinc/32/04/73/221320473.db2.gz ISLUBIWXNTWZFE-OAQYLSRUSA-N 1 1 389.495 4.306 50 0 GIAAMO CCOc1cc(C[N@H+](CCc2ccccc2)C[C@H]2CCCN(C)C2)ccc1OC ZINC000014950151 221321023 /nfs/dbraw/zinc/32/10/23/221321023.db2.gz OWUJQCUXOOMYEP-QHCPKHFHSA-N 1 1 396.575 4.480 50 0 GIAAMO CCOc1cc(C[N@@H+](CCc2ccccc2)C[C@H]2CCCN(C)C2)ccc1OC ZINC000014950151 221321025 /nfs/dbraw/zinc/32/10/25/221321025.db2.gz OWUJQCUXOOMYEP-QHCPKHFHSA-N 1 1 396.575 4.480 50 0 GIAAMO O=C(Nc1ccc(-n2cccn2)cc1)[C@H]1CCCC[N@@H+]1Cc1cc2ccccc2[nH]1 ZINC000015078563 221332758 /nfs/dbraw/zinc/33/27/58/221332758.db2.gz BAZCDLLUMUUMLN-HSZRJFAPSA-N 1 1 399.498 4.347 50 0 GIAAMO O=C(Nc1ccc(-n2cccn2)cc1)[C@H]1CCCC[N@H+]1Cc1cc2ccccc2[nH]1 ZINC000015078563 221332760 /nfs/dbraw/zinc/33/27/60/221332760.db2.gz BAZCDLLUMUUMLN-HSZRJFAPSA-N 1 1 399.498 4.347 50 0 GIAAMO COc1ccc([C@H]2CCC[N@@H+]2CC(=O)N(C)[C@@H](C)c2ccccc2)c(OC)c1 ZINC000015367104 221335039 /nfs/dbraw/zinc/33/50/39/221335039.db2.gz WRZGNUPICYVYHW-LAUBAEHRSA-N 1 1 382.504 4.060 50 0 GIAAMO COc1ccc([C@H]2CCC[N@H+]2CC(=O)N(C)[C@@H](C)c2ccccc2)c(OC)c1 ZINC000015367104 221335041 /nfs/dbraw/zinc/33/50/41/221335041.db2.gz WRZGNUPICYVYHW-LAUBAEHRSA-N 1 1 382.504 4.060 50 0 GIAAMO CCOC(=O)[C@@]1(CCOc2ccccc2)CCC[N@@H+](Cc2cccc(O)c2)C1 ZINC000014980697 221323790 /nfs/dbraw/zinc/32/37/90/221323790.db2.gz FMSHMUZRIFIZMV-HSZRJFAPSA-N 1 1 383.488 4.007 50 0 GIAAMO Cc1cccc(C[N@@H+]2CCC[C@@]3(CCN(C(=O)c4cc(C(C)C)no4)C3)C2)c1 ZINC000014980431 221323896 /nfs/dbraw/zinc/32/38/96/221323896.db2.gz CCRDEOWYZOVFDJ-HSZRJFAPSA-N 1 1 381.520 4.235 50 0 GIAAMO COC[C@@H]1CC[N@@H+](Cc2cn(-c3ccc(C)cc3)nc2-c2ccc(F)cc2)C1 ZINC000015068695 221329053 /nfs/dbraw/zinc/32/90/53/221329053.db2.gz 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CCCOc1ccc(N2C(=O)C[C@H]([NH+]3CCC(C4CCCCC4)CC3)C2=O)cc1 ZINC000018220133 221389991 /nfs/dbraw/zinc/38/99/91/221389991.db2.gz CHNCOGBXILVWDT-QFIPXVFZSA-N 1 1 398.547 4.400 50 0 GIAAMO Cc1csc(SCC(=O)N2CC[NH+](Cc3cccc4ccccc43)CC2)n1 ZINC000018975515 221394179 /nfs/dbraw/zinc/39/41/79/221394179.db2.gz XFKHLYHKTIFAKC-UHFFFAOYSA-N 1 1 397.569 4.041 50 0 GIAAMO Cc1cc(N2CCC3(CCCN3Cc3cccnc3N)CC2)c2ccccc2[nH+]1 ZINC000072438403 136170563 /nfs/dbraw/zinc/17/05/63/136170563.db2.gz COQNTUUTCMZGPH-UHFFFAOYSA-N 1 1 387.531 4.155 50 0 GIAAMO FC(F)(F)c1cccnc1N1CCC[C@H](c2[nH+]ccn2Cc2ccncc2)C1 ZINC000095499049 136179757 /nfs/dbraw/zinc/17/97/57/136179757.db2.gz ZRURTLAIXYNTLB-INIZCTEOSA-N 1 1 387.409 4.124 50 0 GIAAMO c1cn(Cc2cscn2)c(C2CCN(c3nccc(C4CCCC4)n3)CC2)[nH+]1 ZINC000095516526 136180888 /nfs/dbraw/zinc/18/08/88/136180888.db2.gz YGBNZCFVTKHBNZ-UHFFFAOYSA-N 1 1 394.548 4.220 50 0 GIAAMO FC(F)(F)c1ccnc(N2CCC[C@H](c3[nH+]ccn3Cc3ccncc3)C2)c1 ZINC000095531377 136181801 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Cc1ccsc1C(=O)[C@@H]1CCC[N@@H+](Cc2cc(F)ccc2-n2cccn2)C1 ZINC000055360742 222020173 /nfs/dbraw/zinc/02/01/73/222020173.db2.gz NEFIMYJEACGIMX-MRXNPFEDSA-N 1 1 383.492 4.476 50 0 GIAAMO C[C@@H](Sc1nncs1)C(=O)Nc1ccc(C[N@H+]2CCCC[C@@H]2C)cc1 ZINC000055459042 222023006 /nfs/dbraw/zinc/02/30/06/222023006.db2.gz ASQOBXXXAFLOOW-UONOGXRCSA-N 1 1 376.551 4.032 50 0 GIAAMO C[C@H]1CCCC[N@H+]1Cc1nc(-c2ccc(N(C)Cc3ccccc3)nc2)no1 ZINC000065216367 222111797 /nfs/dbraw/zinc/11/17/97/222111797.db2.gz AOEQVWDGQZHLQJ-KRWDZBQOSA-N 1 1 377.492 4.142 50 0 GIAAMO Cc1onc(-c2ccccc2Cl)c1C(=O)N1CCC(Cn2cc[nH+]c2C)CC1 ZINC000062017642 222066600 /nfs/dbraw/zinc/06/66/00/222066600.db2.gz VOPDMTHWBSDCFE-UHFFFAOYSA-N 1 1 398.894 4.361 50 0 GIAAMO C[C@H]1CCC[N@@H+](CCCNC(=O)c2ccc3nc(Cc4ccccc4)oc3c2)C1 ZINC000064967973 222091432 /nfs/dbraw/zinc/09/14/32/222091432.db2.gz HSORDUQXWZOUAU-SFHVURJKSA-N 1 1 391.515 4.270 50 0 GIAAMO CC(C)Cn1cncc1C[N@@H+]1CCC[C@@H](C(=O)c2cccc(OC(C)C)c2)C1 ZINC000071748395 222189291 /nfs/dbraw/zinc/18/92/91/222189291.db2.gz ONRQYHHAZOAIDY-HXUWFJFHSA-N 1 1 383.536 4.421 50 0 GIAAMO CC(C)Cn1cncc1C[N@H+]1CCC[C@@H](C(=O)c2cccc(OC(C)C)c2)C1 ZINC000071748395 222189292 /nfs/dbraw/zinc/18/92/92/222189292.db2.gz ONRQYHHAZOAIDY-HXUWFJFHSA-N 1 1 383.536 4.421 50 0 GIAAMO CC(C)c1[nH+]ccn1[C@@H](C)c1nc(CCc2ccccc2)nn1-c1ccccn1 ZINC000065380987 222127018 /nfs/dbraw/zinc/12/70/18/222127018.db2.gz BCKGAZZNDWGYPR-SFHVURJKSA-N 1 1 386.503 4.377 50 0 GIAAMO O=C(c1ccccn1)N1CCC([N@H+]2CCC[C@@H](CCc3ccc(F)cc3)C2)CC1 ZINC000071479603 222186305 /nfs/dbraw/zinc/18/63/05/222186305.db2.gz BONNQEKBZFFOCI-FQEVSTJZSA-N 1 1 395.522 4.170 50 0 GIAAMO CNC(=O)[C@H]1CC[N@@H+](Cc2nc(-c3cccc(Oc4ccccc4)c3)oc2C)C1 ZINC000071774677 222197219 /nfs/dbraw/zinc/19/72/19/222197219.db2.gz CSGMFEIHAGGNSC-SFHVURJKSA-N 1 1 391.471 4.010 50 0 GIAAMO CC(C)c1cc(C(=O)N2CCC[N@@H+](Cc3ccc(F)cc3)[C@H](C(C)C)C2)no1 ZINC000072153432 222212065 /nfs/dbraw/zinc/21/20/65/222212065.db2.gz KIYOGTLNUWUTKK-FQEVSTJZSA-N 1 1 387.499 4.310 50 0 GIAAMO CC(C)[C@H]1CN(C(=O)c2cc(C3CC3)on2)CCC[N@H+]1Cc1ccc(F)cc1 ZINC000072164565 222214829 /nfs/dbraw/zinc/21/48/29/222214829.db2.gz KTTOSOWRQPYNLA-HXUWFJFHSA-N 1 1 385.483 4.064 50 0 GIAAMO CCN(C(=O)Nc1nnc(C2CC2)s1)[C@H]1CC[N@H+]([C@@H](C)c2ccccc2)C1 ZINC000072314422 222225806 /nfs/dbraw/zinc/22/58/06/222225806.db2.gz LTADSNRBKKRSIL-YOEHRIQHSA-N 1 1 385.537 4.105 50 0 GIAAMO Cn1cc(C[N@@H+]2CCc3n[nH]cc3C2)c(-c2ccc(C3CCCCC3)cc2)n1 ZINC000072481589 222267085 /nfs/dbraw/zinc/26/70/85/222267085.db2.gz MAAVYWFHTJQUSX-UHFFFAOYSA-N 1 1 375.520 4.416 50 0 GIAAMO Cn1cc(C[N@H+]2CCc3n[nH]cc3C2)c(-c2ccc(C3CCCCC3)cc2)n1 ZINC000072481589 222267088 /nfs/dbraw/zinc/26/70/88/222267088.db2.gz MAAVYWFHTJQUSX-UHFFFAOYSA-N 1 1 375.520 4.416 50 0 GIAAMO COCC[N@@H+](C)Cc1cn(-c2ccc(OC)cc2)nc1-c1ccccc1Cl ZINC000072410281 222255883 /nfs/dbraw/zinc/25/58/83/222255883.db2.gz MWZTXQWNLQUNMV-UHFFFAOYSA-N 1 1 385.895 4.280 50 0 GIAAMO Cc1cccc(-n2cc(CN3CC[N@@H+](C)[C@H](C)C3)c(-c3cccc(F)c3)n2)c1 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381.549 4.148 50 0 GIAAMO Cc1cccc(-n2cc(C[N@H+]3CCC[C@](C)(O)C3)c(-c3cccc(F)c3)n2)c1 ZINC000072435414 222261459 /nfs/dbraw/zinc/26/14/59/222261459.db2.gz CTLFJPFVXAUAFG-QHCPKHFHSA-N 1 1 379.479 4.334 50 0 GIAAMO COc1ccc(OC)c2nc(-c3cccc(Cl)c3)c(C[N@H+]3CC[C@@H](O)C3)cc12 ZINC000072477564 222265591 /nfs/dbraw/zinc/26/55/91/222265591.db2.gz NWJHTOXQNZGGQR-QGZVFWFLSA-N 1 1 398.890 4.139 50 0 GIAAMO CC(=O)c1ccccc1C(=O)N1C[C@H]2CC[C@@H]1C[N@@H+](CCCc1ccccc1)C2 ZINC000095511452 222342595 /nfs/dbraw/zinc/34/25/95/222342595.db2.gz LNYRRDWVLPCHHE-FCHUYYIVSA-N 1 1 390.527 4.058 50 0 GIAAMO C[C@@H](c1ccc(-n2cncn2)cc1)[N@@H+](C)Cc1cccc(SC(=O)N(C)C)c1 ZINC000079053294 222302020 /nfs/dbraw/zinc/30/20/20/222302020.db2.gz NTATXKMMNGYLBJ-INIZCTEOSA-N 1 1 395.532 4.234 50 0 GIAAMO CC(C)c1nc2cc(C(=O)NCC[N@H+]3CC[C@@H](c4ccccc4)C3)ccc2o1 ZINC000095525862 222351184 /nfs/dbraw/zinc/35/11/84/222351184.db2.gz RZWHVUSXDXWGFV-LJQANCHMSA-N 1 1 377.488 4.171 50 0 GIAAMO COCCC[N@@H+]1Cc2cccc(NC(=O)c3csc(-c4ccoc4)n3)c2C1 ZINC000095953402 222364332 /nfs/dbraw/zinc/36/43/32/222364332.db2.gz NPDYTKQXUICQPZ-UHFFFAOYSA-N 1 1 383.473 4.008 50 0 GIAAMO COCCC[N@H+]1Cc2cccc(NC(=O)c3csc(-c4ccoc4)n3)c2C1 ZINC000095953402 222364333 /nfs/dbraw/zinc/36/43/33/222364333.db2.gz NPDYTKQXUICQPZ-UHFFFAOYSA-N 1 1 383.473 4.008 50 0 GIAAMO CCc1nccc(CN2CCC3(CC2)C[C@@H](c2ccccc2)C[N@@H+](CC)C3)n1 ZINC000096136331 222386451 /nfs/dbraw/zinc/38/64/51/222386451.db2.gz RWORHLQPMIVPCJ-OAQYLSRUSA-N 1 1 378.564 4.131 50 0 GIAAMO CCc1nccc(CN2CCC3(CC2)C[C@@H](c2ccccc2)C[N@H+](CC)C3)n1 ZINC000096136331 222386455 /nfs/dbraw/zinc/38/64/55/222386455.db2.gz RWORHLQPMIVPCJ-OAQYLSRUSA-N 1 1 378.564 4.131 50 0 GIAAMO CC[N@H+]1C[C@H](c2ccccc2)CC2(CCN(C(=O)c3cnc(C)cc3C)CC2)C1 ZINC000096180506 222395987 /nfs/dbraw/zinc/39/59/87/222395987.db2.gz RGKFSJQWOMHLDI-JOCHJYFZSA-N 1 1 391.559 4.430 50 0 GIAAMO CC[NH+]1CCN(C(=O)C[C@@H](c2cn(C)c3ccccc23)c2ccccc2F)CC1 ZINC000106798149 222509371 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OC[C@@]1(CCc2ccccc2)CCC[N@@H+](Cc2cnn(-c3ccc(F)cc3)c2)C1 ZINC000012431947 221193762 /nfs/dbraw/zinc/19/37/62/221193762.db2.gz FAVPOFGLNIDHFP-XMMPIXPASA-N 1 1 393.506 4.219 50 0 GIAAMO O=C(NC[C@@H]1CCC[N@@H+](Cc2c[nH]nc2C2CCCCC2)C1)c1cccs1 ZINC000012445828 221196720 /nfs/dbraw/zinc/19/67/20/221196720.db2.gz AIGWZGTWBZZRPF-INIZCTEOSA-N 1 1 386.565 4.161 50 0 GIAAMO O=C(NC[C@H]1CCC[N@@H+](Cc2c[nH]nc2C2CCCCC2)C1)c1cccs1 ZINC000012445830 221196995 /nfs/dbraw/zinc/19/69/95/221196995.db2.gz AIGWZGTWBZZRPF-MRXNPFEDSA-N 1 1 386.565 4.161 50 0 GIAAMO CN(C(=O)c1cc2ccccc2n1C)[C@@H]1CCC[N@H+](Cc2ccccc2F)C1 ZINC000012448151 221197400 /nfs/dbraw/zinc/19/74/00/221197400.db2.gz TZZYCOFYAMZTFD-LJQANCHMSA-N 1 1 379.479 4.054 50 0 GIAAMO CN(C(=O)c1cc2ccccc2n1C)[C@@H]1CCC[N@@H+](Cc2ccccc2F)C1 ZINC000012448151 221197404 /nfs/dbraw/zinc/19/74/04/221197404.db2.gz TZZYCOFYAMZTFD-LJQANCHMSA-N 1 1 379.479 4.054 50 0 GIAAMO C[NH+](C)Cc1ccc(C(=O)N2CCC[C@@H](CCc3ccc(F)c(F)c3)C2)o1 ZINC000012464331 221197892 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GIAAMO OC[C@]1(Cc2ccccc2)CCC[N@@H+](Cc2ccc(OC(F)(F)F)cc2)C1 ZINC000012708926 221219706 /nfs/dbraw/zinc/21/97/06/221219706.db2.gz LLPVVEBKMYZRMZ-FQEVSTJZSA-N 1 1 379.422 4.402 50 0 GIAAMO COCCN(Cc1cccc(F)c1)C[C@H]1CCC[N@H+](C2Cc3ccccc3C2)C1 ZINC000012712731 221221188 /nfs/dbraw/zinc/22/11/88/221221188.db2.gz OPXLMMNTEGECSV-OAQYLSRUSA-N 1 1 396.550 4.154 50 0 GIAAMO CC[N@H+](CCn1cccn1)Cc1nc(-c2ccc(C(F)(F)F)cc2)oc1C ZINC000012586439 221211766 /nfs/dbraw/zinc/21/17/66/221211766.db2.gz PDGFYJBJCIEZFM-UHFFFAOYSA-N 1 1 378.398 4.387 50 0 GIAAMO CC[N@@H+](CCn1cccn1)Cc1nc(-c2ccc(C(F)(F)F)cc2)oc1C ZINC000012586439 221211768 /nfs/dbraw/zinc/21/17/68/221211768.db2.gz PDGFYJBJCIEZFM-UHFFFAOYSA-N 1 1 378.398 4.387 50 0 GIAAMO C[NH+](C)[C@@H](CNC(=O)c1ccc(F)cc1Br)c1ccccc1Cl ZINC000012755784 221225600 /nfs/dbraw/zinc/22/56/00/221225600.db2.gz NWOHSQPNIXRQID-INIZCTEOSA-N 1 1 399.691 4.274 50 0 GIAAMO CCC[N@H+](Cc1nc(-c2ccc(OC)c(C)c2OC)oc1C)C[C@H]1CCCO1 ZINC000012758058 221226955 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4.027 50 0 GIAAMO COc1ccc(OC)c([C@@H]2CCC[N@H+]2CC(=O)N[C@@H](C)c2ccccc2C)c1 ZINC000012997120 221254045 /nfs/dbraw/zinc/25/40/45/221254045.db2.gz LHYHSINTGNPXLN-UWJYYQICSA-N 1 1 382.504 4.027 50 0 GIAAMO O=C(Nc1ccccc1)[C@@H]1CCC[N@H+](CN2c3cccc4cccc(c34)C2=O)C1 ZINC000013007981 221256682 /nfs/dbraw/zinc/25/66/82/221256682.db2.gz JKBLFAXHQOSMRQ-GOSISDBHSA-N 1 1 385.467 4.108 50 0 GIAAMO O=C(Nc1ccccc1)[C@@H]1CCC[N@@H+](CN2c3cccc4cccc(c34)C2=O)C1 ZINC000013007981 221256684 /nfs/dbraw/zinc/25/66/84/221256684.db2.gz JKBLFAXHQOSMRQ-GOSISDBHSA-N 1 1 385.467 4.108 50 0 GIAAMO C[NH+](C)[C@H](CNC(=O)CCc1ncc(-c2ccccc2)o1)c1ccccc1Cl ZINC000013010417 221256877 /nfs/dbraw/zinc/25/68/77/221256877.db2.gz NNQBHJDQYVFCLY-LJQANCHMSA-N 1 1 397.906 4.347 50 0 GIAAMO O=C(Nc1nc(C[NH+]2CCCCCC2)cs1)c1ccc(OC(F)F)cc1 ZINC000013007488 221256909 /nfs/dbraw/zinc/25/69/09/221256909.db2.gz WAJQWURQWCHXKE-UHFFFAOYSA-N 1 1 381.448 4.373 50 0 GIAAMO Cc1cccc(C(C)C)c1NC(=O)C[N@H+](C)[C@H](C)c1ccc(-n2cncn2)cc1 ZINC000013020912 221258096 /nfs/dbraw/zinc/25/80/96/221258096.db2.gz LXNHQPBYZXFOTJ-GOSISDBHSA-N 1 1 391.519 4.331 50 0 GIAAMO Cc1cccc(C(C)C)c1NC(=O)C[N@@H+](C)[C@H](C)c1ccc(-n2cncn2)cc1 ZINC000013020912 221258098 /nfs/dbraw/zinc/25/80/98/221258098.db2.gz LXNHQPBYZXFOTJ-GOSISDBHSA-N 1 1 391.519 4.331 50 0 GIAAMO CCN(CC)C(=O)c1ccc(NC(=O)C[NH2+][C@H](C)c2ccccc2Cl)cc1 ZINC000013069542 221260747 /nfs/dbraw/zinc/26/07/47/221260747.db2.gz ZXIPUSABVPWDSI-OAHLLOKOSA-N 1 1 387.911 4.111 50 0 GIAAMO COc1cc2c(cc1OC)[C@H](c1cccs1)[N@@H+](C[C@@H](O)c1ccccc1)CC2 ZINC000013128314 221261940 /nfs/dbraw/zinc/26/19/40/221261940.db2.gz FJFFCYJYGDSGJR-AUSIDOKSSA-N 1 1 395.524 4.446 50 0 GIAAMO O[C@H](COc1ccc(F)cc1)C[N@H+]1CCc2sccc2[C@@H]1c1cccs1 ZINC000014077356 221298636 /nfs/dbraw/zinc/29/86/36/221298636.db2.gz ZUEHQQRQNOGCOM-MGPUTAFESA-N 1 1 389.517 4.336 50 0 GIAAMO CCOC(=O)c1c(NC(=O)Nc2ccc(F)cc2)sc2c1CC[N@H+](CC)C2 ZINC000014094940 221298731 /nfs/dbraw/zinc/29/87/31/221298731.db2.gz 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COc1ccc(C[NH+]2CCC(O)(Cc3cc(-c4ccccc4)no3)CC2)c(F)c1 ZINC000014949761 221318740 /nfs/dbraw/zinc/31/87/40/221318740.db2.gz WHCYRRPSQYNLRS-UHFFFAOYSA-N 1 1 396.462 4.059 50 0 GIAAMO COc1ccc(-c2nn(-c3ccccc3F)cc2C[N@H+](C)Cc2ccno2)cc1 ZINC000014947894 221319235 /nfs/dbraw/zinc/31/92/35/221319235.db2.gz PKPSSORRTNEUIG-UHFFFAOYSA-N 1 1 392.434 4.307 50 0 GIAAMO COc1ccc(-c2nn(-c3ccccc3F)cc2C[N@@H+](C)Cc2ccno2)cc1 ZINC000014947894 221319236 /nfs/dbraw/zinc/31/92/36/221319236.db2.gz PKPSSORRTNEUIG-UHFFFAOYSA-N 1 1 392.434 4.307 50 0 GIAAMO CCCC[C@@H]1C[N@H+](CCNC(=O)c2c(F)cccc2F)Cc2ccccc2O1 ZINC000014953352 221320024 /nfs/dbraw/zinc/32/00/24/221320024.db2.gz CXMLPFFFDKQUCE-QGZVFWFLSA-N 1 1 388.458 4.148 50 0 GIAAMO CCCC[C@@H]1C[N@@H+](CCNC(=O)c2c(F)cccc2F)Cc2ccccc2O1 ZINC000014953352 221320026 /nfs/dbraw/zinc/32/00/26/221320026.db2.gz CXMLPFFFDKQUCE-QGZVFWFLSA-N 1 1 388.458 4.148 50 0 GIAAMO CCN1CCOc2ccc(C[NH+]3CCC(OCc4ccccc4)CC3)cc2C1 ZINC000014955455 221320075 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4.477 50 0 GIAAMO COc1cccc(C(=O)[C@@H]2CCC[N@@H+](Cc3ccc4cccc(F)c4n3)C2)c1 ZINC000015073897 221331756 /nfs/dbraw/zinc/33/17/56/221331756.db2.gz IHHKYQMSNPHQLI-GOSISDBHSA-N 1 1 378.447 4.477 50 0 GIAAMO COCC[N@H+](Cc1ccc(Cl)cc1)Cc1cc(=O)c2cc(C)cc(C)c2[nH]1 ZINC000015862298 221350413 /nfs/dbraw/zinc/35/04/13/221350413.db2.gz SXPUBEOKWNENCN-UHFFFAOYSA-N 1 1 384.907 4.447 50 0 GIAAMO CC(C)c1ccc(NC(=O)C[N@H+](C)[C@H](C)c2ccc(-n3cncn3)cc2)cc1 ZINC000017305759 221382528 /nfs/dbraw/zinc/38/25/28/221382528.db2.gz UOMUOBKPKIMFJS-QGZVFWFLSA-N 1 1 377.492 4.022 50 0 GIAAMO CC(C)c1ccc(NC(=O)C[N@@H+](C)[C@H](C)c2ccc(-n3cncn3)cc2)cc1 ZINC000017305759 221382530 /nfs/dbraw/zinc/38/25/30/221382530.db2.gz UOMUOBKPKIMFJS-QGZVFWFLSA-N 1 1 377.492 4.022 50 0 GIAAMO O=C(Nc1cccc(Cl)c1Cl)N1CC[NH+](CCc2ccccc2)CC1 ZINC000017077334 221376688 /nfs/dbraw/zinc/37/66/88/221376688.db2.gz YMNUUKBTNOVWCG-UHFFFAOYSA-N 1 1 378.303 4.386 50 0 GIAAMO CCOc1cc2c(cc1OCC)[C@H](c1ccc(OC)c(OC)c1Cl)[NH2+]CC2 ZINC000020506991 221496602 /nfs/dbraw/zinc/49/66/02/221496602.db2.gz PJEZGMVCSXTLHC-FQEVSTJZSA-N 1 1 391.895 4.390 50 0 GIAAMO Cc1cccc([C@@H](CC(=O)N2CC[NH+](Cc3ccccc3)CC2)n2cccc2)c1 ZINC000020999049 221523024 /nfs/dbraw/zinc/52/30/24/221523024.db2.gz TTYFAQLBJITCIH-XMMPIXPASA-N 1 1 387.527 4.120 50 0 GIAAMO Cc1cc(C)cc(N2CCC([N@H+]3CCC[C@@H](CCC(=O)N4CCCC4)C3)CC2)c1 ZINC000039363341 136153706 /nfs/dbraw/zinc/15/37/06/136153706.db2.gz IOVYFPJTEJEJCV-QFIPXVFZSA-N 1 1 397.607 4.387 50 0 GIAAMO CCOc1ccccc1N1CC[NH+](Cc2ccc(OC(F)F)c(OC)c2)CC1 ZINC000058202588 136155035 /nfs/dbraw/zinc/15/50/35/136155035.db2.gz UIMAYHDXCFYPTH-UHFFFAOYSA-N 1 1 392.446 4.018 50 0 GIAAMO CCc1cc(C[N@H+]2CCCC23CCN(c2ccc(C(F)(F)F)cn2)CC3)on1 ZINC000072424397 136169786 /nfs/dbraw/zinc/16/97/86/136169786.db2.gz WVLMIIWUWJHHQX-UHFFFAOYSA-N 1 1 394.441 4.286 50 0 GIAAMO CCOc1ccccc1NC(=O)C[NH2+][C@@H](C)c1ccccc1Br ZINC000057315234 222029736 /nfs/dbraw/zinc/02/97/36/222029736.db2.gz SHDKETPCJHSDIE-ZDUSSCGKSA-N 1 1 377.282 4.137 50 0 GIAAMO COc1ccc(OC)c(NC(=O)C[NH2+][C@H](c2ccccc2)c2ccc(C)cc2)c1 ZINC000057363010 222031895 /nfs/dbraw/zinc/03/18/95/222031895.db2.gz WMNMAGHMUSMBES-XMMPIXPASA-N 1 1 390.483 4.330 50 0 GIAAMO CC[C@@H](CO)[N@@H+](Cc1ccc(F)cc1)Cc1cnc(NCc2ccccc2)nc1 ZINC000055182732 222015899 /nfs/dbraw/zinc/01/58/99/222015899.db2.gz XPMJGADOISTGIX-QFIPXVFZSA-N 1 1 394.494 4.001 50 0 GIAAMO CCN(Cc1cccc(C)n1)C[C@@H]1CCC[N@@H+](CCc2cccc(OC)c2)C1 ZINC000055254586 222017695 /nfs/dbraw/zinc/01/76/95/222017695.db2.gz FTZBIQOQBQYNHM-QFIPXVFZSA-N 1 1 381.564 4.175 50 0 GIAAMO CC[N@@H+](Cc1cccc(C)n1)C[C@@H]1CCCN(CCc2cccc(OC)c2)C1 ZINC000055254586 222017704 /nfs/dbraw/zinc/01/77/04/222017704.db2.gz FTZBIQOQBQYNHM-QFIPXVFZSA-N 1 1 381.564 4.175 50 0 GIAAMO CC[N@H+](Cc1cccc(C)n1)C[C@@H]1CCCN(CCc2cccc(OC)c2)C1 ZINC000055254586 222017706 /nfs/dbraw/zinc/01/77/06/222017706.db2.gz FTZBIQOQBQYNHM-QFIPXVFZSA-N 1 1 381.564 4.175 50 0 GIAAMO C[C@@H]([NH2+]Cc1c(C(=O)N2CCCC2)nc2sccn12)c1ccccc1Cl ZINC000055200025 222018910 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50 0 GIAAMO CC[N@H+]1CCC[C@H](c2c(-c3ccccc3)ncn2CCc2nncn2C(C)C)C1 ZINC000065372199 222126157 /nfs/dbraw/zinc/12/61/57/222126157.db2.gz QYYZMXNVSMXVQD-FQEVSTJZSA-N 1 1 392.551 4.165 50 0 GIAAMO C/C(=C\c1ccco1)c1c(-c2ccccc2)ncn1C[C@H]1CCC[N@@H+](CCO)C1 ZINC000065387125 222126967 /nfs/dbraw/zinc/12/69/67/222126967.db2.gz VOXIEGMQCJBAOX-ZAQQZEBGSA-N 1 1 391.515 4.408 50 0 GIAAMO Cc1ccsc1-c1c(-c2ccccc2)ncn1CC[N@H+]1CCC[C@H](CO)C1 ZINC000065502657 222132360 /nfs/dbraw/zinc/13/23/60/222132360.db2.gz UYZQXVZEHJOKPG-SFHVURJKSA-N 1 1 381.545 4.291 50 0 GIAAMO CNc1cc(C)[nH+]c(NCc2nc(-c3ccccn3)c(-c3ccc(C)cc3)[nH]2)n1 ZINC000067694875 222155527 /nfs/dbraw/zinc/15/55/27/222155527.db2.gz CFQAEAWAGOQDJS-UHFFFAOYSA-N 1 1 385.475 4.199 50 0 GIAAMO CNc1cc(C)[nH+]c(NCc2nc(-c3cccc(F)c3)c(-c3ccccn3)[nH]2)n1 ZINC000067847607 222162797 /nfs/dbraw/zinc/16/27/97/222162797.db2.gz LQZALKRRNWFGOW-UHFFFAOYSA-N 1 1 389.438 4.030 50 0 GIAAMO NC(=O)c1ccc(C[N@H+]2CCc3onc(-c4cccc5ccccc54)c3C2)cc1 ZINC000067909499 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GIAAMO Cc1ccc(C[N@H+](C)Cc2cccc(-c3nc(-c4ccncc4)cc(=O)[nH]3)c2)o1 ZINC000071777330 222198088 /nfs/dbraw/zinc/19/80/88/222198088.db2.gz URSRFCNWRQZJRT-UHFFFAOYSA-N 1 1 386.455 4.445 50 0 GIAAMO C[C@@H](CNC(=O)Nc1ccccc1SC1CCCC1)[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000071850110 222199818 /nfs/dbraw/zinc/19/98/18/222199818.db2.gz BQLLHBUCJAXUPG-YESZJQIVSA-N 1 1 391.581 4.341 50 0 GIAAMO C[C@@H](CNC(=O)Nc1ccccc1SC1CCCC1)[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000071850110 222199821 /nfs/dbraw/zinc/19/98/21/222199821.db2.gz BQLLHBUCJAXUPG-YESZJQIVSA-N 1 1 391.581 4.341 50 0 GIAAMO Cn1cc(C[N@@H+](C)CC(C)(C)CO)c(-c2ccc(Oc3ccccc3)cc2)n1 ZINC000072477572 222266378 /nfs/dbraw/zinc/26/63/78/222266378.db2.gz RFMYYTCGHATWLK-UHFFFAOYSA-N 1 1 379.504 4.330 50 0 GIAAMO CC(=O)N1CCC[N@@H+](Cc2cc3cccc(C)c3nc2-c2cccs2)CC1 ZINC000072470114 222263163 /nfs/dbraw/zinc/26/31/63/222263163.db2.gz CYWGZQTZGKXNMW-UHFFFAOYSA-N 1 1 379.529 4.326 50 0 GIAAMO CN(C[C@H]1CCC[N@@H+](CCc2cccc(C(F)(F)F)c2)C1)C(=O)c1cc[nH]c1 ZINC000095512036 222342299 /nfs/dbraw/zinc/34/22/99/222342299.db2.gz LCNYEQZFROMWLB-QGZVFWFLSA-N 1 1 393.453 4.060 50 0 GIAAMO CN(C[C@H]1CCC[N@@H+](CCc2ccccc2F)C1)C(=O)c1ccn(C(C)(C)C)c1 ZINC000095518248 222343552 /nfs/dbraw/zinc/34/35/52/222343552.db2.gz BARSNXKYICPNPO-LJQANCHMSA-N 1 1 399.554 4.409 50 0 GIAAMO CC(C)=CCC/C(C)=C/C[NH+]1CCC2(CC1)c1[nH]cnc1CCN2C(=O)C1CC1 ZINC000095531118 222353112 /nfs/dbraw/zinc/35/31/12/222353112.db2.gz MIZXIDQERNHVME-DJKKODMXSA-N 1 1 396.579 4.188 50 0 GIAAMO c1cn(Cc2ccncc2)c([C@H]2CCCN(c3nc4ccccc4s3)C2)[nH+]1 ZINC000095528326 222353147 /nfs/dbraw/zinc/35/31/47/222353147.db2.gz SJACHAWAAAYJPU-KRWDZBQOSA-N 1 1 375.501 4.320 50 0 GIAAMO Fc1ccc(-c2nnc(C[NH+]3CCC(CN4CCc5ccccc54)CC3)o2)cc1 ZINC000095957593 222364310 /nfs/dbraw/zinc/36/43/10/222364310.db2.gz KFFNCNYGFXAEAG-UHFFFAOYSA-N 1 1 392.478 4.150 50 0 GIAAMO Cc1[nH+]ccn1-c1ccc(CNC(=O)c2cc(Cl)c(N)c(Cl)c2)cc1F ZINC000095978381 222367684 /nfs/dbraw/zinc/36/76/84/222367684.db2.gz OWGMLBCZUBQYOV-UHFFFAOYSA-N 1 1 393.249 4.139 50 0 GIAAMO Cc1ccc(C)c([C@@H](c2ccccc2)[NH+]2CCN(C(=O)c3ccncc3)CC2)c1 ZINC000096183783 222396919 /nfs/dbraw/zinc/39/69/19/222396919.db2.gz VJHCZQPAZAMSOE-XMMPIXPASA-N 1 1 385.511 4.246 50 0 GIAAMO CSc1ccccc1C(=O)[C@@H]1CCC[N@@H+](Cc2ccc(NC(C)=O)cc2)C1 ZINC000019940035 570232862 /nfs/dbraw/zinc/23/28/62/570232862.db2.gz VBKFJSYFCSYNTF-GOSISDBHSA-N 1 1 382.529 4.462 50 0 GIAAMO CSc1ccccc1C(=O)[C@H]1CCC[N@@H+](Cc2ccc(NC(C)=O)cc2)C1 ZINC000019940036 570232960 /nfs/dbraw/zinc/23/29/60/570232960.db2.gz VBKFJSYFCSYNTF-SFHVURJKSA-N 1 1 382.529 4.462 50 0 GIAAMO O=C(NC1CC1)[C@H](c1ccccc1)[N@@H+]1CCC[C@H]1c1ccc2c(c1)OCCCO2 ZINC000247743963 570237687 /nfs/dbraw/zinc/23/76/87/570237687.db2.gz PJFQPIXXJSCBHA-REWPJTCUSA-N 1 1 392.499 4.005 50 0 GIAAMO O=C(NC1CC1)[C@H](c1ccccc1)[N@H+]1CCC[C@H]1c1ccc2c(c1)OCCCO2 ZINC000247743963 570237694 /nfs/dbraw/zinc/23/76/94/570237694.db2.gz PJFQPIXXJSCBHA-REWPJTCUSA-N 1 1 392.499 4.005 50 0 GIAAMO O=C(COc1ccc2ccccc2c1)N1CC[NH+](Cc2c[nH]c3ccccc23)CC1 ZINC000020130195 570241465 /nfs/dbraw/zinc/24/14/65/570241465.db2.gz KDZXBGISISNCTN-UHFFFAOYSA-N 1 1 399.494 4.044 50 0 GIAAMO CCCc1cc(C(=O)N2CC[NH+](C(c3ccccc3)c3ccccc3)CC2)no1 ZINC000020137733 570241865 /nfs/dbraw/zinc/24/18/65/570241865.db2.gz HCGKIEHMBIYEGE-UHFFFAOYSA-N 1 1 389.499 4.175 50 0 GIAAMO Cc1[nH]c2c(cccc2F)c1CC(=O)N[C@@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000097446849 570243848 /nfs/dbraw/zinc/24/38/48/570243848.db2.gz BUJTUFQNCKFAOX-OAHLLOKOSA-N 1 1 385.508 4.000 50 0 GIAAMO C[C@H](c1ccc(-c2ccc(CN3CCN(C)CC3)cn2)cc1)[NH+]1CCCCC1 ZINC000097610012 570247580 /nfs/dbraw/zinc/24/75/80/570247580.db2.gz FZAHRZRQRMYUEQ-HXUWFJFHSA-N 1 1 378.564 4.043 50 0 GIAAMO OCC[C@@H]1CN(Cc2ccccc2-c2ccco2)CC[N@H+]1Cc1ccccc1 ZINC000020206859 570248203 /nfs/dbraw/zinc/24/82/03/570248203.db2.gz WNDDPMIWMQWPDI-JOCHJYFZSA-N 1 1 376.500 4.015 50 0 GIAAMO OCC[C@@H]1C[N@H+](Cc2ccccc2-c2ccco2)CCN1Cc1ccccc1 ZINC000020206859 570248206 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Fc1cccc(Cc2noc(C[N@@H+]3CCCC[C@@H]3CCc3ccccn3)n2)c1 ZINC000020541513 570266730 /nfs/dbraw/zinc/26/67/30/570266730.db2.gz XSKRCTJDLLOYTN-HXUWFJFHSA-N 1 1 380.467 4.182 50 0 GIAAMO Fc1cccc(Cc2noc(C[N@H+]3CCCC[C@@H]3CCc3ccccn3)n2)c1 ZINC000020541513 570266733 /nfs/dbraw/zinc/26/67/33/570266733.db2.gz XSKRCTJDLLOYTN-HXUWFJFHSA-N 1 1 380.467 4.182 50 0 GIAAMO CC(=O)Nc1cccc(NC(=O)c2ccc(C[N@H+]3CCc4ccccc4C3)cc2)c1 ZINC000020567877 570268303 /nfs/dbraw/zinc/26/83/03/570268303.db2.gz XRDOQTPUBQUGDB-UHFFFAOYSA-N 1 1 399.494 4.456 50 0 GIAAMO COc1ccc2[nH]c(CN3CCC[C@H]([N@@H+](C)CCc4ccccn4)C3)c(C)c2c1 ZINC000020598785 570269570 /nfs/dbraw/zinc/26/95/70/570269570.db2.gz GDXMJYPCIAGSQD-FQEVSTJZSA-N 1 1 392.547 4.019 50 0 GIAAMO CC(C)CC[N@H+]1CCN(CC(c2ccccc2)c2ccccc2)C[C@@H]1CCO ZINC000020599675 570269581 /nfs/dbraw/zinc/26/95/81/570269581.db2.gz XUSXFDPXBDANPT-DEOSSOPVSA-N 1 1 380.576 4.233 50 0 GIAAMO CC(C)CCN1CC[N@H+](CC(c2ccccc2)c2ccccc2)C[C@@H]1CCO ZINC000020599675 570269582 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CC[C@H](C)NC(=O)c1cccc(C[NH+]2CCN(c3ccc(Cl)cc3)CC2)c1 ZINC000034684583 570301840 /nfs/dbraw/zinc/30/18/40/570301840.db2.gz YSYIGGIXQYLELP-KRWDZBQOSA-N 1 1 385.939 4.191 50 0 GIAAMO Cc1cccnc1NC(=O)[C@H]1CCC[N@@H+](Cc2ccc(OC(F)(F)F)cc2)C1 ZINC000072308210 570303241 /nfs/dbraw/zinc/30/32/41/570303241.db2.gz FSNXHTHLXDPLOL-INIZCTEOSA-N 1 1 393.409 4.139 50 0 GIAAMO CC(C)Cn1cncc1CN1CCC[N@@H+](Cc2ccc(F)cc2)[C@@H](C(C)C)C1 ZINC000107021121 570308190 /nfs/dbraw/zinc/30/81/90/570308190.db2.gz AJRXRYYAZWTFHU-HSZRJFAPSA-N 1 1 386.559 4.411 50 0 GIAAMO C[C@H]1C[C@H](C)C[NH+](Cc2csc(NC(=O)Cc3ccc(Cl)cc3)n2)C1 ZINC000022293995 570312697 /nfs/dbraw/zinc/31/26/97/570312697.db2.gz RGJVVOGUBMYIDI-KBPBESRZSA-N 1 1 377.941 4.456 50 0 GIAAMO Cc1ccnc(NC(=O)c2ccc([C@H]3CCC[N@@H+]3Cc3cccnc3)s2)c1 ZINC000023429724 570323694 /nfs/dbraw/zinc/32/36/94/570323694.db2.gz KPFJHLDKWALPTH-QGZVFWFLSA-N 1 1 378.501 4.436 50 0 GIAAMO Cc1ccnc(NC(=O)c2ccc([C@H]3CCC[N@H+]3Cc3cccnc3)s2)c1 ZINC000023429724 570323695 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570391581 /nfs/dbraw/zinc/39/15/81/570391581.db2.gz HKEXKNYCBZRAIK-UHFFFAOYSA-N 1 1 385.483 4.095 50 0 GIAAMO CCCC[N@@H+](C)CCCNC(=O)c1ccc2nc(N3CCCCC3)sc2c1 ZINC000005137286 570423909 /nfs/dbraw/zinc/42/39/09/570423909.db2.gz FLSLBDIZWSPTFU-UHFFFAOYSA-N 1 1 388.581 4.138 50 0 GIAAMO COc1ccc(OC)c([C@@H]2CCC[N@@H+]2CC(=O)N[C@H]2CCCc3ccccc32)c1 ZINC000248176729 570440828 /nfs/dbraw/zinc/44/08/28/570440828.db2.gz AVITWMLWZHBXSF-VXKWHMMOSA-N 1 1 394.515 4.035 50 0 GIAAMO COc1ccc(OC)c([C@@H]2CCC[N@H+]2CC(=O)N[C@H]2CCCc3ccccc32)c1 ZINC000248176729 570440830 /nfs/dbraw/zinc/44/08/30/570440830.db2.gz AVITWMLWZHBXSF-VXKWHMMOSA-N 1 1 394.515 4.035 50 0 GIAAMO CC[NH+]1CCN(C2(CNC(=O)c3ccc(C(C)(C)C)cc3)CCCCC2)CC1 ZINC000028293524 570457095 /nfs/dbraw/zinc/45/70/95/570457095.db2.gz NCEJJKDVSVGFRC-UHFFFAOYSA-N 1 1 385.596 4.054 50 0 GIAAMO C[N@@H+](CC(=O)Nc1ccc(OC(F)F)c(Cl)c1)[C@@H]1CCc2ccccc21 ZINC000029487129 570474685 /nfs/dbraw/zinc/47/46/85/570474685.db2.gz NUUMKVDRGYIBPJ-MRXNPFEDSA-N 1 1 380.822 4.499 50 0 GIAAMO CN(C)CCC[NH2+]CC[C@]1(c2cccc(C(F)(F)F)c2)CCOC(C)(C)C1 ZINC000006754881 570492041 /nfs/dbraw/zinc/49/20/41/570492041.db2.gz OJCYXHBQKMVYAZ-FQEVSTJZSA-N 1 1 386.502 4.464 50 0 GIAAMO O=C(C[NH+]1CCCCC1)N1N=C2c3ccccc3CC[C@H]2[C@@H]1c1cccs1 ZINC000006829781 570496197 /nfs/dbraw/zinc/49/61/97/570496197.db2.gz QGFZWIJGDSWWST-XMSQKQJNSA-N 1 1 379.529 4.084 50 0 GIAAMO Cc1cc(C)cc(NC(=O)C2CC[NH+](Cc3nc(-c4ccccc4)no3)CC2)c1 ZINC000030955114 570502251 /nfs/dbraw/zinc/50/22/51/570502251.db2.gz XJMNCPFDPCNLLS-UHFFFAOYSA-N 1 1 390.487 4.204 50 0 GIAAMO C[N@@H+](CCCc1nc(-c2ccccc2)no1)C1CCN(c2ccc(F)cc2)CC1 ZINC000072305177 570517013 /nfs/dbraw/zinc/51/70/13/570517013.db2.gz FLRMYRDJCFXENC-UHFFFAOYSA-N 1 1 394.494 4.409 50 0 GIAAMO CCSCC[C@@H](C)[N@@H+](C)CC(=O)N(C)Cc1ccc(Cl)c(Cl)c1 ZINC000072305343 570517653 /nfs/dbraw/zinc/51/76/53/570517653.db2.gz ZXIWPXZEYZBKOR-CYBMUJFWSA-N 1 1 377.381 4.415 50 0 GIAAMO Cc1ccc(C[N@H+](Cc2ccc3c(c2)OCO3)C[C@H](O)Cc2ccccc2)cc1 ZINC000036101918 570539046 /nfs/dbraw/zinc/53/90/46/570539046.db2.gz HHJYENWMXKJUCJ-HSZRJFAPSA-N 1 1 389.495 4.330 50 0 GIAAMO CCCC(=O)OC[C@@H](O)C[N@@H+](Cc1ccc(F)cc1)Cc1cc(C)ccc1C ZINC000036103990 570540712 /nfs/dbraw/zinc/54/07/12/570540712.db2.gz DHSBIWMHFWWGDH-QFIPXVFZSA-N 1 1 387.495 4.149 50 0 GIAAMO CC(C)[N@H+]1CCc2c(sc3c2C(=O)N[C@H](c2cn(C)c4ccccc24)N3)C1 ZINC000006708418 570545644 /nfs/dbraw/zinc/54/56/44/570545644.db2.gz BOIDWPYHJDUPIL-IBGZPJMESA-N 1 1 380.517 4.435 50 0 GIAAMO COCc1c2ccccc2oc1C(=O)NC[C@@H](c1ccco1)[NH+]1CCCCC1 ZINC000032967219 570550792 /nfs/dbraw/zinc/55/07/92/570550792.db2.gz FVBIKJCDJBSOLY-SFHVURJKSA-N 1 1 382.460 4.129 50 0 GIAAMO COc1ccc(C[N@H+]2CCCN(c3ncc(C(F)(F)F)cc3Cl)CC2)cc1 ZINC000225497682 570580725 /nfs/dbraw/zinc/58/07/25/570580725.db2.gz HFAIGAHXPKGFNY-UHFFFAOYSA-N 1 1 399.844 4.475 50 0 GIAAMO OC[C@]1(Cc2ccc(F)cc2)CCC[N@H+](C2CCN(Cc3ccccc3)CC2)C1 ZINC000039413282 570591543 /nfs/dbraw/zinc/59/15/43/570591543.db2.gz SQHCCZZAIZAQGZ-VWLOTQADSA-N 1 1 396.550 4.107 50 0 GIAAMO COc1cccc(-c2nn(-c3ccccc3)cc2C[N@@H+]2CCC[C@H](OC)C2)c1 ZINC000012453204 570668745 /nfs/dbraw/zinc/66/87/45/570668745.db2.gz SJCUQPYQDQQOGI-QFIPXVFZSA-N 1 1 377.488 4.159 50 0 GIAAMO O=C(c1ccc2c(c1)OCO2)[C@@H]1CCC[N@@H+](Cc2ccccc2OC(F)F)C1 ZINC000012476120 570673848 /nfs/dbraw/zinc/67/38/48/570673848.db2.gz DJYHOUXSKVVJBH-MRXNPFEDSA-N 1 1 389.398 4.112 50 0 GIAAMO O=C(c1ccc2c(c1)OCO2)[C@@H]1CCC[N@H+](Cc2ccccc2OC(F)F)C1 ZINC000012476120 570673854 /nfs/dbraw/zinc/67/38/54/570673854.db2.gz DJYHOUXSKVVJBH-MRXNPFEDSA-N 1 1 389.398 4.112 50 0 GIAAMO CCN(CC)C(=O)[C@H](c1ccccc1)[N@H+](C)Cc1cc(OC)c(OC)cc1C ZINC000058169940 570714895 /nfs/dbraw/zinc/71/48/95/570714895.db2.gz GGSKSOVONYQIPJ-QFIPXVFZSA-N 1 1 384.520 4.054 50 0 GIAAMO CCN(CC)C(=O)[C@H](c1ccccc1)[N@@H+](C)Cc1cc(OC)c(OC)cc1C ZINC000058169940 570714896 /nfs/dbraw/zinc/71/48/96/570714896.db2.gz GGSKSOVONYQIPJ-QFIPXVFZSA-N 1 1 384.520 4.054 50 0 GIAAMO CCCc1ccccc1NC(=O)[C@H]1CCC[N@H+](Cc2nc3ccccc3n2C)C1 ZINC000247721532 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/nfs/dbraw/zinc/62/45/46/818624546.db2.gz BBNGFUVWNOERJR-QHCPKHFHSA-N 1 1 387.527 4.266 50 0 GIAAMO CSc1ccc(C[N@@H+]2CCC[C@@H](N3CCN(c4ccccc4)CC3)C2)cc1 ZINC000020599012 818626653 /nfs/dbraw/zinc/62/66/53/818626653.db2.gz XKKFYYORFPMKRU-JOCHJYFZSA-N 1 1 381.589 4.195 50 0 GIAAMO CSc1ccc(C[N@H+]2CCC[C@@H](N3CCN(c4ccccc4)CC3)C2)cc1 ZINC000020599012 818626656 /nfs/dbraw/zinc/62/66/56/818626656.db2.gz XKKFYYORFPMKRU-JOCHJYFZSA-N 1 1 381.589 4.195 50 0 GIAAMO Fc1ccc(/C=C/C[N@H+]2CCC[C@@H](N3CCN(c4ccc(F)cc4)CC3)C2)cc1 ZINC000020995182 818645694 /nfs/dbraw/zinc/64/56/94/818645694.db2.gz ZYKJPSMLSFVFIC-UHTFCRDUSA-N 1 1 397.513 4.265 50 0 GIAAMO Fc1ccc(/C=C/CN2CCC[C@@H]([NH+]3CCN(c4ccc(F)cc4)CC3)C2)cc1 ZINC000020995182 818645697 /nfs/dbraw/zinc/64/56/97/818645697.db2.gz ZYKJPSMLSFVFIC-UHTFCRDUSA-N 1 1 397.513 4.265 50 0 GIAAMO CC[N@@H+]1CCc2nc(NC(=O)c3ccc(C(=O)c4ccccc4)cc3)sc2C1 ZINC000021294876 818672443 /nfs/dbraw/zinc/67/24/43/818672443.db2.gz HIMBRDLJEDZLIZ-UHFFFAOYSA-N 1 1 391.496 4.004 50 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COc1ccc(-c2ncc(C[N@H+]3CCC[C@@H](Nc4ccc(F)cc4)C3)cn2)cc1 ZINC000012571304 221209220 /nfs/dbraw/zinc/20/92/20/221209220.db2.gz RZPGYIXPMKDTMS-OAQYLSRUSA-N 1 1 392.478 4.368 50 0 GIAAMO CC(C)n1cc([C@@H]2C[C@H]3CN(Cc4cccc(Cl)c4)C(=O)[C@]34CCC[N@@H+]24)cn1 ZINC000012385769 221187270 /nfs/dbraw/zinc/18/72/70/221187270.db2.gz YNFNIOOXSCFBAD-VCOUNFBDSA-N 1 1 398.938 4.055 50 0 GIAAMO C[C@@H]([NH2+][C@@H](C)C(=O)Nc1c(F)cccc1F)c1ccccc1Br ZINC000012624067 221215376 /nfs/dbraw/zinc/21/53/76/221215376.db2.gz GTNMZMCVVZNIAC-MNOVXSKESA-N 1 1 383.236 4.405 50 0 GIAAMO C[C@H]([NH2+][C@@H](C)c1ccccc1Br)C(=O)Nc1c(F)cccc1F ZINC000012624062 221215888 /nfs/dbraw/zinc/21/58/88/221215888.db2.gz GTNMZMCVVZNIAC-QWRGUYRKSA-N 1 1 383.236 4.405 50 0 GIAAMO COc1cc2c(cc1OC)[C@H](c1ccccc1)[N@@H+](C[C@@H](O)c1ccccc1)CC2 ZINC000012624440 221215932 /nfs/dbraw/zinc/21/59/32/221215932.db2.gz VVHYMQWHTKCPDC-RDGATRHJSA-N 1 1 389.495 4.385 50 0 GIAAMO CC(=O)c1cc(C[NH+]2CCC(CO)(Cc3ccccc3Cl)CC2)cs1 ZINC000012711956 221219555 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GIAAMO COc1cccc(C[N@@H+](C)CCC(=O)Nc2cccc3ccccc32)c1OC ZINC000012754529 221226152 /nfs/dbraw/zinc/22/61/52/221226152.db2.gz QNZGYHZHQOWECR-UHFFFAOYSA-N 1 1 378.472 4.318 50 0 GIAAMO COc1cccc(C(=O)[C@@H]2CCC[N@H+](Cc3cc(Cl)c(O)c(OC)c3)C2)c1 ZINC000012762035 221227802 /nfs/dbraw/zinc/22/78/02/221227802.db2.gz KSSGITGIGIOJEP-MRXNPFEDSA-N 1 1 389.879 4.158 50 0 GIAAMO COc1cccc(C(=O)[C@@H]2CCC[N@@H+](Cc3cc(Cl)c(O)c(OC)c3)C2)c1 ZINC000012762035 221227803 /nfs/dbraw/zinc/22/78/03/221227803.db2.gz KSSGITGIGIOJEP-MRXNPFEDSA-N 1 1 389.879 4.158 50 0 GIAAMO Cc1c(Cl)cccc1NC(=O)[C@@H](C)[N@@H+]1CCC[C@@H](C(=O)Nc2ccccc2)C1 ZINC000012805910 221234475 /nfs/dbraw/zinc/23/44/75/221234475.db2.gz RLTSELQLVOGZBG-IAGOWNOFSA-N 1 1 399.922 4.326 50 0 GIAAMO Cc1c(Cl)cccc1NC(=O)[C@@H](C)[N@H+]1CCC[C@@H](C(=O)Nc2ccccc2)C1 ZINC000012805910 221234479 /nfs/dbraw/zinc/23/44/79/221234479.db2.gz RLTSELQLVOGZBG-IAGOWNOFSA-N 1 1 399.922 4.326 50 0 GIAAMO COc1ccc(OC)c([C@@H]2CCC[N@@H+]2CC(=O)N[C@@H]2CCCc3ccccc32)c1 ZINC000012934675 221248154 /nfs/dbraw/zinc/24/81/54/221248154.db2.gz AVITWMLWZHBXSF-YADHBBJMSA-N 1 1 394.515 4.035 50 0 GIAAMO COc1ccc(OC)c([C@@H]2CCC[N@H+]2CC(=O)N[C@@H]2CCCc3ccccc32)c1 ZINC000012934675 221248155 /nfs/dbraw/zinc/24/81/55/221248155.db2.gz AVITWMLWZHBXSF-YADHBBJMSA-N 1 1 394.515 4.035 50 0 GIAAMO COc1ccc([C@H]2CCCCC[N@@H+]2CC(=O)Nc2ccc(OC)cc2OC)cc1 ZINC000012980753 221251919 /nfs/dbraw/zinc/25/19/19/221251919.db2.gz GOXYNRMEGDEYEI-OAQYLSRUSA-N 1 1 398.503 4.268 50 0 GIAAMO COc1ccc([C@H]2CCCCC[N@H+]2CC(=O)Nc2ccc(OC)cc2OC)cc1 ZINC000012980753 221251921 /nfs/dbraw/zinc/25/19/21/221251921.db2.gz GOXYNRMEGDEYEI-OAQYLSRUSA-N 1 1 398.503 4.268 50 0 GIAAMO Cc1ccc(CNC(=O)C[NH+]2CCC(c3nc4ccccc4s3)CC2)cc1F ZINC000012996407 221254411 /nfs/dbraw/zinc/25/44/11/221254411.db2.gz FUHPVXXTUPVFRP-UHFFFAOYSA-N 1 1 397.519 4.240 50 0 GIAAMO COc1ccc(C[N@H+](C)[C@H](C)C(=O)Nc2cccc(Cl)c2Cl)cc1OC ZINC000013096123 221259999 /nfs/dbraw/zinc/25/99/99/221259999.db2.gz FBUXOUMCAKBHGX-GFCCVEGCSA-N 1 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PGNAPLPUCXGTDJ-QFIPXVFZSA-N 1 1 394.446 4.061 50 0 GIAAMO COCCN(CCc1ccccc1)C[C@H]1CCC[N@@H+](C2Cc3ccccc3C2)C1 ZINC000015076692 221330627 /nfs/dbraw/zinc/33/06/27/221330627.db2.gz DJTUYQGHBQFPFG-HSZRJFAPSA-N 1 1 392.587 4.057 50 0 GIAAMO COCCN(CCc1ccccc1)C[C@H]1CCC[N@H+](C2Cc3ccccc3C2)C1 ZINC000015076692 221330629 /nfs/dbraw/zinc/33/06/29/221330629.db2.gz DJTUYQGHBQFPFG-HSZRJFAPSA-N 1 1 392.587 4.057 50 0 GIAAMO COc1ccc(CC[N@H+]2CCC[C@@H](CN(C)C(=O)Nc3ccccc3F)C2)cc1 ZINC000015076799 221331563 /nfs/dbraw/zinc/33/15/63/221331563.db2.gz XOKIGICAHNMAMV-IBGZPJMESA-N 1 1 399.510 4.253 50 0 GIAAMO CCOc1ccc([C@@H]2CCC[N@@H+]2CC(=O)Nc2ccc(N3CCCC3)cc2)cc1 ZINC000015548108 221337299 /nfs/dbraw/zinc/33/72/99/221337299.db2.gz NQVPVGDYOLXXTD-QHCPKHFHSA-N 1 1 393.531 4.461 50 0 GIAAMO CCOc1ccc([C@@H]2CCC[N@H+]2CC(=O)Nc2ccc(N3CCCC3)cc2)cc1 ZINC000015548108 221337302 /nfs/dbraw/zinc/33/73/02/221337302.db2.gz NQVPVGDYOLXXTD-QHCPKHFHSA-N 1 1 393.531 4.461 50 0 GIAAMO CC(C)[N@@H+](CCNC(=O)c1noc2c1CCc1sccc1-2)Cc1ccccc1 ZINC000015733302 221342313 /nfs/dbraw/zinc/34/23/13/221342313.db2.gz CBAPCKRLTKIBRK-UHFFFAOYSA-N 1 1 395.528 4.142 50 0 GIAAMO CC(C)c1ccccc1NC(=O)C[N@H+](C)[C@@H](C)c1ccc(-n2cncn2)cc1 ZINC000017305822 221382757 /nfs/dbraw/zinc/38/27/57/221382757.db2.gz JHPWJNSZARCVHS-KRWDZBQOSA-N 1 1 377.492 4.022 50 0 GIAAMO CC(C)c1ccccc1NC(=O)C[N@@H+](C)[C@@H](C)c1ccc(-n2cncn2)cc1 ZINC000017305822 221382760 /nfs/dbraw/zinc/38/27/60/221382760.db2.gz JHPWJNSZARCVHS-KRWDZBQOSA-N 1 1 377.492 4.022 50 0 GIAAMO COc1cccc([C@@H]2c3cc4c(cc3O[C@](C)([NH+]3CCCC3)[C@H]2C)OCO4)c1 ZINC000016958659 221374663 /nfs/dbraw/zinc/37/46/63/221374663.db2.gz LUELUYBCCRBFBS-BJQRDSPESA-N 1 1 381.472 4.396 50 0 GIAAMO Cc1nnc(C[NH2+]C2CCN(c3cccc(-c4cccc(Cl)c4)c3)CC2)o1 ZINC000019113950 221397148 /nfs/dbraw/zinc/39/71/48/221397148.db2.gz FWNDSFOBCYOGPS-UHFFFAOYSA-N 1 1 382.895 4.457 50 0 GIAAMO COc1cccc(-c2ccc(C(=O)N(C)C[C@H]3CC[N@@H+](CC(C)C)C3)cc2)c1 ZINC000426715912 533370664 /nfs/dbraw/zinc/37/06/64/533370664.db2.gz LYUUHRCOCJYUJG-LJQANCHMSA-N 1 1 380.532 4.412 50 0 GIAAMO COc1cc(C[NH+]2CCN(c3cccc(C(F)(F)F)c3)CC2)cc(OC)c1 ZINC000055031548 132442813 /nfs/dbraw/zinc/44/28/13/132442813.db2.gz NWYKHEGHVWFYOS-UHFFFAOYSA-N 1 1 380.410 4.045 50 0 GIAAMO CCOc1ccccc1N1CC[NH+](Cc2cc(=O)oc3cc(CC)ccc23)CC1 ZINC000058159126 136154713 /nfs/dbraw/zinc/15/47/13/136154713.db2.gz ZXILRAJTQDUSBM-UHFFFAOYSA-N 1 1 392.499 4.076 50 0 GIAAMO OCC[C@@H]1CN(c2ccnc3c2cccc3C(F)(F)F)CC[N@H+]1C1CCCC1 ZINC000072411853 136169678 /nfs/dbraw/zinc/16/96/78/136169678.db2.gz WOKORVOSMIFUDZ-MRXNPFEDSA-N 1 1 393.453 4.069 50 0 GIAAMO C[N@@H+](Cc1ccccc1NC(=O)C1CCN(C(=O)C2CC2)CC1)C1CCCCC1 ZINC000032904222 221747019 /nfs/dbraw/zinc/74/70/19/221747019.db2.gz OMBRZRURPNEVEQ-UHFFFAOYSA-N 1 1 397.563 4.038 50 0 GIAAMO Cc1ccccc1C[N@H+](Cc1ccc(F)cc1)C[C@H](O)COCc1ccco1 ZINC000036104672 221843654 /nfs/dbraw/zinc/84/36/54/221843654.db2.gz ZVOCTUWJGPYWJJ-QFIPXVFZSA-N 1 1 383.463 4.307 50 0 GIAAMO C[C@H](C(=O)NCc1ccccc1C[N@H+]1CCCC[C@@H]1C)n1cnc2ccccc21 ZINC000040112362 221906635 /nfs/dbraw/zinc/90/66/35/221906635.db2.gz LSACSXOEQFENOL-RBUKOAKNSA-N 1 1 390.531 4.288 50 0 GIAAMO CCOc1ccccc1NC(=O)C[NH2+][C@H](C)c1ccccc1Br ZINC000057315235 222030671 /nfs/dbraw/zinc/03/06/71/222030671.db2.gz SHDKETPCJHSDIE-CYBMUJFWSA-N 1 1 377.282 4.137 50 0 GIAAMO CCOC(=O)c1c(C)[nH]c(C(=O)[C@@H](C)[NH2+][C@H](C)c2ccc(F)c(F)c2)c1C ZINC000057392026 222031587 /nfs/dbraw/zinc/03/15/87/222031587.db2.gz QDAGJCGCGPQLKF-DGCLKSJQSA-N 1 1 378.419 4.008 50 0 GIAAMO CCc1cc2c(C[N@H+]3CCC[C@@H]3c3cccc(OC)c3)cc(=O)oc2cc1O ZINC000057529545 222035621 /nfs/dbraw/zinc/03/56/21/222035621.db2.gz RUKOIGMPOBUIQT-HXUWFJFHSA-N 1 1 379.456 4.407 50 0 GIAAMO Cc1ccc(F)cc1NC(=O)C1CC[NH+](Cc2nc(-c3ccccc3)no2)CC1 ZINC000051317163 222004369 /nfs/dbraw/zinc/00/43/69/222004369.db2.gz LVHCKSIHSULTQO-UHFFFAOYSA-N 1 1 394.450 4.035 50 0 GIAAMO CSc1ncc(C[N@@H+]2CCC[C@@H](C(=O)c3cccc4ccccc43)C2)cn1 ZINC000055183044 222015838 /nfs/dbraw/zinc/01/58/38/222015838.db2.gz AQBKTWSCMAYMNF-GOSISDBHSA-N 1 1 377.513 4.447 50 0 GIAAMO CSc1ncc(C[N@H+]2CCC[C@@H](C(=O)c3cccc4ccccc43)C2)cn1 ZINC000055183044 222015843 /nfs/dbraw/zinc/01/58/43/222015843.db2.gz AQBKTWSCMAYMNF-GOSISDBHSA-N 1 1 377.513 4.447 50 0 GIAAMO Cc1cccc(C(=O)Nc2cccc(NC(=O)CC[C@@H]3CCC[N@H+](C)C3)c2)c1 ZINC000055369870 222019825 /nfs/dbraw/zinc/01/98/25/222019825.db2.gz UPENFYTZVNVBQK-SFHVURJKSA-N 1 1 379.504 4.308 50 0 GIAAMO c1cn(CCC[N@H+](Cc2ccc([C@H]3CCCCO3)o2)Cc2cccnc2)cn1 ZINC000055576496 222022525 /nfs/dbraw/zinc/02/25/25/222022525.db2.gz ZKMGXFDFHYUDPM-OAQYLSRUSA-N 1 1 380.492 4.205 50 0 GIAAMO c1cn(CCC[N@@H+](Cc2ccc([C@H]3CCCCO3)o2)Cc2cccnc2)cn1 ZINC000055576496 222022531 /nfs/dbraw/zinc/02/25/31/222022531.db2.gz ZKMGXFDFHYUDPM-OAQYLSRUSA-N 1 1 380.492 4.205 50 0 GIAAMO C[C@H]1CCC[N@@H+](Cc2ccc(CNC(=O)CCOc3cccc(F)c3)cc2)C1 ZINC000058064397 222038695 /nfs/dbraw/zinc/03/86/95/222038695.db2.gz GHYOYHFGHDRKRG-SFHVURJKSA-N 1 1 384.495 4.143 50 0 GIAAMO CCOc1ccc(C(=O)N[C@@H]2CC[N@H+]([C@@H](C)c3ccccc3)C2)cc1OCC ZINC000058179463 222043223 /nfs/dbraw/zinc/04/32/23/222043223.db2.gz OYVAROHDNMCWHT-FXAWDEMLSA-N 1 1 382.504 4.049 50 0 GIAAMO COc1ccc(Cl)cc1C(=O)Nc1ccccc1C[NH+]1CCSCC1 ZINC000060220565 222060239 /nfs/dbraw/zinc/06/02/39/222060239.db2.gz GXWQXNGOSFKKDY-UHFFFAOYSA-N 1 1 376.909 4.150 50 0 GIAAMO C[N@H+]1CCCN(c2nc(-c3ccccc3)nc3nc(-c4ccccc4)oc32)CC1 ZINC000061997279 222064301 /nfs/dbraw/zinc/06/43/01/222064301.db2.gz INPIMIKMYSYCCS-UHFFFAOYSA-N 1 1 385.471 4.094 50 0 GIAAMO c1cc(C[N@H+]2CC[C@H](c3ccnc(-c4ccncc4)c3)C2)n(-c2nccs2)c1 ZINC000065456684 222130337 /nfs/dbraw/zinc/13/03/37/222130337.db2.gz KFTWMIFCYVXFJZ-IBGZPJMESA-N 1 1 387.512 4.380 50 0 GIAAMO C[N@@H+](CCc1ccccn1)C1CCC2(CC1)CCN(C(=O)c1ccco1)CC2 ZINC000067934561 222167867 /nfs/dbraw/zinc/16/78/67/222167867.db2.gz RRHBKDQRXMVTLV-UHFFFAOYSA-N 1 1 381.520 4.014 50 0 GIAAMO CCc1cccc(-c2ccc(C(=O)NCCCn3cc[nH+]c3C(C)C)cn2)c1 ZINC000067965668 222169739 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COc1ccccc1C(=O)NC[C@@H](c1cccs1)[N@H+]1CCc2ccccc2C1 ZINC000022907771 570564020 /nfs/dbraw/zinc/56/40/20/570564020.db2.gz DTRSKZOWYCLEGB-FQEVSTJZSA-N 1 1 392.524 4.286 50 0 GIAAMO COc1ccc(C(=O)NC[C@@H](c2cccs2)[N@@H+]2CCc3ccccc3C2)cc1 ZINC000022907686 570564034 /nfs/dbraw/zinc/56/40/34/570564034.db2.gz FWHGATVURKZBNL-NRFANRHFSA-N 1 1 392.524 4.286 50 0 GIAAMO COc1ccc(C(=O)NC[C@@H](c2cccs2)[N@H+]2CCc3ccccc3C2)cc1 ZINC000022907686 570564037 /nfs/dbraw/zinc/56/40/37/570564037.db2.gz FWHGATVURKZBNL-NRFANRHFSA-N 1 1 392.524 4.286 50 0 GIAAMO CSc1ccc(C[N@H+](C)CC(=O)Nc2ccc(N3CCCCC3)cc2)cc1 ZINC000006786113 570592453 /nfs/dbraw/zinc/59/24/53/570592453.db2.gz ACFBZNBMZGSOMQ-UHFFFAOYSA-N 1 1 383.561 4.469 50 0 GIAAMO CSc1ccc(C[N@@H+](C)CC(=O)Nc2ccc(N3CCCCC3)cc2)cc1 ZINC000006786113 570592455 /nfs/dbraw/zinc/59/24/55/570592455.db2.gz ACFBZNBMZGSOMQ-UHFFFAOYSA-N 1 1 383.561 4.469 50 0 GIAAMO C[N@@H+](C1CCCCC1)[C@H]1CCCC[C@@H]1NS(=O)(=O)c1ccc(Cl)cc1 ZINC000006809590 570611955 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378.472 4.206 50 0 GIAAMO CCOc1ccc(NC(=O)N2CCC(C[N@H+]3CCc4ccccc4C3)CC2)cc1 ZINC000006877318 570668501 /nfs/dbraw/zinc/66/85/01/570668501.db2.gz HPYCUIOLBAYWFR-UHFFFAOYSA-N 1 1 393.531 4.388 50 0 GIAAMO O=C(C[N@@H+]1CCC[C@@H](c2nc3ccccc3s2)C1)NCc1ccccc1Cl ZINC000006881372 570676643 /nfs/dbraw/zinc/67/66/43/570676643.db2.gz VKKZTMWNZOBEIC-MRXNPFEDSA-N 1 1 399.947 4.446 50 0 GIAAMO O=C(C[N@H+]1CCC[C@@H](c2nc3ccccc3s2)C1)NCc1ccccc1Cl ZINC000006881372 570676649 /nfs/dbraw/zinc/67/66/49/570676649.db2.gz VKKZTMWNZOBEIC-MRXNPFEDSA-N 1 1 399.947 4.446 50 0 GIAAMO CCCCN(CC)C(=O)[C@@H]1CCC[N@@H+](Cc2nc3ccccc3n2C(C)C)C1 ZINC000247972753 570718603 /nfs/dbraw/zinc/71/86/03/570718603.db2.gz DSHXVRBGTFMSBU-LJQANCHMSA-N 1 1 384.568 4.478 50 0 GIAAMO CCCc1ccccc1NC(=O)C1CC[NH+](Cc2nc3ccccc3n2C)CC1 ZINC000248027531 570719784 /nfs/dbraw/zinc/71/97/84/570719784.db2.gz MWLWSBDPMCZPNI-UHFFFAOYSA-N 1 1 390.531 4.377 50 0 GIAAMO CCc1cccc(NC(=O)[C@H]2CCC[N@H+](Cc3nc4ccccc4n3CC)C2)c1 ZINC000249691565 570722845 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GIAAMO C[C@@H](C(=O)Nc1ccc(F)c(F)c1F)[NH+]1CCC(Cc2ccccc2)CC1 ZINC000007385839 570836086 /nfs/dbraw/zinc/83/60/86/570836086.db2.gz LTKQAXHNDMGVTQ-AWEZNQCLSA-N 1 1 376.422 4.386 50 0 GIAAMO O=C(NC1CC1)c1ccc(C[N@H+](Cc2cc(F)cc3cccnc32)C2CC2)cc1 ZINC000032825281 570839277 /nfs/dbraw/zinc/83/92/77/570839277.db2.gz CIUVFIHVRCQKDL-UHFFFAOYSA-N 1 1 389.474 4.431 50 0 GIAAMO CC(C)(C)OC(=O)Nc1cccc(C(=O)N[C@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000032819926 570841545 /nfs/dbraw/zinc/84/15/45/570841545.db2.gz ALTQQSCJUVRNPV-FQEVSTJZSA-N 1 1 395.503 4.038 50 0 GIAAMO O=C1N[C@@H](c2cccs2)Nc2sc3c(c21)CC[N@@H+](Cc1ccccc1)C3 ZINC000004525921 570843037 /nfs/dbraw/zinc/84/30/37/570843037.db2.gz QJFDGQQAYPZMQL-GOSISDBHSA-N 1 1 381.526 4.222 50 0 GIAAMO O=C1N[C@@H](c2cccs2)Nc2sc3c(c21)CC[N@H+](Cc1ccccc1)C3 ZINC000004525921 570843039 /nfs/dbraw/zinc/84/30/39/570843039.db2.gz QJFDGQQAYPZMQL-GOSISDBHSA-N 1 1 381.526 4.222 50 0 GIAAMO COC(=O)c1ccc(C[N@H+]2CCC[C@H](C(=O)c3ccc(SC)cc3)C2)cc1 ZINC000015062055 570874508 /nfs/dbraw/zinc/87/45/08/570874508.db2.gz HBPQWJHSEOFBQT-IBGZPJMESA-N 1 1 383.513 4.290 50 0 GIAAMO O=C(CSCc1ccc(Cl)s1)NC[C@H](c1ccco1)[NH+]1CCCC1 ZINC000044517316 570882698 /nfs/dbraw/zinc/88/26/98/570882698.db2.gz ZUOSWMSCYXKJKL-CQSZACIVSA-N 1 1 384.954 4.181 50 0 GIAAMO CC(C)[C@@H](CO)[N@@H+](Cc1ccccc1)Cc1ccc(Oc2cnccn2)cc1 ZINC000097032743 570887217 /nfs/dbraw/zinc/88/72/17/570887217.db2.gz FVGIKUGUZIUWKZ-JOCHJYFZSA-N 1 1 377.488 4.288 50 0 GIAAMO CCOc1ccc(C(=O)N[C@@H]2CC[N@H+]([C@H](C)c3ccccc3)C2)cc1OCC ZINC000106135290 570948779 /nfs/dbraw/zinc/94/87/79/570948779.db2.gz OYVAROHDNMCWHT-YLJYHZDGSA-N 1 1 382.504 4.049 50 0 GIAAMO COc1ccc(NC(=O)[C@@H](C)[N@H+]2CC=C(c3ccc(O)cc3)CC2)cc1Cl ZINC000025680350 570950861 /nfs/dbraw/zinc/95/08/61/570950861.db2.gz ZRYXMDBARNSFNG-CQSZACIVSA-N 1 1 386.879 4.171 50 0 GIAAMO COc1ccc(NC(=O)[C@@H](C)[N@@H+]2CC=C(c3ccc(O)cc3)CC2)cc1Cl ZINC000025680350 570950862 /nfs/dbraw/zinc/95/08/62/570950862.db2.gz ZRYXMDBARNSFNG-CQSZACIVSA-N 1 1 386.879 4.171 50 0 GIAAMO CCc1nc(C[NH+]2CCC(CNc3ncnc4c(F)cccc34)CC2)cs1 ZINC000252486391 570969388 /nfs/dbraw/zinc/96/93/88/570969388.db2.gz HKYGECIMXDDFMQ-UHFFFAOYSA-N 1 1 385.512 4.112 50 0 GIAAMO Cc1ccc([C@H]2Nc3sc4c(c3C(=O)N2)CC[N@@H+](Cc2ccccc2)C4)o1 ZINC000004543408 570973784 /nfs/dbraw/zinc/97/37/84/570973784.db2.gz KYOQVBGCLLPWPT-LJQANCHMSA-N 1 1 379.485 4.062 50 0 GIAAMO Cc1ccc([C@H]2Nc3sc4c(c3C(=O)N2)CC[N@H+](Cc2ccccc2)C4)o1 ZINC000004543408 570973785 /nfs/dbraw/zinc/97/37/85/570973785.db2.gz KYOQVBGCLLPWPT-LJQANCHMSA-N 1 1 379.485 4.062 50 0 GIAAMO C[C@@H]1C[C@H](C)C[N@@H+](Cc2csc(NC(=O)CCc3ccccc3F)n2)C1 ZINC000045754623 570995621 /nfs/dbraw/zinc/99/56/21/570995621.db2.gz JXQXDEKYESZDFE-GASCZTMLSA-N 1 1 375.513 4.331 50 0 GIAAMO C[C@@H]1C[C@H](C)C[N@H+](Cc2csc(NC(=O)CCc3ccccc3F)n2)C1 ZINC000045754623 570995625 /nfs/dbraw/zinc/99/56/25/570995625.db2.gz JXQXDEKYESZDFE-GASCZTMLSA-N 1 1 375.513 4.331 50 0 GIAAMO C[C@@H]1C[C@@H](C)C[NH+](Cc2csc(NC(=O)CCc3ccccc3F)n2)C1 ZINC000045754627 570995839 /nfs/dbraw/zinc/99/58/39/570995839.db2.gz JXQXDEKYESZDFE-HUUCEWRRSA-N 1 1 375.513 4.331 50 0 GIAAMO Cc1[nH+]c2cc3c(cc2n1C[C@H](O)c1cc(Cl)ccc1Cl)OCCO3 ZINC000084290284 571012245 /nfs/dbraw/zinc/01/22/45/571012245.db2.gz LVIUJCIFBOKGEK-INIZCTEOSA-N 1 1 379.243 4.156 50 0 GIAAMO COc1ccc(CC[N@@H+](C)Cc2ccc(F)c(Br)c2)cc1OC ZINC000019606693 571020848 /nfs/dbraw/zinc/02/08/48/571020848.db2.gz LQLHGRJYUURXQK-UHFFFAOYSA-N 1 1 382.273 4.280 50 0 GIAAMO Cc1nc(C(C)C)sc1C(=O)N1C[C@H]2CC[C@H](C[N@@H+]2Cc2ccccc2)C1 ZINC000095356096 571052450 /nfs/dbraw/zinc/05/24/50/571052450.db2.gz BEAXXPRHYFWJFW-RTBURBONSA-N 1 1 383.561 4.312 50 0 GIAAMO CC(C)n1cccc1C(=O)N1CCC2(CC1)C[C@H](c1ccccc1)C[N@@H+](C)C2 ZINC000095389558 571071986 /nfs/dbraw/zinc/07/19/86/571071986.db2.gz IVGOFMBFLOEWRP-NRFANRHFSA-N 1 1 379.548 4.411 50 0 GIAAMO Cc1ccc2c(c1)[nH]c1c2ncnc1N1CC[NH+](C/C=C/c2ccccc2)CC1 ZINC000002401422 817386947 /nfs/dbraw/zinc/38/69/47/817386947.db2.gz XQSOTQINFBVZPE-VMPITWQZSA-N 1 1 383.499 4.255 50 0 GIAAMO 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GIAAMO COc1cc(C[N@H+]2CCC[C@](CO)(Cc3cccc(Cl)c3)C2)cc(OC)c1 ZINC000012576521 221208321 /nfs/dbraw/zinc/20/83/21/221208321.db2.gz ZOEUDFXNAGZEHO-QFIPXVFZSA-N 1 1 389.923 4.174 50 0 GIAAMO CCOC(=O)[C@@]1(Cc2ccccc2F)CCC[N@@H+](CCCC(F)(F)F)C1 ZINC000012585780 221210034 /nfs/dbraw/zinc/21/00/34/221210034.db2.gz CMWCJOFZPGFDMT-GOSISDBHSA-N 1 1 375.406 4.356 50 0 GIAAMO COc1ccc(C(=O)[C@@H]2CCC[N@H+](C3C4CC5CC(C4)CC3C5)C2)cc1OC ZINC000012595791 221212490 /nfs/dbraw/zinc/21/24/90/221212490.db2.gz AULOHPXZIIULCN-YIEWGUIWSA-N 1 1 383.532 4.423 50 0 GIAAMO C[C@@H](c1ccc2c(c1)OCCO2)[N@@H+](C)Cc1cn(C)nc1-c1ccccc1F ZINC000012714282 221220465 /nfs/dbraw/zinc/22/04/65/221220465.db2.gz GSQVNTFDHPDPBL-HNNXBMFYSA-N 1 1 381.451 4.190 50 0 GIAAMO O=C(c1ccc2c(c1)OCO2)[C@H]1CCC[N@@H+](Cc2ccc3cccc(F)c3n2)C1 ZINC000012716127 221221123 /nfs/dbraw/zinc/22/11/23/221221123.db2.gz CSFXMKTUYXBSRP-KRWDZBQOSA-N 1 1 392.430 4.198 50 0 GIAAMO O=C(c1ccc2c(c1)OCO2)[C@H]1CCC[N@H+](Cc2ccc3cccc(F)c3n2)C1 ZINC000012716127 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COc1cc(NC(=O)C[N@H+](Cc2ccc(C(C)C)cc2)C2CC2)cc(OC)c1 ZINC000015520199 221336634 /nfs/dbraw/zinc/33/66/34/221336634.db2.gz QDAMMAZQSXLKNC-UHFFFAOYSA-N 1 1 382.504 4.430 50 0 GIAAMO COc1cc(NC(=O)C[N@@H+](Cc2ccc(C(C)C)cc2)C2CC2)cc(OC)c1 ZINC000015520199 221336636 /nfs/dbraw/zinc/33/66/36/221336636.db2.gz QDAMMAZQSXLKNC-UHFFFAOYSA-N 1 1 382.504 4.430 50 0 GIAAMO COc1ccc(CC[N@H+]2CCC[C@H](CN(C)Cc3cccc(F)c3F)C2)cc1 ZINC000014977755 221323930 /nfs/dbraw/zinc/32/39/30/221323930.db2.gz ITZLAMGWMWFIRL-LJQANCHMSA-N 1 1 388.502 4.360 50 0 GIAAMO Cc1nc(C)c(C[N@H+]2CC[C@@]3(C2)CCCN(Cc2ccccc2F)C3)nc1C ZINC000015062907 221328280 /nfs/dbraw/zinc/32/82/80/221328280.db2.gz WZMMMDQZBLASAD-QHCPKHFHSA-N 1 1 382.527 4.029 50 0 GIAAMO Cc1nc(C)c(CN2CC[C@@]3(C2)CCC[N@H+](Cc2ccccc2F)C3)nc1C ZINC000015062907 221328283 /nfs/dbraw/zinc/32/82/83/221328283.db2.gz WZMMMDQZBLASAD-QHCPKHFHSA-N 1 1 382.527 4.029 50 0 GIAAMO Cc1nc(C)c(CN2CC[C@@]3(C2)CCC[N@@H+](Cc2ccccc2F)C3)nc1C ZINC000015062907 221328286 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399.462 4.209 50 0 GIAAMO CCc1ccc(C[NH+]2CCN(C(=O)NC34CC5CC(CC(C5)C3)C4)CC2)cc1 ZINC000017078012 221377342 /nfs/dbraw/zinc/37/73/42/221377342.db2.gz FOCJBQFFRZTSFF-UHFFFAOYSA-N 1 1 381.564 4.045 50 0 GIAAMO COC(=O)c1c(-c2ccccc2)csc1NC(=O)C[NH+]1C[C@H](C)C[C@@H](C)C1 ZINC000017078944 221377349 /nfs/dbraw/zinc/37/73/49/221377349.db2.gz JGUDSTMNQDTOOI-HUUCEWRRSA-N 1 1 386.517 4.118 50 0 GIAAMO CCOc1cc2c(cc1OCC)[C@H](c1cc(OC)c(O)cc1Cl)[NH2+]CC2 ZINC000019848328 221459916 /nfs/dbraw/zinc/45/99/16/221459916.db2.gz MIOCKRHUPUDHKN-HXUWFJFHSA-N 1 1 377.868 4.087 50 0 GIAAMO C[C@@H]1C[N@H+](Cc2ccccc2)CCN1C(=O)c1csc(-c2cccs2)n1 ZINC000020431974 221487245 /nfs/dbraw/zinc/48/72/45/221487245.db2.gz WNKZWTHPYLQNMV-OAHLLOKOSA-N 1 1 383.542 4.218 50 0 GIAAMO C[C@@H]1C[N@@H+](Cc2ccccc2)CCN1C(=O)c1csc(-c2cccs2)n1 ZINC000020431974 221487249 /nfs/dbraw/zinc/48/72/49/221487249.db2.gz WNKZWTHPYLQNMV-OAHLLOKOSA-N 1 1 383.542 4.218 50 0 GIAAMO Cc1n[nH]c(C[N@H+]2CC[C@]3(C2)CCCN(CCC2CCCCC2)C3=O)c1Cl ZINC000426535593 533669791 /nfs/dbraw/zinc/66/97/91/533669791.db2.gz BTHJTNLVMNQXCO-NRFANRHFSA-N 1 1 392.975 4.156 50 0 GIAAMO Cc1ccc(-c2ccnc(N3CCC[C@H](c4[nH+]ccn4CC4CC4)C3)n2)c(C)n1 ZINC000095510649 136180671 /nfs/dbraw/zinc/18/06/71/136180671.db2.gz ULRPMWJPZRGFEI-IBGZPJMESA-N 1 1 388.519 4.146 50 0 GIAAMO C[N@H+](CC(=O)Nc1ccc2c(c1)CCC2)Cc1ccccc1N1CCCCC1 ZINC000012567435 136200509 /nfs/dbraw/zinc/20/05/09/136200509.db2.gz CMLJGOKIEWEPIA-UHFFFAOYSA-N 1 1 377.532 4.236 50 0 GIAAMO C[N@@H+](CC(=O)Nc1ccc2c(c1)CCC2)Cc1ccccc1N1CCCCC1 ZINC000012567435 136200510 /nfs/dbraw/zinc/20/05/10/136200510.db2.gz CMLJGOKIEWEPIA-UHFFFAOYSA-N 1 1 377.532 4.236 50 0 GIAAMO CC(C)Cc1ccc(S(=O)(=O)N2CCC(C[N@H+]3CCC[C@@H](C)C3)CC2)cc1 ZINC000032952010 221756321 /nfs/dbraw/zinc/75/63/21/221756321.db2.gz VVDDPFFMSISUOH-LJQANCHMSA-N 1 1 392.609 4.018 50 0 GIAAMO COc1cc(C[NH2+]CCCN(C)C)ccc1OCc1c(F)cccc1Cl ZINC000057398563 222031110 /nfs/dbraw/zinc/03/11/10/222031110.db2.gz QUXALHGSPIECQV-UHFFFAOYSA-N 1 1 380.891 4.108 50 0 GIAAMO COc1ccc(OC)c(NC(=O)C[NH2+][C@@H](c2ccccc2)c2ccc(C)cc2)c1 ZINC000057363012 222032608 /nfs/dbraw/zinc/03/26/08/222032608.db2.gz WMNMAGHMUSMBES-DEOSSOPVSA-N 1 1 390.483 4.330 50 0 GIAAMO COc1ccc(CNC(=O)C[NH2+][C@@H](c2cccs2)c2ccc(C)cc2)cc1 ZINC000057435557 222033055 /nfs/dbraw/zinc/03/30/55/222033055.db2.gz IBOUUGSXCREXJJ-JOCHJYFZSA-N 1 1 380.513 4.061 50 0 GIAAMO CCc1cccc(NC(=O)C2CC[NH+](Cc3nc(-c4ccccc4)no3)CC2)c1 ZINC000051317128 222004654 /nfs/dbraw/zinc/00/46/54/222004654.db2.gz AEKSQMMIICWSJX-UHFFFAOYSA-N 1 1 390.487 4.150 50 0 GIAAMO COCCN(Cc1ccc(C)cc1)C[C@@H]1CCC[N@@H+](C2Cc3ccccc3C2)C1 ZINC000055134346 222015255 /nfs/dbraw/zinc/01/52/55/222015255.db2.gz BWWAZZFGIUUWGC-QHCPKHFHSA-N 1 1 392.587 4.323 50 0 GIAAMO COCCN(Cc1ccc(C)cc1)C[C@@H]1CCC[N@H+](C2Cc3ccccc3C2)C1 ZINC000055134346 222015258 /nfs/dbraw/zinc/01/52/58/222015258.db2.gz BWWAZZFGIUUWGC-QHCPKHFHSA-N 1 1 392.587 4.323 50 0 GIAAMO O=C1CC[N@H+](Cc2ccc(C(F)(F)F)cc2)CCN1Cc1ccc(F)cc1 ZINC000055307520 222019970 /nfs/dbraw/zinc/01/99/70/222019970.db2.gz SOCFYBYBXGRBJV-UHFFFAOYSA-N 1 1 380.385 4.079 50 0 GIAAMO Cc1ccc(NC(=O)c2ccccc2)c(NC(=O)c2ccc(C[NH+](C)C)o2)c1 ZINC000055384195 222020400 /nfs/dbraw/zinc/02/04/00/222020400.db2.gz AQWJYJUNVBMQDK-UHFFFAOYSA-N 1 1 377.444 4.154 50 0 GIAAMO Cc1ccc(NC(=O)C[NH+]2CCC(c3nc(-c4ccccc4)no3)CC2)c(C)c1 ZINC000065184100 222106817 /nfs/dbraw/zinc/10/68/17/222106817.db2.gz BPQDWYAVJPDMTL-UHFFFAOYSA-N 1 1 390.487 4.172 50 0 GIAAMO COc1ccccc1CNC(=O)C[NH2+][C@H](c1ccccc1)c1ccc(Cl)cc1 ZINC000058157193 222041783 /nfs/dbraw/zinc/04/17/83/222041783.db2.gz MRPFZTIOVOQIEN-HSZRJFAPSA-N 1 1 394.902 4.344 50 0 GIAAMO COc1ccc([C@@H]2CCCCC[N@@H+]2CN2C(=O)NC3(CCC(C)CC3)C2=O)cc1 ZINC000058160777 222042793 /nfs/dbraw/zinc/04/27/93/222042793.db2.gz KAILTPPEVBVPCD-GTPZEUEISA-N 1 1 399.535 4.071 50 0 GIAAMO COc1ccc([C@@H]2CCCCC[N@H+]2CN2C(=O)NC3(CCC(C)CC3)C2=O)cc1 ZINC000058160777 222042797 /nfs/dbraw/zinc/04/27/97/222042797.db2.gz KAILTPPEVBVPCD-GTPZEUEISA-N 1 1 399.535 4.071 50 0 GIAAMO COC(=O)[C@@H](C)C[N@H+](Cc1ncc(-c2ccc(OC)cc2)o1)Cc1ccccc1 ZINC000060333811 222058853 /nfs/dbraw/zinc/05/88/53/222058853.db2.gz QPKHIXMQBTWFRN-KRWDZBQOSA-N 1 1 394.471 4.162 50 0 GIAAMO COC(=O)[C@@H](C)C[N@@H+](Cc1ncc(-c2ccc(OC)cc2)o1)Cc1ccccc1 ZINC000060333811 222058856 /nfs/dbraw/zinc/05/88/56/222058856.db2.gz QPKHIXMQBTWFRN-KRWDZBQOSA-N 1 1 394.471 4.162 50 0 GIAAMO COc1ccc(C[N@@H+](Cc2ccccc2)Cc2cc(=O)n3cc(C)ccc3n2)cc1 ZINC000064590878 222075026 /nfs/dbraw/zinc/07/50/26/222075026.db2.gz KVJILDHKFPMZOA-UHFFFAOYSA-N 1 1 399.494 4.214 50 0 GIAAMO COc1cccc(C[N@@H+]2CCCn3nc(-c4ccc(C)cc4)cc3C2)c1OC ZINC000065270457 222119216 /nfs/dbraw/zinc/11/92/16/222119216.db2.gz NOPWBNPTAPMXIU-UHFFFAOYSA-N 1 1 377.488 4.282 50 0 GIAAMO COc1cccc(C[N@H+]2CCCn3nc(-c4ccc(C)cc4)cc3C2)c1OC ZINC000065270457 222119219 /nfs/dbraw/zinc/11/92/19/222119219.db2.gz NOPWBNPTAPMXIU-UHFFFAOYSA-N 1 1 377.488 4.282 50 0 GIAAMO Cc1noc(C)c1NC(=O)c1ccc(C[N@H+]2CCC[C@@H]2c2ccccn2)cc1 ZINC000065424458 222129981 /nfs/dbraw/zinc/12/99/81/222129981.db2.gz RKULBUFROWKALY-HXUWFJFHSA-N 1 1 376.460 4.276 50 0 GIAAMO Cc1nc(C)c(C[N@H+]2CC[C@@]3(C2)CCCN(C(=O)c2cccc(C)c2)C3)s1 ZINC000067805992 222161186 /nfs/dbraw/zinc/16/11/86/222161186.db2.gz UWUDXUYTSUMFSX-JOCHJYFZSA-N 1 1 383.561 4.197 50 0 GIAAMO CCc1[nH+]ccn1CC(=O)N1CCC[C@H](CCc2cccc(C(F)(F)F)c2)C1 ZINC000071405777 222184031 /nfs/dbraw/zinc/18/40/31/222184031.db2.gz ZNAQGWZMHKGNKS-QGZVFWFLSA-N 1 1 393.453 4.336 50 0 GIAAMO CCc1[nH+]ccn1CC(=O)N1CCC[C@@H](CCc2cccc(C(F)(F)F)c2)C1 ZINC000071405778 222184209 /nfs/dbraw/zinc/18/42/09/222184209.db2.gz ZNAQGWZMHKGNKS-KRWDZBQOSA-N 1 1 393.453 4.336 50 0 GIAAMO Cc1ccc(C(=O)N2CCC[N@@H+](Cc3ccc(F)cc3)[C@H](C(C)C)C2)cc1O ZINC000071730303 222188599 /nfs/dbraw/zinc/18/85/99/222188599.db2.gz QMKFWODLGIXDQL-NRFANRHFSA-N 1 1 384.495 4.212 50 0 GIAAMO OCCOc1ccccc1C[N@H+]1CCC[C@H](CCc2ccc(F)cc2F)C1 ZINC000071762495 222193764 /nfs/dbraw/zinc/19/37/64/222193764.db2.gz QWRBOXSXFVGNBW-QGZVFWFLSA-N 1 1 375.459 4.181 50 0 GIAAMO COCc1ncc(C[N@H+]2CCC[C@H](CCc3cccc(C(F)(F)F)c3)C2)cn1 ZINC000071759201 222194708 /nfs/dbraw/zinc/19/47/08/222194708.db2.gz HBGVYJZKBLXLQJ-QGZVFWFLSA-N 1 1 393.453 4.487 50 0 GIAAMO CCC(=O)N(c1ccccc1)[C@@H]1CC[N@@H+](CCCC(=O)c2ccc(F)cc2)C1 ZINC000071769278 222196377 /nfs/dbraw/zinc/19/63/77/222196377.db2.gz RSXFNAUIXGOMCW-OAQYLSRUSA-N 1 1 382.479 4.306 50 0 GIAAMO COc1ccc(-c2nnc(C[N@@H+](CCCO)[C@@H]3CCCc4ccccc43)o2)cc1 ZINC000072308765 222223136 /nfs/dbraw/zinc/22/31/36/222223136.db2.gz AQIZBZKHEKKKKF-OAQYLSRUSA-N 1 1 393.487 4.007 50 0 GIAAMO COc1ccc(-c2nc3cc(C)ccc3cc2CN2CC[N@H+]3CCC[C@@H]3C2)cc1 ZINC000072410755 222255639 /nfs/dbraw/zinc/25/56/39/222255639.db2.gz MMLKZEXUTIUWKX-JOCHJYFZSA-N 1 1 387.527 4.499 50 0 GIAAMO COc1ccc(-c2nc3c(C)cccc3cc2C[N@H+]2CCC[C@@H](O)C2)cc1OC ZINC000072407859 222256103 /nfs/dbraw/zinc/25/61/03/222256103.db2.gz MHCQDKFDEIQXLU-HXUWFJFHSA-N 1 1 392.499 4.184 50 0 GIAAMO Cc1cccc(-n2cc(C[N@H+](C)CC3(CO)CC3)c(-c3cccc(F)c3)n2)c1 ZINC000072418068 222257985 /nfs/dbraw/zinc/25/79/85/222257985.db2.gz PEXJHGFOBNQTKI-UHFFFAOYSA-N 1 1 379.479 4.191 50 0 GIAAMO Cc1cc(-c2nn(-c3ccccc3F)cc2CN2CC[N@@H+](C)[C@H](C)C2)c(C)s1 ZINC000072436298 222261521 /nfs/dbraw/zinc/26/15/21/222261521.db2.gz OMAUPCNWWKFXJR-OAHLLOKOSA-N 1 1 398.551 4.493 50 0 GIAAMO COc1ccc(-c2nn(-c3ccccc3F)cc2C[N@@H+](C)C[C@H]2CCCO2)cc1 ZINC000072454284 222262349 /nfs/dbraw/zinc/26/23/49/222262349.db2.gz UPAIBZRZZSJIRF-HXUWFJFHSA-N 1 1 395.478 4.298 50 0 GIAAMO Cc1nc(C[NH+]2CCC3(CC(=O)N(Cc4ccc(Cl)cc4)C3)CC2)cs1 ZINC000077438492 222280737 /nfs/dbraw/zinc/28/07/37/222280737.db2.gz QCJHLLDUXVGZQM-UHFFFAOYSA-N 1 1 389.952 4.120 50 0 GIAAMO Cc1ccc(-c2c[nH]nc2[C@H]2CCC[N@H+](Cc3cnc(N(C)C)s3)C2)cc1 ZINC000077455925 222283032 /nfs/dbraw/zinc/28/30/32/222283032.db2.gz FTGHCQRBTFNQGZ-KRWDZBQOSA-N 1 1 381.549 4.287 50 0 GIAAMO C[C@H]1CCc2c(C(=O)N3CCC[N@H+](Cc4ccc(F)cc4)CC3)csc2C1 ZINC000084700245 222321488 /nfs/dbraw/zinc/32/14/88/222321488.db2.gz PVAPFPKAGYFIMW-INIZCTEOSA-N 1 1 386.536 4.360 50 0 GIAAMO C[C@H]1CCc2c(C(=O)N3CCC[N@@H+](Cc4ccc(F)cc4)CC3)csc2C1 ZINC000084700245 222321491 /nfs/dbraw/zinc/32/14/91/222321491.db2.gz PVAPFPKAGYFIMW-INIZCTEOSA-N 1 1 386.536 4.360 50 0 GIAAMO Cc1cccc(-c2nc(CNC(=O)[C@H]3CCC[N@@H+](Cc4ccco4)C3)cs2)c1 ZINC000095519510 222346846 /nfs/dbraw/zinc/34/68/46/222346846.db2.gz CMBWJHRRRGFVFK-SFHVURJKSA-N 1 1 395.528 4.240 50 0 GIAAMO Cc1ccc(OCc2nc(C[NH2+][C@@H](C)c3ccc(NC(N)=O)cc3)cs2)cc1 ZINC000095959250 222365931 /nfs/dbraw/zinc/36/59/31/222365931.db2.gz FHOZDJFCFTXHHQ-HNNXBMFYSA-N 1 1 396.516 4.372 50 0 GIAAMO C[C@H](CCc1ccc2c(c1)OCO2)[NH2+][C@@H](C)c1noc(Cc2ccccc2)n1 ZINC000165385809 222531374 /nfs/dbraw/zinc/53/13/74/222531374.db2.gz VISHCEUPQKJTTJ-CVEARBPZSA-N 1 1 379.460 4.061 50 0 GIAAMO Cc1noc(C[N@@H+]2CCC[C@@H](CCC(=O)Nc3ccc(C(F)(F)F)cc3)C2)n1 ZINC000095523366 534406587 /nfs/dbraw/zinc/40/65/87/534406587.db2.gz ZDZKWNQDPLAPPO-AWEZNQCLSA-N 1 1 396.413 4.028 50 0 GIAAMO Cc1noc(C[N@H+]2CCC[C@@H](CCC(=O)Nc3ccc(C(F)(F)F)cc3)C2)n1 ZINC000095523366 534406591 /nfs/dbraw/zinc/40/65/91/534406591.db2.gz ZDZKWNQDPLAPPO-AWEZNQCLSA-N 1 1 396.413 4.028 50 0 GIAAMO COc1ccc(C[NH+]2CCN(c3cccc(C(F)(F)F)c3)CC2)c(OC)c1 ZINC000000752272 524034321 /nfs/dbraw/zinc/03/43/21/524034321.db2.gz KMSCGWGAGJSJLV-UHFFFAOYSA-N 1 1 380.410 4.045 50 0 GIAAMO CCC(=O)c1cccc(-c2ccc(C(=O)N(CC)C[C@@H]3CC[N@@H+](C)C3)cc2)c1 ZINC000426478934 528468957 /nfs/dbraw/zinc/46/89/57/528468957.db2.gz OMUZOMDJTAYJFJ-GOSISDBHSA-N 1 1 378.516 4.360 50 0 GIAAMO CN(C)c1ncc(C[N@H+]2CCC[C@@H](C(=O)c3cccc4ccccc43)C2)s1 ZINC000019720371 570211001 /nfs/dbraw/zinc/21/10/01/570211001.db2.gz CESQIEUUKLAMLY-QGZVFWFLSA-N 1 1 379.529 4.457 50 0 GIAAMO CN1CC[NH+](CCO[C@H]2Cc3ccccc3Sc3ccc(Cl)cc32)CC1 ZINC000019802428 570220783 /nfs/dbraw/zinc/22/07/83/570220783.db2.gz BJZHTQLHPCJNND-IBGZPJMESA-N 1 1 388.964 4.352 50 0 GIAAMO COc1ccc(OCCn2c3ccccc3n(Cc3ccccc3C)c2=[NH2+])cc1 ZINC000019907249 570229105 /nfs/dbraw/zinc/22/91/05/570229105.db2.gz QDEWTNCEDUJTFI-UHFFFAOYSA-N 1 1 387.483 4.367 50 0 GIAAMO O=C(Nc1cc(Cl)cc(Cl)c1)[C@H](c1ccccc1)[NH+]1CCC(O)CC1 ZINC000048279076 570230969 /nfs/dbraw/zinc/23/09/69/570230969.db2.gz IIJPBOCPOFHASI-SFHVURJKSA-N 1 1 379.287 4.130 50 0 GIAAMO COc1cccc(C[N@H+]2CCC[C@@H](N3CCN(c4cccc(Cl)c4)CC3)C2)c1 ZINC000019939330 570232460 /nfs/dbraw/zinc/23/24/60/570232460.db2.gz CIQHHNDFCJJEEL-JOCHJYFZSA-N 1 1 399.966 4.135 50 0 GIAAMO COc1cccc(CN2CCC[C@@H]([NH+]3CCN(c4cccc(Cl)c4)CC3)C2)c1 ZINC000019939330 570232465 /nfs/dbraw/zinc/23/24/65/570232465.db2.gz CIQHHNDFCJJEEL-JOCHJYFZSA-N 1 1 399.966 4.135 50 0 GIAAMO FC(F)(F)c1cccc(N2CCN([C@H]3CCC[N@@H+](Cc4ccco4)C3)CC2)c1 ZINC000020455419 570258793 /nfs/dbraw/zinc/25/87/93/570258793.db2.gz SYZDEHAZVIIWHF-IBGZPJMESA-N 1 1 393.453 4.085 50 0 GIAAMO FC(F)(F)c1cccc(N2CC[NH+]([C@H]3CCCN(Cc4ccco4)C3)CC2)c1 ZINC000020455419 570258796 /nfs/dbraw/zinc/25/87/96/570258796.db2.gz SYZDEHAZVIIWHF-IBGZPJMESA-N 1 1 393.453 4.085 50 0 GIAAMO CCC(=O)c1ccccc1OCCCC[NH+]1CCN(Cc2ccccc2)CC1 ZINC000020500188 570264233 /nfs/dbraw/zinc/26/42/33/570264233.db2.gz GZATZVIDFBNYSI-UHFFFAOYSA-N 1 1 380.532 4.256 50 0 GIAAMO COc1ccc(-n2ncc([C@@H](C)[NH2+]Cc3nc4ccccc4nc3C)c2C)cc1 ZINC000020560584 570267815 /nfs/dbraw/zinc/26/78/15/570267815.db2.gz ORNRZPXYWVNGNL-OAHLLOKOSA-N 1 1 387.487 4.292 50 0 GIAAMO CC(C)n1ncc(NC(=O)c2ccc([C@H]3CCC[N@@H+]3Cc3ccco3)s2)n1 ZINC000020586635 570269112 /nfs/dbraw/zinc/26/91/12/570269112.db2.gz LUYAYFOFMLNTOQ-OAHLLOKOSA-N 1 1 385.493 4.103 50 0 GIAAMO CC(C)n1ncc(NC(=O)c2ccc([C@H]3CCC[N@H+]3Cc3ccco3)s2)n1 ZINC000020586635 570269113 /nfs/dbraw/zinc/26/91/13/570269113.db2.gz LUYAYFOFMLNTOQ-OAHLLOKOSA-N 1 1 385.493 4.103 50 0 GIAAMO CC[N@@H+]1CCc2nc(NC(=O)CCc3ccc(-c4ccccc4F)o3)sc2C1 ZINC000021296136 570290035 /nfs/dbraw/zinc/29/00/35/570290035.db2.gz VCFICHYFBQQABW-UHFFFAOYSA-N 1 1 399.491 4.492 50 0 GIAAMO CC[N@H+]1CCc2nc(NC(=O)CCc3ccc(-c4ccccc4F)o3)sc2C1 ZINC000021296136 570290039 /nfs/dbraw/zinc/29/00/39/570290039.db2.gz VCFICHYFBQQABW-UHFFFAOYSA-N 1 1 399.491 4.492 50 0 GIAAMO CCOc1ccc([C@H]2CCC[N@H+]2Cc2cc(=O)n3cc(Cl)ccc3n2)cc1 ZINC000021584799 570292769 /nfs/dbraw/zinc/29/27/69/570292769.db2.gz MQHZSNQTXZXYDX-LJQANCHMSA-N 1 1 383.879 4.084 50 0 GIAAMO Cc1ccc(C)c(-c2n[nH]cc2C[N@H+]2CCC[C@H](OCc3ccccn3)C2)c1 ZINC000216530700 570302988 /nfs/dbraw/zinc/30/29/88/570302988.db2.gz IDNXWKQSHHOUAU-NRFANRHFSA-N 1 1 376.504 4.270 50 0 GIAAMO Fc1ccccc1-c1noc2c1CN([C@H]1CC[N@@H+](Cc3ccccc3)C1)CC2 ZINC000023358327 570322046 /nfs/dbraw/zinc/32/20/46/570322046.db2.gz YMDIEHZYTDDEKF-SFHVURJKSA-N 1 1 377.463 4.113 50 0 GIAAMO Cc1ccsc1C[N@H+]1CCC[C@H](N2CCN(c3cccc(Cl)c3)CC2)C1 ZINC000022914491 570334618 /nfs/dbraw/zinc/33/46/18/570334618.db2.gz XSEFWIICFHFIGY-FQEVSTJZSA-N 1 1 389.996 4.497 50 0 GIAAMO COCCC[C@@H]1CCC[N@H+](C2CCN(c3ccc(-c4cc[nH]n4)cc3)CC2)C1 ZINC000023251728 570352625 /nfs/dbraw/zinc/35/26/25/570352625.db2.gz DVYSVOFCJZJTNH-IBGZPJMESA-N 1 1 382.552 4.184 50 0 GIAAMO CCCCCCOc1ccc(N2C(=O)C[C@@H]([N@H+](C)Cc3ccccc3)C2=O)cc1 ZINC000004713994 570397056 /nfs/dbraw/zinc/39/70/56/570397056.db2.gz XCSZWJQIASJREB-JOCHJYFZSA-N 1 1 394.515 4.410 50 0 GIAAMO CCCCCCOc1ccc(N2C(=O)C[C@@H]([N@@H+](C)Cc3ccccc3)C2=O)cc1 ZINC000004713994 570397058 /nfs/dbraw/zinc/39/70/58/570397058.db2.gz XCSZWJQIASJREB-JOCHJYFZSA-N 1 1 394.515 4.410 50 0 GIAAMO CC(=O)c1c(C)[nH]c(C(=O)Nc2nc(C[NH+]3C[C@H](C)C[C@@H](C)C3)cs2)c1C ZINC000025057991 570404841 /nfs/dbraw/zinc/40/48/41/570404841.db2.gz NXIWSNVYNZZNJA-VXGBXAGGSA-N 1 1 388.537 4.021 50 0 GIAAMO COc1ccc(C[N@H+]2CCC[C@H](C(=O)Nc3c(C)cccc3C)C2)cc1OC ZINC000005017763 570424131 /nfs/dbraw/zinc/42/41/31/570424131.db2.gz QSVNBDGOVAQFFK-IBGZPJMESA-N 1 1 382.504 4.171 50 0 GIAAMO O[C@]12CCCC[C@H]1[C@@H](c1ccc3c(c1)OCO3)[N@@H+](Cc1cccc(F)c1)CC2 ZINC000006576856 570481117 /nfs/dbraw/zinc/48/11/17/570481117.db2.gz ORZUIMGMXAQGPX-PMOQBDJRSA-N 1 1 383.463 4.423 50 0 GIAAMO O=C(CCc1ccco1)N1CC[NH+](Cc2ccc(-c3cccc(F)c3)s2)CC1 ZINC000030181209 570486727 /nfs/dbraw/zinc/48/67/27/570486727.db2.gz DWESQTKBLAFBMY-UHFFFAOYSA-N 1 1 398.503 4.424 50 0 GIAAMO Cc1ccc(NC(=O)C2CC[NH+](Cc3nc(-c4ccccc4)no3)CC2)cc1C ZINC000030955116 570502399 /nfs/dbraw/zinc/50/23/99/570502399.db2.gz VGRYUNJLAQKBMB-UHFFFAOYSA-N 1 1 390.487 4.204 50 0 GIAAMO COc1ccc(C[N@@H+](C[C@@H](O)COc2ccc(Cl)cc2)C(C)C)cc1OC ZINC000036095804 570535615 /nfs/dbraw/zinc/53/56/15/570535615.db2.gz OOFBLKKIBDXFTI-GOSISDBHSA-N 1 1 393.911 4.008 50 0 GIAAMO O[C@@H](COCc1ccccc1)C[N@@H+](Cc1ccccc1)Cc1ccccc1F ZINC000036103014 570540286 /nfs/dbraw/zinc/54/02/86/570540286.db2.gz PMQICGVGDDPNGF-HSZRJFAPSA-N 1 1 379.475 4.406 50 0 GIAAMO COc1ccc(C(=O)NC[C@@H](c2ccsc2)[N@@H+]2CCc3ccccc3C2)cc1 ZINC000022765983 570543585 /nfs/dbraw/zinc/54/35/85/570543585.db2.gz TUYLSTHMSAKFBB-QFIPXVFZSA-N 1 1 392.524 4.286 50 0 GIAAMO COc1ccc(C(=O)NC[C@@H](c2ccsc2)[N@H+]2CCc3ccccc3C2)cc1 ZINC000022765983 570543590 /nfs/dbraw/zinc/54/35/90/570543590.db2.gz TUYLSTHMSAKFBB-QFIPXVFZSA-N 1 1 392.524 4.286 50 0 GIAAMO O=C(NC[C@@H](c1cccs1)[N@@H+]1CCc2ccccc2C1)NC1CCCCC1 ZINC000022907674 570564240 /nfs/dbraw/zinc/56/42/40/570564240.db2.gz FZAFQJGXTCERFD-FQEVSTJZSA-N 1 1 383.561 4.479 50 0 GIAAMO O=C(NC[C@@H](c1cccs1)[N@H+]1CCc2ccccc2C1)NC1CCCCC1 ZINC000022907674 570564246 /nfs/dbraw/zinc/56/42/46/570564246.db2.gz FZAFQJGXTCERFD-FQEVSTJZSA-N 1 1 383.561 4.479 50 0 GIAAMO COc1ccccc1[C@@H](CNC(=O)c1oc2ccc(Cl)cc2c1C)[NH+](C)C ZINC000006747983 570566939 /nfs/dbraw/zinc/56/69/39/570566939.db2.gz SUUFFJDFIFISSF-QGZVFWFLSA-N 1 1 386.879 4.436 50 0 GIAAMO COC(=O)c1ccc(C[N@H+]2CCC[C@@](CO)(CCCc3ccccc3)C2)cc1 ZINC000039364268 570590245 /nfs/dbraw/zinc/59/02/45/570590245.db2.gz NKXXXDAQXNEFMC-DEOSSOPVSA-N 1 1 381.516 4.071 50 0 GIAAMO OC[C@@]1(Cc2ccc(F)cc2)CCC[N@H+](C2CCN(Cc3ccccc3)CC2)C1 ZINC000039413283 570591326 /nfs/dbraw/zinc/59/13/26/570591326.db2.gz SQHCCZZAIZAQGZ-RUZDIDTESA-N 1 1 396.550 4.107 50 0 GIAAMO O[C@@]1(c2ccccc2)CCC[N@@H+](CCCc2nc(-c3ccccc3)no2)CC1 ZINC000225674706 570601495 /nfs/dbraw/zinc/60/14/95/570601495.db2.gz AVMATHWIROJUON-QHCPKHFHSA-N 1 1 377.488 4.043 50 0 GIAAMO Cc1ccc2c(c1)C1=C([C@@H](c3cccs3)O2)[C@H](c2cccnc2)N2NC=NC2=[NH+]1 ZINC000005516554 570623974 /nfs/dbraw/zinc/62/39/74/570623974.db2.gz NPKPSTXPHUZRKY-LEWJYISDSA-N 1 1 399.479 4.256 50 0 GIAAMO COc1ccc([C@@H]2CC(c3cc(C)ccc3C)=NN2C(=O)C[N@@H+](C)C(C)C)cc1 ZINC000036345147 570627682 /nfs/dbraw/zinc/62/76/82/570627682.db2.gz JTDMPCAZHYDMLX-QHCPKHFHSA-N 1 1 393.531 4.330 50 0 GIAAMO COc1ccccc1[C@H]1CC(c2cc(C)ccc2C)=NN1C(=O)C[N@@H+](C)C(C)C ZINC000036345368 570627735 /nfs/dbraw/zinc/62/77/35/570627735.db2.gz UYDUZYRJZVDBKW-JOCHJYFZSA-N 1 1 393.531 4.330 50 0 GIAAMO COc1ccc(C2=NN(C(=O)C[N@@H+](C)C(C)C)[C@H](c3ccc(C)cc3C)C2)cc1 ZINC000036345773 570628181 /nfs/dbraw/zinc/62/81/81/570628181.db2.gz DACIPWNOMRYAEO-QHCPKHFHSA-N 1 1 393.531 4.330 50 0 GIAAMO CC(=O)Nc1sc2c(c1C[NH+]1CCN(c3ccc(F)cc3)CC1)CCCC2 ZINC000054072961 570676313 /nfs/dbraw/zinc/67/63/13/570676313.db2.gz JYHAMVSBYCEZJP-UHFFFAOYSA-N 1 1 387.524 4.047 50 0 GIAAMO C[C@@H]1CCCC[N@H+]1Cc1ccccc1CNC(=O)CCc1nc2ccccc2[nH]1 ZINC000036394397 570679059 /nfs/dbraw/zinc/67/90/59/570679059.db2.gz KCJFDLJMVNKCQM-GOSISDBHSA-N 1 1 390.531 4.186 50 0 GIAAMO CCN(C(=O)C[N@@H+]1CCC[C@H]1c1ccc(OC)c(OC)c1)c1ccccc1C ZINC000036395409 570679097 /nfs/dbraw/zinc/67/90/97/570679097.db2.gz QYQZLULFVJZARR-FQEVSTJZSA-N 1 1 382.504 4.202 50 0 GIAAMO CCN(C(=O)C[N@H+]1CCC[C@H]1c1ccc(OC)c(OC)c1)c1ccccc1C ZINC000036395409 570679102 /nfs/dbraw/zinc/67/91/02/570679102.db2.gz QYQZLULFVJZARR-FQEVSTJZSA-N 1 1 382.504 4.202 50 0 GIAAMO CC[C@@H](CO)[N@@H+](Cc1c(C)nc2ccc(Cl)cn21)Cc1ccc(F)cc1 ZINC000055091066 570682354 /nfs/dbraw/zinc/68/23/54/570682354.db2.gz UJQVBCVGQUTGQS-SFHVURJKSA-N 1 1 375.875 4.208 50 0 GIAAMO C[C@@H](c1ccccc1)N(C)C(=O)C[N@@H+]1CCC[C@H]1c1ccc2c(c1)OCCCO2 ZINC000036398753 570683879 /nfs/dbraw/zinc/68/38/79/570683879.db2.gz QFQATWYJRYALDC-RXVVDRJESA-N 1 1 394.515 4.204 50 0 GIAAMO C[C@@H](c1ccccc1)N(C)C(=O)C[N@H+]1CCC[C@H]1c1ccc2c(c1)OCCCO2 ZINC000036398753 570683884 /nfs/dbraw/zinc/68/38/84/570683884.db2.gz QFQATWYJRYALDC-RXVVDRJESA-N 1 1 394.515 4.204 50 0 GIAAMO Cc1[nH+]ccn1-c1ccc(NC(=O)c2cc(C(C)C)n(-c3ccccc3)n2)cn1 ZINC000155345038 570686314 /nfs/dbraw/zinc/68/63/14/570686314.db2.gz ITTPEEZLWJZTKC-UHFFFAOYSA-N 1 1 386.459 4.137 50 0 GIAAMO CC[C@H](c1nnc(SCC(=O)Nc2ccccc2-c2ccccc2)o1)[NH+](C)C ZINC000032691549 570742722 /nfs/dbraw/zinc/74/27/22/570742722.db2.gz RVWGMPSMDBJMDZ-GOSISDBHSA-N 1 1 396.516 4.480 50 0 GIAAMO COc1ccc([C@@H]2CCC[N@@H+]2CC(=O)Nc2cc(C)c(Cl)cc2OC)cc1 ZINC000025414170 570750585 /nfs/dbraw/zinc/75/05/85/570750585.db2.gz ORMSJNJIGOZVGS-IBGZPJMESA-N 1 1 388.895 4.441 50 0 GIAAMO COc1ccc([C@@H]2CCC[N@H+]2CC(=O)Nc2cc(C)c(Cl)cc2OC)cc1 ZINC000025414170 570750587 /nfs/dbraw/zinc/75/05/87/570750587.db2.gz ORMSJNJIGOZVGS-IBGZPJMESA-N 1 1 388.895 4.441 50 0 GIAAMO CC(C)c1noc(-c2cccnc2N2CCC[N@@H+](Cc3ccc(F)cc3)CC2)n1 ZINC000065257917 570758923 /nfs/dbraw/zinc/75/89/23/570758923.db2.gz UTMOMCFIRCIKHF-UHFFFAOYSA-N 1 1 395.482 4.106 50 0 GIAAMO COc1ccc(C[N@@H+](C[C@H](O)CO[C@@H]2CCCc3ccccc32)C2CC2)cc1 ZINC000032743339 570787487 /nfs/dbraw/zinc/78/74/87/570787487.db2.gz BZQPCJYBMDOZBG-XUZZJYLKSA-N 1 1 381.516 4.115 50 0 GIAAMO Clc1ccccc1Cn1nc(C[NH2+]Cc2ccncc2)c(-c2ccccc2)n1 ZINC000261491702 570789530 /nfs/dbraw/zinc/78/95/30/570789530.db2.gz DOFPFVCAVXRSII-UHFFFAOYSA-N 1 1 389.890 4.332 50 0 GIAAMO Clc1ccccc1Cn1nc(C[NH2+]Cc2cccnc2)c(-c2ccccc2)n1 ZINC000261492434 570789690 /nfs/dbraw/zinc/78/96/90/570789690.db2.gz ANVJFGPAKQHYBD-UHFFFAOYSA-N 1 1 389.890 4.332 50 0 GIAAMO O=C(NCCC[N@@H+]1CCO[C@@H](c2ccccc2)C1)c1ccc(Cl)cc1Cl ZINC000036699957 570794872 /nfs/dbraw/zinc/79/48/72/570794872.db2.gz QNJDYKYVGYHOOF-LJQANCHMSA-N 1 1 393.314 4.187 50 0 GIAAMO O=C(NCCC[N@H+]1CCO[C@@H](c2ccccc2)C1)c1ccc(Cl)cc1Cl ZINC000036699957 570794874 /nfs/dbraw/zinc/79/48/74/570794874.db2.gz QNJDYKYVGYHOOF-LJQANCHMSA-N 1 1 393.314 4.187 50 0 GIAAMO C[C@@H](c1nc2ccccc2n1C(F)F)N1CC[NH+](Cc2ccsc2)CC1 ZINC000036723523 570805574 /nfs/dbraw/zinc/80/55/74/570805574.db2.gz NNRDEHUSLBANIG-AWEZNQCLSA-N 1 1 376.476 4.372 50 0 GIAAMO COc1ccc([C@@H]2CC(c3ccccc3)=NN2C(=O)C[N@H+]2CCCC[C@H]2C)cc1 ZINC000037130763 570842710 /nfs/dbraw/zinc/84/27/10/570842710.db2.gz AVLULMFXAXTXNV-JPYJTQIMSA-N 1 1 391.515 4.247 50 0 GIAAMO O=C1N[C@@H](/C=C/c2ccco2)Nc2sc3c(c21)CC[N@@H+](Cc1ccccc1)C3 ZINC000004525923 570842982 /nfs/dbraw/zinc/84/29/82/570842982.db2.gz GKBSEDVGSXVRTP-CSHXORCISA-N 1 1 391.496 4.094 50 0 GIAAMO O=C1N[C@@H](/C=C/c2ccco2)Nc2sc3c(c21)CC[N@H+](Cc1ccccc1)C3 ZINC000004525923 570842983 /nfs/dbraw/zinc/84/29/83/570842983.db2.gz GKBSEDVGSXVRTP-CSHXORCISA-N 1 1 391.496 4.094 50 0 GIAAMO CC(=O)Nc1ccc2c(C[N@@H+](C)Cc3ccc([C@H]4C[C@@H]4C)o3)cc(=O)oc2c1 ZINC000032844970 570852458 /nfs/dbraw/zinc/85/24/58/570852458.db2.gz GSQMQZZPHYUAPL-DJJJIMSYSA-N 1 1 380.444 4.100 50 0 GIAAMO CC(=O)Nc1ccc2c(C[N@H+](C)Cc3ccc([C@H]4C[C@@H]4C)o3)cc(=O)oc2c1 ZINC000032844970 570852461 /nfs/dbraw/zinc/85/24/61/570852461.db2.gz GSQMQZZPHYUAPL-DJJJIMSYSA-N 1 1 380.444 4.100 50 0 GIAAMO C[C@@H]([NH2+][C@H](C(=O)N1CCCCC1)c1ccccc1)c1ccc(-n2ccnc2)cc1 ZINC000012560219 570862156 /nfs/dbraw/zinc/86/21/56/570862156.db2.gz YDLTTXRVPYOILR-XXBNENTESA-N 1 1 388.515 4.277 50 0 GIAAMO O=C(CCc1ccccc1)[C@H]1CCC[N@@H+](Cc2cc(-c3ccccn3)no2)C1 ZINC000072144031 570870392 /nfs/dbraw/zinc/87/03/92/570870392.db2.gz SVTSKMLUTREZBE-IBGZPJMESA-N 1 1 375.472 4.151 50 0 GIAAMO CCOc1ccc(C[NH2+]CC2(N[C@@H](C)c3ccccc3)CCOCC2)cc1OC ZINC000097002580 570885935 /nfs/dbraw/zinc/88/59/35/570885935.db2.gz FIMOFHKWOPUHSO-IBGZPJMESA-N 1 1 398.547 4.084 50 0 GIAAMO Cc1cc(C)nc(-c2cccc(C(=O)NC[C@@H]3Cc4ccccc4C[N@H+]3C)c2)c1 ZINC000299759598 570892154 /nfs/dbraw/zinc/89/21/54/570892154.db2.gz VBGYRYHCOWPVHY-QHCPKHFHSA-N 1 1 385.511 4.152 50 0 GIAAMO Cc1cc(C)nc(-c2cccc(C(=O)NC[C@@H]3Cc4ccccc4C[N@@H+]3C)c2)c1 ZINC000299759598 570892158 /nfs/dbraw/zinc/89/21/58/570892158.db2.gz 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4.162 50 0 GIAAMO C[C@@H]1CCC[N@@H+](CCCNc2ccc(-c3nc(-c4cccc(F)c4)no3)cn2)C1 ZINC000064676923 222079854 /nfs/dbraw/zinc/07/98/54/222079854.db2.gz VBEMISLAEQGBCT-MRXNPFEDSA-N 1 1 395.482 4.472 50 0 GIAAMO CCNc1nc(Nc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2)cc(C)[nH+]1 ZINC000064801709 222082661 /nfs/dbraw/zinc/08/26/61/222082661.db2.gz YTAAZCLUCDJDNZ-UHFFFAOYSA-N 1 1 397.504 4.070 50 0 GIAAMO O=C(NCc1cccc(C(F)(F)F)c1)C1=CC[N@@H+](Cc2cccc(F)c2)CC1 ZINC000064818091 222083762 /nfs/dbraw/zinc/08/37/62/222083762.db2.gz PWXQQLFWGUSPKZ-UHFFFAOYSA-N 1 1 392.396 4.293 50 0 GIAAMO Oc1cc(-c2cccnc2)cc2c1OCC[N@H+](Cc1c[nH]nc1-c1ccccc1)C2 ZINC000067921442 222166728 /nfs/dbraw/zinc/16/67/28/222166728.db2.gz JGEXOVHWRPVSSH-UHFFFAOYSA-N 1 1 398.466 4.239 50 0 GIAAMO Oc1cc(-c2cccnc2)cc2c1OCC[N@@H+](Cc1c[nH]nc1-c1ccccc1)C2 ZINC000067921442 222166730 /nfs/dbraw/zinc/16/67/30/222166730.db2.gz JGEXOVHWRPVSSH-UHFFFAOYSA-N 1 1 398.466 4.239 50 0 GIAAMO CC(C)c1[nH+]ccn1CCCNC(=O)c1ccc(-c2ccc3cc[nH]c3c2)nc1 ZINC000067946359 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CCS[C@@H]1CC[C@H]([N@@H+](C)CC(=O)Nc2ccc(Br)cc2C)C1 ZINC000072305261 222222093 /nfs/dbraw/zinc/22/20/93/222222093.db2.gz HSJTYKXMCBXAAS-LSDHHAIUSA-N 1 1 385.371 4.302 50 0 GIAAMO CCNc1nc(Nc2ccc(NC(=O)c3ccc(F)cc3F)cc2)cc(C)[nH+]1 ZINC000072437938 222261586 /nfs/dbraw/zinc/26/15/86/222261586.db2.gz RCQDPIUINIJYQJ-UHFFFAOYSA-N 1 1 383.402 4.491 50 0 GIAAMO CCn1c2ccccc2c2cc(C[N@H+]3CCC[C@@]4(CN(C)C(=O)O4)C3)ccc21 ZINC000072431305 222261746 /nfs/dbraw/zinc/26/17/46/222261746.db2.gz MYSQAGGPGNDOAD-HSZRJFAPSA-N 1 1 377.488 4.231 50 0 GIAAMO COc1ccc(OC)c2nc(-c3ccc(Cl)cc3)c(C[N@H+]3CC[C@H](O)C3)cc12 ZINC000072462608 222263257 /nfs/dbraw/zinc/26/32/57/222263257.db2.gz XLKJVXFLNNBHDT-KRWDZBQOSA-N 1 1 398.890 4.139 50 0 GIAAMO Cc1cccc(-n2cc(CN(C)[C@@H]3CC[N@@H+](C)C3)c(-c3cccc(F)c3)n2)c1 ZINC000072470006 222263749 /nfs/dbraw/zinc/26/37/49/222263749.db2.gz GRPWEGBQWMIHTR-JOCHJYFZSA-N 1 1 378.495 4.123 50 0 GIAAMO Cc1cccc(-n2cc(C[N@@H+](C)[C@@H]3CCN(C)C3)c(-c3cccc(F)c3)n2)c1 ZINC000072470006 222263754 /nfs/dbraw/zinc/26/37/54/222263754.db2.gz GRPWEGBQWMIHTR-JOCHJYFZSA-N 1 1 378.495 4.123 50 0 GIAAMO Cc1cccc(-n2cc(C[N@H+](C)[C@@H]3CCN(C)C3)c(-c3cccc(F)c3)n2)c1 ZINC000072470006 222263757 /nfs/dbraw/zinc/26/37/57/222263757.db2.gz GRPWEGBQWMIHTR-JOCHJYFZSA-N 1 1 378.495 4.123 50 0 GIAAMO c1cn(Cc2cccnc2)c([C@@H]2CCCN(c3nc4ccccc4s3)C2)[nH+]1 ZINC000095498072 222332186 /nfs/dbraw/zinc/33/21/86/222332186.db2.gz SVQYCXWZAIAKSP-QGZVFWFLSA-N 1 1 375.501 4.320 50 0 GIAAMO CCCNC(=O)C1([NH2+]Cc2csc(-c3ccc(F)cc3)n2)CCCCC1 ZINC000095964664 222365083 /nfs/dbraw/zinc/36/50/83/222365083.db2.gz VXPJYGBKKRYBEC-UHFFFAOYSA-N 1 1 375.513 4.268 50 0 GIAAMO CC[NH+]1CCN(c2ccc(NC(=O)c3ccccc3Cl)cc2Cl)CC1 ZINC000000809777 521699046 /nfs/dbraw/zinc/69/90/46/521699046.db2.gz JFBTWUTWFGXZLY-UHFFFAOYSA-N 1 1 378.303 4.388 50 0 GIAAMO Cc1ccc(N[C@H]2CCC[N@H+](C3CCN(Cc4ccccn4)CC3)C2)cc1C ZINC000019220334 525321308 /nfs/dbraw/zinc/32/13/08/525321308.db2.gz GPMDVDZQLCUJMZ-QHCPKHFHSA-N 1 1 378.564 4.239 50 0 GIAAMO CC1(C)C[C@@H](C[N@H+]2CCCC23CCN(c2cnc4ccccc4n2)CC3)CCO1 ZINC000072440209 535363029 /nfs/dbraw/zinc/36/30/29/535363029.db2.gz FSLDMZWBLLWAGP-IBGZPJMESA-N 1 1 394.563 4.270 50 0 GIAAMO COc1ccc(N2C(=O)c3ccccc3N(C)[C@@H]2c2[nH+]c(C)n3ccccc23)cc1 ZINC000057932397 536665186 /nfs/dbraw/zinc/66/51/86/536665186.db2.gz VZLRWLNGAPSOIE-QHCPKHFHSA-N 1 1 398.466 4.447 50 0 GIAAMO COc1ccc(C)cc1NC(=O)[C@@H](C)[N@H+](C)Cc1ccccc1N1CCCCC1 ZINC000012645203 536812090 /nfs/dbraw/zinc/81/20/90/536812090.db2.gz WICMEIZPQKOLNX-LJQANCHMSA-N 1 1 395.547 4.453 50 0 GIAAMO COc1ccc(C)cc1NC(=O)[C@@H](C)[N@@H+](C)Cc1ccccc1N1CCCCC1 ZINC000012645203 536812097 /nfs/dbraw/zinc/81/20/97/536812097.db2.gz WICMEIZPQKOLNX-LJQANCHMSA-N 1 1 395.547 4.453 50 0 GIAAMO COc1ccccc1C(=O)N1CC[NH+](C(c2ccccc2)c2ccccc2)CC1 ZINC000019720590 570211580 /nfs/dbraw/zinc/21/15/80/570211580.db2.gz SIAIIQUXNKAVGB-UHFFFAOYSA-N 1 1 386.495 4.243 50 0 GIAAMO CC(C)Cc1c[nH]nc1[C@H]1CCC[N@@H+](Cc2cnn(-c3ccc(F)cc3)c2)C1 ZINC000019794666 570219917 /nfs/dbraw/zinc/21/99/17/570219917.db2.gz IHZHJTAEUAZBHR-SFHVURJKSA-N 1 1 381.499 4.313 50 0 GIAAMO O=C(CC[N@@H+]1CCO[C@@H](c2ccc(Cl)cc2)C1)NCc1ccccc1Cl ZINC000048290511 570228938 /nfs/dbraw/zinc/22/89/38/570228938.db2.gz LEESMWKMVPDASX-LJQANCHMSA-N 1 1 393.314 4.073 50 0 GIAAMO O=C(CC[N@H+]1CCO[C@@H](c2ccc(Cl)cc2)C1)NCc1ccccc1Cl ZINC000048290511 570228941 /nfs/dbraw/zinc/22/89/41/570228941.db2.gz LEESMWKMVPDASX-LJQANCHMSA-N 1 1 393.314 4.073 50 0 GIAAMO Cc1cccc(NC(=O)CC[NH+]2CCN(Cc3cccc4ccccc43)CC2)c1 ZINC000019900010 570228992 /nfs/dbraw/zinc/22/89/92/570228992.db2.gz YJYIHKNDTGPAAU-UHFFFAOYSA-N 1 1 387.527 4.295 50 0 GIAAMO Cc1ccc(C[N@@H+](C)C[C@@H](O)CO[C@@H](c2ccccc2)c2ccccc2C)o1 ZINC000006082993 570238957 /nfs/dbraw/zinc/23/89/57/570238957.db2.gz ALFNPRBMXJTCFF-QPPBQGQZSA-N 1 1 379.500 4.495 50 0 GIAAMO O=C(C1CC[NH+](Cc2c(F)cccc2Cl)CC1)N1CCc2ccccc2C1 ZINC000020130711 570241613 /nfs/dbraw/zinc/24/16/13/570241613.db2.gz FOYJURQMHGTYHV-UHFFFAOYSA-N 1 1 386.898 4.276 50 0 GIAAMO CN(C)c1ncc(C[N@@H+]2CCC[C@@H](C(=O)c3ccc(C(F)(F)F)cc3)C2)s1 ZINC000020203663 570247354 /nfs/dbraw/zinc/24/73/54/570247354.db2.gz PYMAAASMILZCEM-CQSZACIVSA-N 1 1 397.466 4.323 50 0 GIAAMO CN(C)c1ncc(C[N@H+]2CCC[C@@H](C(=O)c3ccc(C(F)(F)F)cc3)C2)s1 ZINC000020203663 570247357 /nfs/dbraw/zinc/24/73/57/570247357.db2.gz PYMAAASMILZCEM-CQSZACIVSA-N 1 1 397.466 4.323 50 0 GIAAMO CCCn1ncc(CN(C)C[C@H]2CCC[N@@H+](CCc3ccc(F)cc3)C2)c1C ZINC000020203673 570247536 /nfs/dbraw/zinc/24/75/36/570247536.db2.gz OECUMCAFNRGZMB-OAQYLSRUSA-N 1 1 386.559 4.127 50 0 GIAAMO CC[NH+]1CCN(CCCCOc2c(Cl)cc(C)cc2Br)CC1 ZINC000020390232 570253953 /nfs/dbraw/zinc/25/39/53/570253953.db2.gz TURZDMNUWWBAEU-UHFFFAOYSA-N 1 1 389.765 4.207 50 0 GIAAMO COc1ccc(CNC(=O)C2CC[NH+](Cc3c(F)cccc3Cl)CC2)cc1 ZINC000001179409 570254924 /nfs/dbraw/zinc/25/49/24/570254924.db2.gz KBSKZUATSOGKOS-UHFFFAOYSA-N 1 1 390.886 4.016 50 0 GIAAMO FC(F)(F)c1cccc(OCCC[NH+]2CCN(Cc3ccccc3)CC2)c1 ZINC000020482075 570261915 /nfs/dbraw/zinc/26/19/15/570261915.db2.gz LMWWEPAWBSJXMQ-UHFFFAOYSA-N 1 1 378.438 4.292 50 0 GIAAMO Cc1ccc(NC(=O)C[NH+]2CCC(c3nc(-c4ccc(C)cc4)no3)CC2)cc1 ZINC000049403254 570264618 /nfs/dbraw/zinc/26/46/18/570264618.db2.gz MMJNAQRRQZVHOC-UHFFFAOYSA-N 1 1 390.487 4.172 50 0 GIAAMO OCC[C@H]1C[N@@H+](Cc2cccc(-c3ccco3)c2)CCN1Cc1ccsc1 ZINC000020534769 570265956 /nfs/dbraw/zinc/26/59/56/570265956.db2.gz RWTUMMZKIFWLHV-NRFANRHFSA-N 1 1 382.529 4.077 50 0 GIAAMO C[N@@H+](CCCNc1ncnc2onc(-c3ccc(F)cc3)c21)Cc1ccccc1 ZINC000020574440 570268901 /nfs/dbraw/zinc/26/89/01/570268901.db2.gz ONSNRHYFVCPQHS-UHFFFAOYSA-N 1 1 391.450 4.358 50 0 GIAAMO C[NH+]1CCN(CC[C@]2(c3cccc(C(F)(F)F)c3)CCOC(C)(C)C2)CC1 ZINC000020588831 570269201 /nfs/dbraw/zinc/26/92/01/570269201.db2.gz ITHWYVODEWLLHV-FQEVSTJZSA-N 1 1 384.486 4.170 50 0 GIAAMO COc1ccc2cc(-c3n[nH]cc3C[N@@H+](C)C[C@H](O)c3ccccc3)ccc2c1 ZINC000020780756 570280321 /nfs/dbraw/zinc/28/03/21/570280321.db2.gz INKIPIBMXVCCEI-QHCPKHFHSA-N 1 1 387.483 4.404 50 0 GIAAMO CCn1c(C[NH+]2CCCCC2)nc2cc(NC(=O)c3ccccc3OC)ccc21 ZINC000026121118 570281426 /nfs/dbraw/zinc/28/14/26/570281426.db2.gz LRVDLSMBRHXLHT-UHFFFAOYSA-N 1 1 392.503 4.303 50 0 GIAAMO CCCOc1c(Br)cc(CNC[C@@H]2CCC[N@@H+]2CC)cc1OCC ZINC000020968199 570285753 /nfs/dbraw/zinc/28/57/53/570285753.db2.gz CXPKESNPZNJJAE-INIZCTEOSA-N 1 1 399.373 4.211 50 0 GIAAMO CCCOc1c(Br)cc(CNC[C@@H]2CCC[N@H+]2CC)cc1OCC ZINC000020968199 570285754 /nfs/dbraw/zinc/28/57/54/570285754.db2.gz CXPKESNPZNJJAE-INIZCTEOSA-N 1 1 399.373 4.211 50 0 GIAAMO C[N@@H+](Cc1ccccc1)[C@H]1CCCN(Cc2c[nH]nc2-c2ccc(F)cc2)C1 ZINC000020998398 570286923 /nfs/dbraw/zinc/28/69/23/570286923.db2.gz YHKPBUWFQHVVFJ-QFIPXVFZSA-N 1 1 378.495 4.312 50 0 GIAAMO OC1(c2ccc(Br)cc2)CC[NH+](Cc2c(F)cccc2F)CC1 ZINC000002498204 570288490 /nfs/dbraw/zinc/28/84/90/570288490.db2.gz CBVJRZRUJNOPRV-UHFFFAOYSA-N 1 1 382.248 4.211 50 0 GIAAMO CNC(=O)[C@@H]1CC[N@@H+](Cc2cccc(Oc3cccc(C(F)(F)F)c3)c2)C1 ZINC000215418430 570288701 /nfs/dbraw/zinc/28/87/01/570288701.db2.gz JTPJTZNARPFZIF-OAHLLOKOSA-N 1 1 378.394 4.066 50 0 GIAAMO Cc1ccc([C@@H](C)NC(=O)C[N@@H+]2CCC[C@@H]2c2ccc3c(c2)OCCO3)cc1C ZINC000012902069 570288901 /nfs/dbraw/zinc/28/89/01/570288901.db2.gz FBIFVVKCXXEIGT-WIYYLYMNSA-N 1 1 394.515 4.089 50 0 GIAAMO Cc1ccc([C@@H](C)NC(=O)C[N@H+]2CCC[C@@H]2c2ccc3c(c2)OCCO3)cc1C ZINC000012902069 570288903 /nfs/dbraw/zinc/28/89/03/570288903.db2.gz FBIFVVKCXXEIGT-WIYYLYMNSA-N 1 1 394.515 4.089 50 0 GIAAMO CC(C)[C@@H]([NH2+][C@@H](C(=O)N1CCCC1)c1ccccc1)c1ccc2c(c1)OCCO2 ZINC000012913273 570292367 /nfs/dbraw/zinc/29/23/67/570292367.db2.gz FLIYCJZBJXVOGC-DHIUTWEWSA-N 1 1 394.515 4.108 50 0 GIAAMO Cc1ccccc1C[NH+]1CCN(C(=O)c2csc(-c3ccccc3)n2)CC1 ZINC000012921506 570294395 /nfs/dbraw/zinc/29/43/95/570294395.db2.gz AKHYMMXZKLVMDD-UHFFFAOYSA-N 1 1 377.513 4.077 50 0 GIAAMO Cc1cccc2c1cc(C(=O)NCC[N@H+]1CCC[C@@H](c3ccccc3)C1)n2C ZINC000216066978 570295536 /nfs/dbraw/zinc/29/55/36/570295536.db2.gz XCTOGMGHWQIHSQ-HXUWFJFHSA-N 1 1 375.516 4.096 50 0 GIAAMO CN(C)CC[NH2+][C@H](C(=O)Nc1ccc(Cl)cc1C(F)(F)F)c1ccccc1 ZINC000022039581 570303123 /nfs/dbraw/zinc/30/31/23/570303123.db2.gz ZMCCXUOTSABWOS-KRWDZBQOSA-N 1 1 399.844 4.190 50 0 GIAAMO Cc1noc2nc(C)cc(C(=O)Nc3nc(C[N@H+]4C[C@H](C)C[C@H](C)C4)cs3)c12 ZINC000022296673 570312728 /nfs/dbraw/zinc/31/27/28/570312728.db2.gz NDNRNEMWJGEAPW-TXEJJXNPSA-N 1 1 399.520 4.026 50 0 GIAAMO Cc1noc2nc(C)cc(C(=O)Nc3nc(C[N@@H+]4C[C@H](C)C[C@H](C)C4)cs3)c12 ZINC000022296673 570312730 /nfs/dbraw/zinc/31/27/30/570312730.db2.gz NDNRNEMWJGEAPW-TXEJJXNPSA-N 1 1 399.520 4.026 50 0 GIAAMO CCOc1ccc(C(=O)c2c[nH+]c3ccc(C)cc3c2N2CCOCC2)cc1 ZINC000035310523 570323804 /nfs/dbraw/zinc/32/38/04/570323804.db2.gz ZCRWRVNHRMHTEI-UHFFFAOYSA-N 1 1 376.456 4.010 50 0 GIAAMO CC[N@@H+]1CCc2nc(NC(=O)CCSc3ccc(Cl)cc3)sc2C1 ZINC000023080744 570343363 /nfs/dbraw/zinc/34/33/63/570343363.db2.gz KCMCRKMAYYCXNQ-UHFFFAOYSA-N 1 1 381.954 4.295 50 0 GIAAMO CC[N@H+]1CCc2nc(NC(=O)CCSc3ccc(Cl)cc3)sc2C1 ZINC000023080744 570343366 /nfs/dbraw/zinc/34/33/66/570343366.db2.gz KCMCRKMAYYCXNQ-UHFFFAOYSA-N 1 1 381.954 4.295 50 0 GIAAMO COc1cc2c(cc1OC)[C@@H](c1cccs1)[N@@H+](C[C@H](O)c1ccccc1)CC2 ZINC000035399961 570350526 /nfs/dbraw/zinc/35/05/26/570350526.db2.gz FJFFCYJYGDSGJR-CVDCTZTESA-N 1 1 395.524 4.446 50 0 GIAAMO O=C(NCC1(c2cccc(F)c2)CCCC1)[C@@H]1CCC[N@@H+](Cc2ccco2)C1 ZINC000219291851 570351713 /nfs/dbraw/zinc/35/17/13/570351713.db2.gz GUMNIGMCEVRWKX-GOSISDBHSA-N 1 1 384.495 4.259 50 0 GIAAMO CC(C)C[NH+](CC(C)C)Cn1nc([C@@H]2COc3ccccc3O2)n(C)c1=S ZINC000023381296 570359320 /nfs/dbraw/zinc/35/93/20/570359320.db2.gz XJYAPKLVSUEVOB-SFHVURJKSA-N 1 1 390.553 4.035 50 0 GIAAMO O=C(c1cc(-c2ccco2)nc2ccccc21)N1CC[NH+](Cc2ccccc2)CC1 ZINC000023408466 570361283 /nfs/dbraw/zinc/36/12/83/570361283.db2.gz JAYJQWZYHQLKBW-UHFFFAOYSA-N 1 1 397.478 4.453 50 0 GIAAMO COc1cccc(C[N@@H+](C)C2CCN(c3cccc(-c4cc[nH]n4)c3)CC2)c1 ZINC000023478239 570363131 /nfs/dbraw/zinc/36/31/31/570363131.db2.gz FSARRHFXKUDUNO-UHFFFAOYSA-N 1 1 376.504 4.186 50 0 GIAAMO CCN(CC)c1ccc(NC(=O)c2c(F)cccc2F)c(N(CC)CC)[nH+]1 ZINC000004390502 570373179 /nfs/dbraw/zinc/37/31/79/570373179.db2.gz YOIOHUCAVRMHCP-UHFFFAOYSA-N 1 1 376.451 4.305 50 0 GIAAMO C[N@H+](Cc1ccccc1F)Cc1cc(=O)oc2cc(Br)ccc12 ZINC000023819166 570373225 /nfs/dbraw/zinc/37/32/25/570373225.db2.gz UCUMFLHPNUENIX-UHFFFAOYSA-N 1 1 376.225 4.327 50 0 GIAAMO C[N@@H+](Cc1ccccc1F)Cc1cc(=O)oc2cc(Br)ccc12 ZINC000023819166 570373228 /nfs/dbraw/zinc/37/32/28/570373228.db2.gz UCUMFLHPNUENIX-UHFFFAOYSA-N 1 1 376.225 4.327 50 0 GIAAMO COc1ccccc1[C@H](CNC(=O)c1ccc2[nH]c3c(c2c1)CCCC3)[NH+](C)C ZINC000023979267 570376317 /nfs/dbraw/zinc/37/63/17/570376317.db2.gz NDLSLSNNPFIUSC-QFIPXVFZSA-N 1 1 391.515 4.088 50 0 GIAAMO CCCCc1nn2c(nc(C[N@@H+](CCC)Cc3ccc(C)cc3)cc2=O)s1 ZINC000035509800 570382291 /nfs/dbraw/zinc/38/22/91/570382291.db2.gz GFAJKWATXSUVGU-UHFFFAOYSA-N 1 1 384.549 4.214 50 0 GIAAMO Cc1ccc(CNC(=O)C[NH+]2CCC(c3nc4ccccc4s3)CC2)cc1 ZINC000004966568 570384144 /nfs/dbraw/zinc/38/41/44/570384144.db2.gz ZFOWKBXCXVJHIK-UHFFFAOYSA-N 1 1 379.529 4.101 50 0 GIAAMO COc1ccc(NC(=O)[C@@H](C)[N@H+]2CC=C(c3c[nH]c4ccccc43)CC2)cc1 ZINC000024716386 570390382 /nfs/dbraw/zinc/39/03/82/570390382.db2.gz SFDKZQFVLOBTQO-MRXNPFEDSA-N 1 1 375.472 4.293 50 0 GIAAMO COc1ccc(NC(=O)[C@@H](C)[N@@H+]2CC=C(c3c[nH]c4ccccc43)CC2)cc1 ZINC000024716386 570390384 /nfs/dbraw/zinc/39/03/84/570390384.db2.gz SFDKZQFVLOBTQO-MRXNPFEDSA-N 1 1 375.472 4.293 50 0 GIAAMO CCOC(=O)[C@@H]1CCC[N@@H+](Cc2ccc(OCc3ccccc3)c(OC)c2)C1 ZINC000004689617 570393517 /nfs/dbraw/zinc/39/35/17/570393517.db2.gz WUBLGOGMJUFGTM-HXUWFJFHSA-N 1 1 383.488 4.049 50 0 GIAAMO CN(Cc1ccsc1)C(=O)C[N@@H+]1CCc2sccc2[C@@H]1c1ccccc1 ZINC000024945684 570399415 /nfs/dbraw/zinc/39/94/15/570399415.db2.gz MCNGAOAEBRRTCE-NRFANRHFSA-N 1 1 382.554 4.416 50 0 GIAAMO CN(Cc1ccsc1)C(=O)C[N@H+]1CCc2sccc2[C@@H]1c1ccccc1 ZINC000024945684 570399417 /nfs/dbraw/zinc/39/94/17/570399417.db2.gz MCNGAOAEBRRTCE-NRFANRHFSA-N 1 1 382.554 4.416 50 0 GIAAMO CC(C)(CNC(=O)c1ccccc1Br)[N@H+]1CCc2ccccc2C1 ZINC000025460702 570414370 /nfs/dbraw/zinc/41/43/70/570414370.db2.gz BEBBSJLAERDMFJ-UHFFFAOYSA-N 1 1 387.321 4.016 50 0 GIAAMO C[C@H](C(=O)NC(c1ccccc1)c1ccccc1)[N@H+]1CCC[C@H]1c1cccn1C ZINC000239284700 570428837 /nfs/dbraw/zinc/42/88/37/570428837.db2.gz BXJKCGCJXLNCFG-XXBNENTESA-N 1 1 387.527 4.456 50 0 GIAAMO C[N@@H+](CCC(=O)Nc1cc(Cl)ccc1Cl)C[C@@H]1COc2ccccc2O1 ZINC000026922360 570430020 /nfs/dbraw/zinc/43/00/20/570430020.db2.gz TZBZWVDSFKYYRC-CQSZACIVSA-N 1 1 395.286 4.094 50 0 GIAAMO CC(C)c1ccccc1OC[C@H](O)C[N@H+]1CCC[C@H]1c1ccc2c(c1)OCCO2 ZINC000241965556 570431778 /nfs/dbraw/zinc/43/17/78/570431778.db2.gz UTUASHKNRICHSN-CTNGQTDRSA-N 1 1 397.515 4.158 50 0 GIAAMO C[N@H+](CCC(=O)Nc1ccnn1C1CCCC1)Cc1nc2ccccc2s1 ZINC000028888769 570465743 /nfs/dbraw/zinc/46/57/43/570465743.db2.gz VWXWSNVUYNPQJF-UHFFFAOYSA-N 1 1 383.521 4.069 50 0 GIAAMO C[N@@H+](CCC(=O)Nc1ccnn1C1CCCC1)Cc1nc2ccccc2s1 ZINC000028888769 570465746 /nfs/dbraw/zinc/46/57/46/570465746.db2.gz VWXWSNVUYNPQJF-UHFFFAOYSA-N 1 1 383.521 4.069 50 0 GIAAMO C[N@H+](CC(=O)Nc1ccccc1C(=O)NC1CCCC1)Cc1ccc(Cl)cc1 ZINC000006580879 570483061 /nfs/dbraw/zinc/48/30/61/570483061.db2.gz CHGJWDYBVPQLJR-UHFFFAOYSA-N 1 1 399.922 4.083 50 0 GIAAMO C[N@@H+](CC(=O)Nc1ccccc1C(=O)NC1CCCC1)Cc1ccc(Cl)cc1 ZINC000006580879 570483064 /nfs/dbraw/zinc/48/30/64/570483064.db2.gz CHGJWDYBVPQLJR-UHFFFAOYSA-N 1 1 399.922 4.083 50 0 GIAAMO O=C(C[NH+]1CCCCC1)N1N=C2c3ccccc3CC[C@@H]2[C@@H]1c1cccs1 ZINC000006829788 570496203 /nfs/dbraw/zinc/49/62/03/570496203.db2.gz QGFZWIJGDSWWST-PGRDOPGGSA-N 1 1 379.529 4.084 50 0 GIAAMO O=C(NCc1ccccc1)N1CC[NH+](C(c2ccccc2)c2ccccc2)CC1 ZINC000022668656 570500933 /nfs/dbraw/zinc/50/09/33/570500933.db2.gz MJNFFUNSASCVDH-UHFFFAOYSA-N 1 1 385.511 4.303 50 0 GIAAMO O=C(c1ccccc1F)N(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)CC(F)(F)F ZINC000072304632 570515444 /nfs/dbraw/zinc/51/54/44/570515444.db2.gz FNXUXNWKVHFTRC-QGZVFWFLSA-N 1 1 394.412 4.352 50 0 GIAAMO O[C@@H](Cc1ccccc1)C[N@H+](Cc1ccc2c(c1)OCO2)Cc1ccccc1F ZINC000036103149 570540029 /nfs/dbraw/zinc/54/00/29/570540029.db2.gz ZPMZHZFXVDLKRC-NRFANRHFSA-N 1 1 393.458 4.160 50 0 GIAAMO O[C@@H](Cc1ccccc1)C[N@@H+](Cc1ccc2c(c1)OCO2)Cc1ccccc1F ZINC000036103149 570540035 /nfs/dbraw/zinc/54/00/35/570540035.db2.gz ZPMZHZFXVDLKRC-NRFANRHFSA-N 1 1 393.458 4.160 50 0 GIAAMO COc1ccc(OC[C@H](O)C[N@@H+](Cc2cccs2)Cc2ccccc2)cc1 ZINC000036103329 570540263 /nfs/dbraw/zinc/54/02/63/570540263.db2.gz SIWDHDQMIIEUDM-LJQANCHMSA-N 1 1 383.513 4.199 50 0 GIAAMO Cc1ccc(C)c(C[N@H+](Cc2ccc3c(c2)OCO3)C[C@@H](O)COCC(C)C)c1 ZINC000036103926 570540674 /nfs/dbraw/zinc/54/06/74/570540674.db2.gz WWKKHIVRGNJVLK-JOCHJYFZSA-N 1 1 399.531 4.068 50 0 GIAAMO COc1ccc(OC[C@H](O)C[N@@H+](Cc2ccccc2)Cc2ccccc2C)cc1 ZINC000036104436 570541589 /nfs/dbraw/zinc/54/15/89/570541589.db2.gz GGHBBHSFQHSMHJ-HSZRJFAPSA-N 1 1 391.511 4.446 50 0 GIAAMO Cc1ccccc1C[NH+]1CCN([C@@H](C)c2nnc(-c3ccc(F)cc3)o2)CC1 ZINC000022791049 570547882 /nfs/dbraw/zinc/54/78/82/570547882.db2.gz NDIGWTIUSOPJTD-KRWDZBQOSA-N 1 1 380.467 4.063 50 0 GIAAMO CCn1cc(C[N@H+]2CCC[C@@H](C(=O)c3ccc4cc(OC)ccc4c3)C2)c(C)n1 ZINC000012056797 570602654 /nfs/dbraw/zinc/60/26/54/570602654.db2.gz HCVFALUDAUIMPA-OAQYLSRUSA-N 1 1 391.515 4.468 50 0 GIAAMO COc1ccccc1CN1C[C@@H]2C[C@@H](c3ccccc3Cl)[N@H+]3CCC[C@@]23C1=O ZINC000012091567 570607784 /nfs/dbraw/zinc/60/77/84/570607784.db2.gz HIQNDQKBLITKHM-NYDSKATKSA-N 1 1 396.918 4.287 50 0 GIAAMO Cc1ccc([C@@H]2Oc3ccccc3C3=C2[C@H](c2cccnc2)N2NC=NC2=[NH+]3)cc1 ZINC000005516254 570623825 /nfs/dbraw/zinc/62/38/25/570623825.db2.gz VEMSTSLRXQWXAU-GOTSBHOMSA-N 1 1 393.450 4.194 50 0 GIAAMO COc1ccccc1[C@@H]1CC(c2cc(C)ccc2C)=NN1C(=O)C[N@@H+](C)C(C)C ZINC000036345367 570627426 /nfs/dbraw/zinc/62/74/26/570627426.db2.gz UYDUZYRJZVDBKW-QFIPXVFZSA-N 1 1 393.531 4.330 50 0 GIAAMO COc1ccc([C@H]2CC(c3cc(C)ccc3C)=NN2C(=O)C[N@@H+](C)C(C)C)cc1 ZINC000036345148 570627529 /nfs/dbraw/zinc/62/75/29/570627529.db2.gz JTDMPCAZHYDMLX-HSZRJFAPSA-N 1 1 393.531 4.330 50 0 GIAAMO Cc1nn(-c2ccccc2)c(Oc2ccccc2F)c1C[N@@H+](C[C@@H](C)O)C1CC1 ZINC000036346031 570628000 /nfs/dbraw/zinc/62/80/00/570628000.db2.gz LYPWQSAUEFXGMB-MRXNPFEDSA-N 1 1 395.478 4.457 50 0 GIAAMO Cc1nn(-c2ccccc2)c(Oc2ccccc2F)c1C[N@H+](C[C@@H](C)O)C1CC1 ZINC000036346031 570628004 /nfs/dbraw/zinc/62/80/04/570628004.db2.gz LYPWQSAUEFXGMB-MRXNPFEDSA-N 1 1 395.478 4.457 50 0 GIAAMO CC[N@H+]1CCc2cc(OC)c(OC)cc2[C@H]1[C@H](NC(=O)c1ccccc1)C(C)C ZINC000006870780 570664214 /nfs/dbraw/zinc/66/42/14/570664214.db2.gz SDEDZPKGPMPZOG-PKTZIBPZSA-N 1 1 396.531 4.078 50 0 GIAAMO O=C(c1cccc(C(F)(F)F)c1)[C@@H]1CCC[N@@H+](Cc2cccc3nonc32)C1 ZINC000055054747 570680536 /nfs/dbraw/zinc/68/05/36/570680536.db2.gz ICHGLWRIHILTNB-OAHLLOKOSA-N 1 1 389.377 4.337 50 0 GIAAMO CC(C)C[C@H](CNC(=S)Nc1ccc(Cl)cc1Cl)[NH+]1CCOCC1 ZINC000058053893 570708441 /nfs/dbraw/zinc/70/84/41/570708441.db2.gz CAMYNEBSYPQXHS-CQSZACIVSA-N 1 1 390.380 4.027 50 0 GIAAMO Cc1ccc(C)c(NC(=O)[C@@H]2CCC[N@H+](Cc3nc4ccccc4n3C)C2)c1 ZINC000247720469 570715531 /nfs/dbraw/zinc/71/55/31/570715531.db2.gz ABMIQOSLPJOBGB-GOSISDBHSA-N 1 1 376.504 4.041 50 0 GIAAMO CCCN(C(=O)[C@@H]1CCC[N@@H+](Cc2nc3ccccc3n2C(C)C)C1)C(C)C ZINC000247963277 570717787 /nfs/dbraw/zinc/71/77/87/570717787.db2.gz ALYLIGSAMHRUAB-LJQANCHMSA-N 1 1 384.568 4.476 50 0 GIAAMO CCn1c(C[N@@H+]2CCC[C@@H](C(=O)Nc3ccc(F)cc3F)C2)nc2ccccc21 ZINC000249697887 570722774 /nfs/dbraw/zinc/72/27/74/570722774.db2.gz VFITVFRSGJZPAQ-OAHLLOKOSA-N 1 1 398.457 4.185 50 0 GIAAMO CCn1c(C[N@H+]2CCC[C@@H](C(=O)Nc3ccc(F)cc3F)C2)nc2ccccc21 ZINC000249697887 570722776 /nfs/dbraw/zinc/72/27/76/570722776.db2.gz VFITVFRSGJZPAQ-OAHLLOKOSA-N 1 1 398.457 4.185 50 0 GIAAMO COc1ccc(C)cc1NC(=O)CC[N@H+]1CCCC[C@@H]1CCc1ccccn1 ZINC000252478830 570727870 /nfs/dbraw/zinc/72/78/70/570727870.db2.gz AVPWJGGNAPXBLE-HXUWFJFHSA-N 1 1 381.520 4.215 50 0 GIAAMO Cc1nc(-c2ccccc2F)sc1C(=O)NC[C@H]1CCC[N@H+]2CCCC[C@H]12 ZINC000036569572 570741080 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CC[C@@H](C)[C@@H]([NH3+])C(=O)Oc1ccc2c(c1)oc(C)c(-c1cccc(F)c1)c2=O ZINC000020111201 818614068 /nfs/dbraw/zinc/61/40/68/818614068.db2.gz BUQUFFQFNJQQKO-MPBGBICISA-N 1 1 383.419 4.186 50 0 GIAAMO C[N@H+]1CCN(c2nncc(-c3ccc(C(F)(F)F)cc3)n2)C[C@@H]1c1ccccc1 ZINC000020202301 818616889 /nfs/dbraw/zinc/61/68/89/818616889.db2.gz YHQIUXVBMWRRTA-LJQANCHMSA-N 1 1 399.420 4.051 50 0 GIAAMO Cc1ccc(/C=C/C(=O)NCCN2CCC([N@H+](C)[C@@H]3CCCC[C@H]3C)CC2)cc1 ZINC000020241342 818617800 /nfs/dbraw/zinc/61/78/00/818617800.db2.gz LUHSUUOGVHQADD-AHUNDJPPSA-N 1 1 397.607 4.099 50 0 GIAAMO Clc1ccc(-c2csc3ncnc(NCCC[NH+]4CCOCC4)c23)cc1 ZINC000020449446 818622339 /nfs/dbraw/zinc/62/23/39/818622339.db2.gz MSOOMWSIEFQKGO-UHFFFAOYSA-N 1 1 388.924 4.146 50 0 GIAAMO COCc1ccc(C[N@H+]2CCC[C@@H](c3n[nH]cc3-c3c(F)cccc3F)C2)o1 ZINC000020600408 818626497 /nfs/dbraw/zinc/62/64/97/818626497.db2.gz AZCRLTMVILMBTJ-CQSZACIVSA-N 1 1 387.430 4.474 50 0 GIAAMO COc1cccc([C@@H]2CCCC[N@H+]2Cc2cccc(-c3nc(C)cc(=O)[nH]3)c2)c1 ZINC000020783095 818631280 /nfs/dbraw/zinc/63/12/80/818631280.db2.gz MFQUSWGHXWNWKP-QFIPXVFZSA-N 1 1 389.499 4.481 50 0 GIAAMO Cc1cccc(NC(=O)NCc2c3c(sc2-n2cccc2)C[N@@H+](C)CC3)c1 ZINC000020927264 818640852 /nfs/dbraw/zinc/64/08/52/818640852.db2.gz RURDTDWRCGJLKL-UHFFFAOYSA-N 1 1 380.517 4.157 50 0 GIAAMO O=C(NC[C@@H](c1ccsc1)[N@@H+]1CCc2ccccc2C1)c1ccc(F)cc1 ZINC000020951138 818642459 /nfs/dbraw/zinc/64/24/59/818642459.db2.gz RVPDCIALRBZELH-NRFANRHFSA-N 1 1 380.488 4.417 50 0 GIAAMO O=C(NC[C@@H](c1ccsc1)[N@H+]1CCc2ccccc2C1)c1ccc(F)cc1 ZINC000020951138 818642463 /nfs/dbraw/zinc/64/24/63/818642463.db2.gz RVPDCIALRBZELH-NRFANRHFSA-N 1 1 380.488 4.417 50 0 GIAAMO COc1ccc(CC[N@@H+](C)[C@H]2CCCN(Cc3cc(C)c(C)o3)C2)cc1OC ZINC000023360362 818927715 /nfs/dbraw/zinc/92/77/15/818927715.db2.gz PVXPXRFIALVYPX-FQEVSTJZSA-N 1 1 386.536 4.053 50 0 GIAAMO C[C@@H](c1ccco1)[N@@H+](C)Cc1cccc(-c2nc(-c3ccco3)cc(=O)[nH]2)c1 ZINC000023478734 818944483 /nfs/dbraw/zinc/94/44/83/818944483.db2.gz 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CC(=O)Nc1ccc(CN(C)[C@@H]2CCC[N@@H+](CCCc3ccccc3)C2)cc1 ZINC000023358604 570356437 /nfs/dbraw/zinc/35/64/37/570356437.db2.gz BUPXWBVCKHKOSL-XMMPIXPASA-N 1 1 379.548 4.174 50 0 GIAAMO CC(=O)Nc1ccc(C[N@@H+](C)[C@@H]2CCCN(CCCc3ccccc3)C2)cc1 ZINC000023358604 570356438 /nfs/dbraw/zinc/35/64/38/570356438.db2.gz BUPXWBVCKHKOSL-XMMPIXPASA-N 1 1 379.548 4.174 50 0 GIAAMO CC(=O)Nc1ccc(C[N@H+](C)[C@@H]2CCCN(CCCc3ccccc3)C2)cc1 ZINC000023358604 570356439 /nfs/dbraw/zinc/35/64/39/570356439.db2.gz BUPXWBVCKHKOSL-XMMPIXPASA-N 1 1 379.548 4.174 50 0 GIAAMO COc1ccc(NC(=O)N2CCCC3=C[C@H]4C[C@H](C[N@H+]5CCCC[C@@H]45)[C@@H]32)cc1 ZINC000390826650 570356896 /nfs/dbraw/zinc/35/68/96/570356896.db2.gz OFDGNZYVSUEVPS-GKJHBJHPSA-N 1 1 381.520 4.122 50 0 GIAAMO CC(C)(C)CC[N@H+]1CCC[C@H]1c1ccc(C(=O)NCCc2cnccn2)s1 ZINC000023543299 570365212 /nfs/dbraw/zinc/36/52/12/570365212.db2.gz MRENFUUHNFINJO-KRWDZBQOSA-N 1 1 386.565 4.084 50 0 GIAAMO C1=NC2=[NH+]C3=C([C@@H](c4ccccc4)N2N1)[C@H](c1ccccc1)Oc1ccccc13 ZINC000004338300 570369455 /nfs/dbraw/zinc/36/94/55/570369455.db2.gz FLYUEDWASNXGQC-PKTZIBPZSA-N 1 1 378.435 4.491 50 0 GIAAMO CC[N@H+]1CCc2c(sc3c2C(=O)N[C@@H](c2cccc(Br)c2)N3)C1 ZINC000006349168 570395539 /nfs/dbraw/zinc/39/55/39/570395539.db2.gz KIFDWMQURDDGGH-OAHLLOKOSA-N 1 1 392.322 4.318 50 0 GIAAMO Cc1cccc(-c2nnc([C@H](C)[NH+]3CCC(C(=O)Nc4ccccc4)CC3)o2)c1 ZINC000024856355 570396287 /nfs/dbraw/zinc/39/62/87/570396287.db2.gz XKBZSFLOURXELL-KRWDZBQOSA-N 1 1 390.487 4.457 50 0 GIAAMO O=C([C@@H]1CCC[N@H+](Cc2cccc(Br)c2)C1)N1CCCCCC1 ZINC000004744873 570401792 /nfs/dbraw/zinc/40/17/92/570401792.db2.gz BAKKADZPEIAHBZ-QGZVFWFLSA-N 1 1 379.342 4.064 50 0 GIAAMO CC(=O)c1c(C)[nH]c(C(=O)Nc2nc(C[N@H+]3C[C@H](C)C[C@H](C)C3)cs2)c1C ZINC000025057996 570404795 /nfs/dbraw/zinc/40/47/95/570404795.db2.gz NXIWSNVYNZZNJA-TXEJJXNPSA-N 1 1 388.537 4.021 50 0 GIAAMO CC(=O)c1c(C)[nH]c(C(=O)Nc2nc(C[N@@H+]3C[C@H](C)C[C@H](C)C3)cs2)c1C ZINC000025057996 570404797 /nfs/dbraw/zinc/40/47/97/570404797.db2.gz 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C[N@@H+](CCC(=O)Nc1cc(Cl)ccc1Cl)C[C@H]1COc2ccccc2O1 ZINC000026922363 570429830 /nfs/dbraw/zinc/42/98/30/570429830.db2.gz TZBZWVDSFKYYRC-AWEZNQCLSA-N 1 1 395.286 4.094 50 0 GIAAMO Cc1ccccc1OCC(=O)NC[C@@H](c1ccccc1Cl)[NH+]1CCCCC1 ZINC000027664250 570439263 /nfs/dbraw/zinc/43/92/63/570439263.db2.gz UVALXUQUQZCNHK-FQEVSTJZSA-N 1 1 386.923 4.371 50 0 GIAAMO Cc1ccccc1C[N@H+](C)CC(=O)Nc1ccccc1C(=O)Nc1ccccc1 ZINC000006552018 570474814 /nfs/dbraw/zinc/47/48/14/570474814.db2.gz IBUGIAXTJOBSBS-UHFFFAOYSA-N 1 1 387.483 4.318 50 0 GIAAMO Cc1ccccc1C[N@@H+](C)CC(=O)Nc1ccccc1C(=O)Nc1ccccc1 ZINC000006552018 570474815 /nfs/dbraw/zinc/47/48/15/570474815.db2.gz IBUGIAXTJOBSBS-UHFFFAOYSA-N 1 1 387.483 4.318 50 0 GIAAMO COc1ccc(CC2CC[NH+](Cc3nnc(-c4cc(C)oc4C)o3)CC2)cc1 ZINC000089582224 570494596 /nfs/dbraw/zinc/49/45/96/570494596.db2.gz BBHFAWIZMWCJTI-UHFFFAOYSA-N 1 1 381.476 4.410 50 0 GIAAMO Cc1nc(-c2ccc(F)cc2)sc1C(=O)NC[C@@H]1CCC[N@H+]2CCCC[C@@H]12 ZINC000043746958 570503558 /nfs/dbraw/zinc/50/35/58/570503558.db2.gz MSFYWHVMDIVJMY-WMZOPIPTSA-N 1 1 387.524 4.252 50 0 GIAAMO COC(=O)[C@H]([NH3+])CSC(c1ccccc1)(c1ccccc1)c1ccccc1 ZINC000031959878 570507600 /nfs/dbraw/zinc/50/76/00/570507600.db2.gz DXUZZMIANHJYIU-OAQYLSRUSA-N 1 1 377.509 4.212 50 0 GIAAMO Cc1noc(C(F)(F)F)c1C(=O)Nc1ccc(C[N@@H+]2CCC[C@H](C)C2)cc1 ZINC000072307023 570524731 /nfs/dbraw/zinc/52/47/31/570524731.db2.gz COASFCGNTUPJEE-LBPRGKRZSA-N 1 1 381.398 4.486 50 0 GIAAMO O[C@@H](Cc1ccccc1)C[N@@H+](Cc1ccccc1)Cc1ccc2c(c1)OCO2 ZINC000036103553 570540127 /nfs/dbraw/zinc/54/01/27/570540127.db2.gz JGEVATDRWVHDKM-QFIPXVFZSA-N 1 1 375.468 4.021 50 0 GIAAMO O[C@H](COCc1ccco1)C[N@H+](Cc1ccccc1)Cc1ccc(F)cc1F ZINC000036104086 570540895 /nfs/dbraw/zinc/54/08/95/570540895.db2.gz MMGYTZXQNAJWRG-FQEVSTJZSA-N 1 1 387.426 4.138 50 0 GIAAMO O[C@H](COCc1ccco1)C[N@@H+](Cc1ccccc1)Cc1ccc(F)cc1F ZINC000036104086 570540898 /nfs/dbraw/zinc/54/08/98/570540898.db2.gz MMGYTZXQNAJWRG-FQEVSTJZSA-N 1 1 387.426 4.138 50 0 GIAAMO O=C(NC[C@H](c1cccs1)[N@@H+]1CCc2ccccc2C1)c1ccccc1F ZINC000022907744 570564325 /nfs/dbraw/zinc/56/43/25/570564325.db2.gz RQVZROCCDDLBOL-HXUWFJFHSA-N 1 1 380.488 4.417 50 0 GIAAMO O=C(NC[C@H](c1cccs1)[N@H+]1CCc2ccccc2C1)c1ccccc1F ZINC000022907744 570564328 /nfs/dbraw/zinc/56/43/28/570564328.db2.gz RQVZROCCDDLBOL-HXUWFJFHSA-N 1 1 380.488 4.417 50 0 GIAAMO CCOc1cc(CNCC[NH+](C)C)ccc1OCc1c(F)cccc1Cl ZINC000040720246 570604590 /nfs/dbraw/zinc/60/45/90/570604590.db2.gz SJMKFQHXJHIHQS-UHFFFAOYSA-N 1 1 380.891 4.108 50 0 GIAAMO CNC(=O)[C@H]1CCC[N@H+]1Cc1ccc(-c2nc3cccc(Cl)c3s2)cc1 ZINC000072313900 570652590 /nfs/dbraw/zinc/65/25/90/570652590.db2.gz VBBDDTIBBYHHIB-QGZVFWFLSA-N 1 1 385.920 4.327 50 0 GIAAMO C[C@@H]1CN(C[C@H]2CCC[N@H+]2CCCSc2ccccc2Cl)C[C@H](C)O1 ZINC000229338197 570663999 /nfs/dbraw/zinc/66/39/99/570663999.db2.gz CUWCYLZBUJHGLP-FGTMMUONSA-N 1 1 383.001 4.396 50 0 GIAAMO CC[N@H+]1CCC[C@H]1CNC(=S)N[C@@H](c1cccs1)c1ccc2c(c1)CCC2 ZINC000229583253 570665765 /nfs/dbraw/zinc/66/57/65/570665765.db2.gz WRTUEGUHJIBRCH-PZJWPPBQSA-N 1 1 399.629 4.275 50 0 GIAAMO C[C@@H]1C[N@@H+](C[C@@H](O)COc2ccc(C(C)(C)C)cc2C(C)(C)C)C[C@H](C)O1 ZINC000012421487 570672763 /nfs/dbraw/zinc/67/27/63/570672763.db2.gz PIGXXTGSOQVEQT-ZIFCJYIRSA-N 1 1 377.569 4.131 50 0 GIAAMO C[C@@H]1C[N@H+](C[C@@H](O)COc2ccc(C(C)(C)C)cc2C(C)(C)C)C[C@H](C)O1 ZINC000012421487 570672767 /nfs/dbraw/zinc/67/27/67/570672767.db2.gz PIGXXTGSOQVEQT-ZIFCJYIRSA-N 1 1 377.569 4.131 50 0 GIAAMO C[C@H]1CCCC[N@H+]1Cc1ccccc1CNC(=O)CCc1nc2ccccc2[nH]1 ZINC000036394398 570679123 /nfs/dbraw/zinc/67/91/23/570679123.db2.gz KCJFDLJMVNKCQM-SFHVURJKSA-N 1 1 390.531 4.186 50 0 GIAAMO CC(=O)c1cc(CCC(=O)NCc2ccc(C[N@@H+]3CCCC[C@H]3C)cc2)oc1C ZINC000036397837 570682656 /nfs/dbraw/zinc/68/26/56/570682656.db2.gz BXNRJBDEXZNHQB-QGZVFWFLSA-N 1 1 396.531 4.414 50 0 GIAAMO C[C@@H]1CCCC[N@H+]1Cc1ccc(CNC(=O)CCOc2ccccc2F)cc1 ZINC000057984828 570704986 /nfs/dbraw/zinc/70/49/86/570704986.db2.gz GORIYPUTDOQKGU-GOSISDBHSA-N 1 1 384.495 4.285 50 0 GIAAMO C[C@H](c1nc2ccccc2c(=O)[nH]1)[N@@H+]1CCC[C@H](c2nc3ccccc3s2)C1 ZINC000036442665 570712020 /nfs/dbraw/zinc/71/20/20/570712020.db2.gz IGNNDXVFSRUCQJ-CABCVRRESA-N 1 1 390.512 4.473 50 0 GIAAMO C[C@H](c1nc2ccccc2c(=O)[nH]1)[N@H+]1CCC[C@H](c2nc3ccccc3s2)C1 ZINC000036442665 570712023 /nfs/dbraw/zinc/71/20/23/570712023.db2.gz IGNNDXVFSRUCQJ-CABCVRRESA-N 1 1 390.512 4.473 50 0 GIAAMO CCn1c(C[NH+]2CCC(C(=O)Nc3ccc(C)cc3)CC2)nc2ccccc21 ZINC000247985491 570718977 /nfs/dbraw/zinc/71/89/77/570718977.db2.gz JESXJBQZDBPZNV-UHFFFAOYSA-N 1 1 376.504 4.215 50 0 GIAAMO CCc1cccc(NC(=O)C2CC[NH+](Cc3nc4ccccc4n3CC)CC2)c1 ZINC000249692491 570722827 /nfs/dbraw/zinc/72/28/27/570722827.db2.gz MSJPWSROJWYLFY-UHFFFAOYSA-N 1 1 390.531 4.469 50 0 GIAAMO C[N@@H+](CCNC(=O)c1sc2ncccc2c1-n1cccc1)C1CCCCC1 ZINC000033059865 570746935 /nfs/dbraw/zinc/74/69/35/570746935.db2.gz QGHRTTSSCOHTCG-UHFFFAOYSA-N 1 1 382.533 4.081 50 0 GIAAMO Cc1csc2nc(C[N@H+](Cc3ccc(Cl)cc3)CC(C)C)cc(=O)n12 ZINC000033068918 570768433 /nfs/dbraw/zinc/76/84/33/570768433.db2.gz PIJMGCKKSFJTKC-UHFFFAOYSA-N 1 1 375.925 4.376 50 0 GIAAMO Clc1ccc(Cn2nc(C[NH2+]Cc3cccnc3)c(-c3ccccc3)n2)cc1 ZINC000261492506 570789732 /nfs/dbraw/zinc/78/97/32/570789732.db2.gz DHFCIJQJWZYFKX-UHFFFAOYSA-N 1 1 389.890 4.332 50 0 GIAAMO C[NH+]1CCN(C(=S)c2cn(Cc3ccccc3Cl)c3ccccc23)CC1 ZINC000005879271 570800611 /nfs/dbraw/zinc/80/06/11/570800611.db2.gz XVAYDPIZANDVOF-UHFFFAOYSA-N 1 1 383.948 4.266 50 0 GIAAMO O=C1N[C@H](c2cccs2)Nc2sc3c(c21)CC[N@@H+](Cc1ccccc1)C3 ZINC000004525920 570843111 /nfs/dbraw/zinc/84/31/11/570843111.db2.gz QJFDGQQAYPZMQL-SFHVURJKSA-N 1 1 381.526 4.222 50 0 GIAAMO O=C1N[C@H](c2cccs2)Nc2sc3c(c21)CC[N@H+](Cc1ccccc1)C3 ZINC000004525920 570843113 /nfs/dbraw/zinc/84/31/13/570843113.db2.gz QJFDGQQAYPZMQL-SFHVURJKSA-N 1 1 381.526 4.222 50 0 GIAAMO CCN1CCN(c2cc(C[NH2+][C@@H](c3cc4ccccc4o3)C(C)C)ccn2)CC1 ZINC000170592010 570849816 /nfs/dbraw/zinc/84/98/16/570849816.db2.gz COYPPWORAJBJOL-XMMPIXPASA-N 1 1 392.547 4.457 50 0 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380.532 4.190 50 0 GIAAMO CCOc1cc(C[N@H+]2C[C@@H]3CC[C@H](C2)N(Cc2ccccc2)C3)ccc1OC ZINC000095368409 571059710 /nfs/dbraw/zinc/05/97/10/571059710.db2.gz HYTOYSZRZYTLCE-FCHUYYIVSA-N 1 1 380.532 4.190 50 0 GIAAMO C[N@H+]1CCCCC[C@@H]1C(=O)N(CCc1c[nH]c2ccccc12)Cc1cccnc1 ZINC000095373619 571062927 /nfs/dbraw/zinc/06/29/27/571062927.db2.gz MPBIPEKFMLYYGG-HSZRJFAPSA-N 1 1 390.531 4.009 50 0 GIAAMO CSCc1ccc(C(=O)N2C[C@H]3CC[C@@H]2C[N@H+](Cc2ccc(F)cc2)C3)o1 ZINC000095378157 571065669 /nfs/dbraw/zinc/06/56/69/571065669.db2.gz WLZRADBYMSTRQU-FUHWJXTLSA-N 1 1 388.508 4.018 50 0 GIAAMO CSCc1ccc(C(=O)N2C[C@H]3CC[C@@H]2C[N@@H+](Cc2ccc(F)cc2)C3)o1 ZINC000095378157 571065672 /nfs/dbraw/zinc/06/56/72/571065672.db2.gz WLZRADBYMSTRQU-FUHWJXTLSA-N 1 1 388.508 4.018 50 0 GIAAMO O=C(NC[C@@H]1C[N@@H+](CC2CC2)CC12CCCCC2)Nc1cc(F)ccc1F ZINC000409421333 823220955 /nfs/dbraw/zinc/22/09/55/823220955.db2.gz IWMCLRULBYVWOE-MRXNPFEDSA-N 1 1 377.479 4.379 50 0 GIAAMO Cc1cccc2[nH]c3c(ncnc3N3CC[NH+](C/C=C/c4ccccc4)CC3)c21 ZINC000002234611 817380502 /nfs/dbraw/zinc/38/05/02/817380502.db2.gz RNIBYUMOXHANHX-UXBLZVDNSA-N 1 1 383.499 4.255 50 0 GIAAMO Cc1ccc(NC(=O)C[NH+]2CCC(c3nc4ccccc4[nH]3)CC2)cc1Cl ZINC000004315256 817520134 /nfs/dbraw/zinc/52/01/34/817520134.db2.gz ATRVKTXOJGSSSC-UHFFFAOYSA-N 1 1 382.895 4.343 50 0 GIAAMO COc1cccc(CN2CCC[C@@]3(CC[N@@H+](Cc4ccc(C)s4)C3)C2=O)c1 ZINC000012715259 818177693 /nfs/dbraw/zinc/17/76/93/818177693.db2.gz ZWUVQDZRNRMAOR-QFIPXVFZSA-N 1 1 384.545 4.080 50 0 GIAAMO Cc1nc(C[N@H+](C)[C@@H]2CCC(=O)N(Cc3ccc(Cl)cc3)CC2)cs1 ZINC000014994625 818281295 /nfs/dbraw/zinc/28/12/95/818281295.db2.gz IVTKKRMQHXAANW-GOSISDBHSA-N 1 1 377.941 4.118 50 0 GIAAMO O=C(NCC[N@@H+]1Cc2ccccc2O[C@@H](c2ccccc2)C1)[C@H]1CC=CCC1 ZINC000019744242 818604253 /nfs/dbraw/zinc/60/42/53/818604253.db2.gz SNVHGOXVZNCFJA-NZQKXSOJSA-N 1 1 376.500 4.095 50 0 GIAAMO O=C(c1ccc2cc[nH]c2c1)N1CCC[C@@H]2C[N@@H+](Cc3ccsc3)CC[C@H]21 ZINC000019758318 818605285 /nfs/dbraw/zinc/60/52/85/818605285.db2.gz DXXQCWIIYLPKGD-TZIWHRDSSA-N 1 1 379.529 4.356 50 0 GIAAMO COc1cccc(CN2CCC[C@]3(CC[N@@H+](Cc4cccs4)C3)C2)c1OC ZINC000020454479 818622090 /nfs/dbraw/zinc/62/20/90/818622090.db2.gz NYUDFZQPHBHPOI-QFIPXVFZSA-N 1 1 386.561 4.253 50 0 GIAAMO CCn1cc(CCCC(=O)N2CC[NH+](Cc3ccccc3)CC2)c2ccccc21 ZINC000020489994 818623019 /nfs/dbraw/zinc/62/30/19/818623019.db2.gz IJEAKERRLMWMKW-UHFFFAOYSA-N 1 1 389.543 4.328 50 0 GIAAMO CSc1ccc(C[N@@H+]2CCC[C@H](N3CCN(c4ccccc4)CC3)C2)cc1 ZINC000020599013 818626454 /nfs/dbraw/zinc/62/64/54/818626454.db2.gz XKKFYYORFPMKRU-QFIPXVFZSA-N 1 1 381.589 4.195 50 0 GIAAMO CSc1ccc(C[N@H+]2CCC[C@H](N3CCN(c4ccccc4)CC3)C2)cc1 ZINC000020599013 818626460 /nfs/dbraw/zinc/62/64/60/818626460.db2.gz XKKFYYORFPMKRU-QFIPXVFZSA-N 1 1 381.589 4.195 50 0 GIAAMO COc1cccc(-c2nnc3sc(C[N@H+]4CCc5ccccc5C4)cn32)c1 ZINC000020605399 818627157 /nfs/dbraw/zinc/62/71/57/818627157.db2.gz PWOXVDQGCUJBLG-UHFFFAOYSA-N 1 1 376.485 4.025 50 0 GIAAMO CC(C)[C@@](O)(c1ccc(F)cc1)[C@H](C[NH+]1CCOCC1)c1ccc(Cl)cc1 ZINC000020868390 818635361 /nfs/dbraw/zinc/63/53/61/818635361.db2.gz SEXQPFLANHPCNH-FGZHOGPDSA-N 1 1 391.914 4.439 50 0 GIAAMO OCC[C@H]1CN(Cc2ccccc2-c2ccco2)CC[N@H+]1Cc1cccs1 ZINC000020920171 818640227 /nfs/dbraw/zinc/64/02/27/818640227.db2.gz WSIUPGFNYASBSR-IBGZPJMESA-N 1 1 382.529 4.077 50 0 GIAAMO OCC[C@H]1C[N@H+](Cc2ccccc2-c2ccco2)CCN1Cc1cccs1 ZINC000020920171 818640231 /nfs/dbraw/zinc/64/02/31/818640231.db2.gz WSIUPGFNYASBSR-IBGZPJMESA-N 1 1 382.529 4.077 50 0 GIAAMO OCC[C@H]1C[N@@H+](Cc2ccccc2-c2ccco2)CCN1Cc1cccs1 ZINC000020920171 818640235 /nfs/dbraw/zinc/64/02/35/818640235.db2.gz WSIUPGFNYASBSR-IBGZPJMESA-N 1 1 382.529 4.077 50 0 GIAAMO C[C@@H]1CCCC[N@H+]1CCCNC(=O)c1cc(-c2cccnc2)nc2ccccc21 ZINC000021934550 818757323 /nfs/dbraw/zinc/75/73/23/818757323.db2.gz YOPGKTDYKHOGKL-GOSISDBHSA-N 1 1 388.515 4.291 50 0 GIAAMO CC[C@H](CNC(=O)c1ccccc1Br)[N@H+]1CCc2ccccc2C1 ZINC000032445816 820946125 /nfs/dbraw/zinc/94/61/25/820946125.db2.gz YSTLSPFVEOLIRZ-QGZVFWFLSA-N 1 1 387.321 4.016 50 0 GIAAMO C[N@@H+]1CC2=C(OC(N)=C(C#N)[C@H]2c2cccc(F)c2)/C(=C\c2cccc(F)c2)C1 ZINC000033351923 821055599 /nfs/dbraw/zinc/05/55/99/821055599.db2.gz ABJNAKNMXMXAFN-RCZJECKNSA-N 1 1 391.421 4.056 50 0 GIAAMO COc1ccc(-c2nc(C[N@@H+](CC3CC3)C[C@@H]3CCCO3)c(C)o2)c(OC)c1 ZINC000039429903 821105942 /nfs/dbraw/zinc/10/59/42/821105942.db2.gz PLHBQRDYHJOIEO-SFHVURJKSA-N 1 1 386.492 4.058 50 0 GIAAMO Cc1ccc(-c2ccsc2C(=O)NCC2([NH+]3CCOCC3)CCCCC2)cc1 ZINC000040009634 821125421 /nfs/dbraw/zinc/12/54/21/821125421.db2.gz XZSPXJZCDJHWCO-UHFFFAOYSA-N 1 1 398.572 4.488 50 0 GIAAMO CSc1ccccc1NC(=O)CC[N@@H+]1CCO[C@H](c2ccc(Cl)cc2)C1 ZINC000040154721 821151184 /nfs/dbraw/zinc/15/11/84/821151184.db2.gz NZTQMOGBWDTYKB-SFHVURJKSA-N 1 1 390.936 4.464 50 0 GIAAMO CSc1ccccc1NC(=O)CC[N@H+]1CCO[C@H](c2ccc(Cl)cc2)C1 ZINC000040154721 821151192 /nfs/dbraw/zinc/15/11/92/821151192.db2.gz NZTQMOGBWDTYKB-SFHVURJKSA-N 1 1 390.936 4.464 50 0 GIAAMO CSc1ccccc1NC(=O)CC[N@@H+]1CCO[C@@H](c2ccc(Cl)cc2)C1 ZINC000040154722 821151379 /nfs/dbraw/zinc/15/13/79/821151379.db2.gz NZTQMOGBWDTYKB-GOSISDBHSA-N 1 1 390.936 4.464 50 0 GIAAMO CSc1ccccc1NC(=O)CC[N@H+]1CCO[C@@H](c2ccc(Cl)cc2)C1 ZINC000040154722 821151383 /nfs/dbraw/zinc/15/13/83/821151383.db2.gz NZTQMOGBWDTYKB-GOSISDBHSA-N 1 1 390.936 4.464 50 0 GIAAMO CC(C)c1cccc(-c2ccc(C(=O)N3CCC[C@H](C[NH+]4CCOCC4)C3)o2)c1 ZINC000180531417 822697391 /nfs/dbraw/zinc/69/73/91/822697391.db2.gz AABDTSXUUOSXAK-LJQANCHMSA-N 1 1 396.531 4.254 50 0 GIAAMO C[C@H]1C[N@H+](C2CCN(C(=O)Nc3ccccc3Oc3ccccc3)CC2)CCO1 ZINC000124335024 823588128 /nfs/dbraw/zinc/58/81/28/823588128.db2.gz IATZBMXNQYQTRC-SFHVURJKSA-N 1 1 395.503 4.196 50 0 GIAAMO CCc1ccc([C@H]2C[N@H+](Cc3ccc(OCc4noc(C)n4)cc3)CCO2)cc1 ZINC000191668815 823728287 /nfs/dbraw/zinc/72/82/87/823728287.db2.gz WGYYDBMRXIZJHW-JOCHJYFZSA-N 1 1 393.487 4.093 50 0 GIAAMO CCc1ccc([C@H]2C[N@@H+](Cc3ccc(OCc4noc(C)n4)cc3)CCO2)cc1 ZINC000191668815 823728296 /nfs/dbraw/zinc/72/82/96/823728296.db2.gz WGYYDBMRXIZJHW-JOCHJYFZSA-N 1 1 393.487 4.093 50 0 GIAAMO C[N@@H+](Cc1ccc(Cl)c2cccnc12)[C@H]1CCN(Cc2ccccc2)C1=O ZINC000191770381 823762333 /nfs/dbraw/zinc/76/23/33/823762333.db2.gz KQDWMCVOMFMWFX-FQEVSTJZSA-N 1 1 379.891 4.121 50 0 GIAAMO C[N@@H+](Cc1ccccc1)[C@H]1CCOC2(CCN(C(=O)c3ccsc3)CC2)C1 ZINC000169792415 823916465 /nfs/dbraw/zinc/91/64/65/823916465.db2.gz VKRWNJYFIPTEEQ-FQEVSTJZSA-N 1 1 384.545 4.034 50 0 GIAAMO Cc1ncsc1C[N@H+]1CC[C@H](Oc2ccccc2-c2nc(C3CC3)no2)C1 ZINC000575314958 823952713 /nfs/dbraw/zinc/95/27/13/823952713.db2.gz UNEJOOMPWYDMJJ-HNNXBMFYSA-N 1 1 382.489 4.032 50 0 GIAAMO COCCO[C@@H]1C[N@H+](C2CCN(Cc3cccc(C)c3)CC2)C12CCCCC2 ZINC000575317580 823953993 /nfs/dbraw/zinc/95/39/93/823953993.db2.gz YTPXFJXAHRYDNA-HSZRJFAPSA-N 1 1 386.580 4.010 50 0 GIAAMO COCCO[C@@H]1C[N@@H+](C2CCN(Cc3cccc(C)c3)CC2)C12CCCCC2 ZINC000575317580 823954000 /nfs/dbraw/zinc/95/40/00/823954000.db2.gz YTPXFJXAHRYDNA-HSZRJFAPSA-N 1 1 386.580 4.010 50 0 GIAAMO COc1cccc(C[N@H+]2CCC[C@H](Cn3c(C)cnc3C3CCOCC3)C2)c1 ZINC000575547750 823976628 /nfs/dbraw/zinc/97/66/28/823976628.db2.gz VFTHUADGSCOJDW-FQEVSTJZSA-N 1 1 383.536 4.006 50 0 GIAAMO COc1ccccc1-c1ccc(-c2ccc([C@@H](C)[NH+]3CCOCC3)cc2)nn1 ZINC000426563155 231240989 /nfs/dbraw/zinc/24/09/89/231240989.db2.gz DFIGLPQEFWGGAI-QGZVFWFLSA-N 1 1 375.472 4.212 50 0 GIAAMO Cc1[nH+]ccn1-c1ccccc1CNC(=O)N1CCCC[C@@H]1c1nccs1 ZINC000426705577 231254647 /nfs/dbraw/zinc/25/46/47/231254647.db2.gz DBHDWOQXBUKKLQ-GOSISDBHSA-N 1 1 381.505 4.074 50 0 GIAAMO CC[NH+]1CCN(c2ccc(NC(=O)Cc3ccc(Cl)cc3)cc2Cl)CC1 ZINC000001312262 212235612 /nfs/dbraw/zinc/23/56/12/212235612.db2.gz MAGLNQLAHYOLEP-UHFFFAOYSA-N 1 1 392.330 4.317 50 0 GIAAMO COc1ccc(C2=NN(C(=O)C[NH+]3CCCCC3)[C@@H](c3ccc(C)cc3)C2)cc1 ZINC000001053103 212210705 /nfs/dbraw/zinc/21/07/05/212210705.db2.gz NWKSNJZYQLBIEO-HSZRJFAPSA-N 1 1 391.515 4.167 50 0 GIAAMO COc1ccc([C@H]2CCC[N@@H+]2CC(=O)N[C@H](C)c2ccc(C)c(C)c2)c(OC)c1 ZINC000034799582 212162472 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CCN(C(=O)[C@H](C)[N@@H+](C)Cc1ccc2c(c1)OCO2)c1cccc2ccccc21 ZINC000007664698 221004083 /nfs/dbraw/zinc/00/40/83/221004083.db2.gz NZECDYNDJJSWHE-KRWDZBQOSA-N 1 1 390.483 4.442 50 0 GIAAMO COc1ccccc1[C@H](CNC(=O)CSc1ccc2ccccc2c1)[NH+](C)C ZINC000008088779 221025881 /nfs/dbraw/zinc/02/58/81/221025881.db2.gz KOURUEMGPPOODZ-NRFANRHFSA-N 1 1 394.540 4.360 50 0 GIAAMO C[C@H](C(=O)NCCc1cccs1)[NH+]1CCC(c2nc3ccccc3s2)CC1 ZINC000007917228 221015909 /nfs/dbraw/zinc/01/59/09/221015909.db2.gz HHQGPGALWBJPEY-OAHLLOKOSA-N 1 1 399.585 4.285 50 0 GIAAMO CC(C)C[N@@H+]1CCO[C@H](CNCc2ccc(-c3nc4ccccc4s3)o2)C1 ZINC000007985270 221019155 /nfs/dbraw/zinc/01/91/55/221019155.db2.gz XFHGCSUHHUCABC-QGZVFWFLSA-N 1 1 385.533 4.003 50 0 GIAAMO CC(C)C[N@H+]1CCO[C@H](CNCc2ccc(-c3nc4ccccc4s3)o2)C1 ZINC000007985270 221019160 /nfs/dbraw/zinc/01/91/60/221019160.db2.gz XFHGCSUHHUCABC-QGZVFWFLSA-N 1 1 385.533 4.003 50 0 GIAAMO C=C1C(Nc2ccc([NH+](CC)CC)cc2C)=NS(=O)(=O)C1c1ccccc1 ZINC000009251876 221076047 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4.059 50 0 GIAAMO c1ccc(-c2noc(C[N@H+]3CCCN(c4nc5ccccc5s4)CC3)n2)cc1 ZINC000011815634 221128139 /nfs/dbraw/zinc/12/81/39/221128139.db2.gz DOROYKAHMBHINW-UHFFFAOYSA-N 1 1 391.500 4.059 50 0 GIAAMO CN(C(=O)CCCc1cccs1)[C@@H]1CCC[N@H+](C2Cc3ccccc3C2)C1 ZINC000011843367 221131797 /nfs/dbraw/zinc/13/17/97/221131797.db2.gz IJGKCPLAPQHWEM-HXUWFJFHSA-N 1 1 382.573 4.161 50 0 GIAAMO COc1ccc(CC[N@@H+]2CCC[C@H](CN(C)Cc3ccc(OC)cc3)C2)cc1 ZINC000011879911 221134723 /nfs/dbraw/zinc/13/47/23/221134723.db2.gz LLZAZGGWTAUFPP-JOCHJYFZSA-N 1 1 382.548 4.090 50 0 GIAAMO COc1ccc(CC[N@H+]2CCC[C@H](CN(C)Cc3ccc(OC)cc3)C2)cc1 ZINC000011879911 221134726 /nfs/dbraw/zinc/13/47/26/221134726.db2.gz LLZAZGGWTAUFPP-JOCHJYFZSA-N 1 1 382.548 4.090 50 0 GIAAMO CCn1c(C[NH2+][C@@H](C)c2cnn(-c3ccc(OC)cc3)c2C)nc2ccccc21 ZINC000011935670 221139354 /nfs/dbraw/zinc/13/93/54/221139354.db2.gz ZKZKUNASQDYMLP-INIZCTEOSA-N 1 1 389.503 4.410 50 0 GIAAMO COc1ccc(C[N@H+]2CCC[C@H](c3n[nH]cc3-c3cccc(C)c3)C2)cc1O ZINC000012028732 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221195693 /nfs/dbraw/zinc/19/56/93/221195693.db2.gz LJCVZXVYPLMASQ-JOCHJYFZSA-N 1 1 376.491 4.360 50 0 GIAAMO CC1(CCC(=O)N2CC[C@]3(C2)CCC[N@@H+](Cc2cccc(F)c2F)C3)CC1 ZINC000012439461 221195695 /nfs/dbraw/zinc/19/56/95/221195695.db2.gz LJCVZXVYPLMASQ-JOCHJYFZSA-N 1 1 376.491 4.360 50 0 GIAAMO O=C(c1ccc2[nH]cnc2c1)N1CC[NH+](C(c2ccccc2)c2ccccc2)CC1 ZINC000012535136 221202911 /nfs/dbraw/zinc/20/29/11/221202911.db2.gz SKZUXHJOCLJKGN-UHFFFAOYSA-N 1 1 396.494 4.110 50 0 GIAAMO COc1ccc(NC(=O)[C@@H](C)Nc2ccc([NH+]3CCCCC3)cc2)cc1OC ZINC000012550237 221204978 /nfs/dbraw/zinc/20/49/78/221204978.db2.gz DEUXVSKINWKIEX-MRXNPFEDSA-N 1 1 383.492 4.133 50 0 GIAAMO CC(=O)Nc1ccc(C[N@H+]2CC[C@]3(C2)CCCN(Cc2ccccc2F)C3)cc1 ZINC000012572414 221208106 /nfs/dbraw/zinc/20/81/06/221208106.db2.gz KEMRLEWHEHQIGG-XMMPIXPASA-N 1 1 395.522 4.272 50 0 GIAAMO CC(C)n1cc(C(=O)N2CC[C@]3(C2)CCC[N@@H+](CCC2CCCCC2)C3)cn1 ZINC000012575122 221209110 /nfs/dbraw/zinc/20/91/10/221209110.db2.gz FDOGGTDHOSXSEU-HSZRJFAPSA-N 1 1 386.584 4.363 50 0 GIAAMO C[N@H+]1CCC[C@H](CN(CCc2ccccc2)C(=O)c2ccc3cc[nH]c3c2)C1 ZINC000012579890 221210377 /nfs/dbraw/zinc/21/03/77/221210377.db2.gz BCPVHBOOWWSKIR-FQEVSTJZSA-N 1 1 375.516 4.195 50 0 GIAAMO CCN(CC)C(=O)[C@H]1CCC[N@@H+](Cc2nc(-c3ccc(F)cc3F)oc2C)C1 ZINC000012373511 221186245 /nfs/dbraw/zinc/18/62/45/221186245.db2.gz PZKAFZYPGQWOQR-HNNXBMFYSA-N 1 1 391.462 4.009 50 0 GIAAMO Cc1nc(C(=O)N(C)C[C@@H]2CCC[N@@H+](CCc3ccc(Cl)cc3)C2)cs1 ZINC000012386890 221188195 /nfs/dbraw/zinc/18/81/95/221188195.db2.gz DASMNBVKFJTMST-KRWDZBQOSA-N 1 1 391.968 4.132 50 0 GIAAMO CCc1ocnc1C(=O)N1CC[C@@]2(C1)CCC[N@@H+](Cc1ccc(C(C)C)cc1)C2 ZINC000012595901 221212598 /nfs/dbraw/zinc/21/25/98/221212598.db2.gz QJUMUDZYGJUOIR-DEOSSOPVSA-N 1 1 395.547 4.489 50 0 GIAAMO Oc1ccc(C[NH+]2CCC(O)(Cc3cc(-c4ccccc4)no3)CC2)cc1Cl ZINC000012596029 221213254 /nfs/dbraw/zinc/21/32/54/221213254.db2.gz OPCQKXVLEPNIFF-UHFFFAOYSA-N 1 1 398.890 4.270 50 0 GIAAMO CCOc1ccc(C[N@H+]2CCC[C@H](C(=O)c3cccc(Cl)c3)C2)cc1CO 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385.489 4.098 50 0 GIAAMO COc1cccc(OC[C@H]2CCC[N@@H+](Cc3nc(-c4cccs4)no3)C2)c1 ZINC000012745200 221223181 /nfs/dbraw/zinc/22/31/81/221223181.db2.gz HMMFJSDNWNXCLR-HNNXBMFYSA-N 1 1 385.489 4.098 50 0 GIAAMO Cc1nn(C)c(Cl)c1C[N@H+]1CCC[C@@H](CCC(=O)Nc2ccccc2F)C1 ZINC000012589224 221211577 /nfs/dbraw/zinc/21/15/77/221211577.db2.gz GTGJBHBGLZOKEZ-HNNXBMFYSA-N 1 1 392.906 4.152 50 0 GIAAMO C[NH+](C)[C@H](CNC(=O)c1ccc(F)cc1Br)c1ccccc1Cl ZINC000012755788 221226016 /nfs/dbraw/zinc/22/60/16/221226016.db2.gz NWOHSQPNIXRQID-MRXNPFEDSA-N 1 1 399.691 4.274 50 0 GIAAMO C[C@@H]1C[C@H](C)C[N@@H+](Cc2csc(NC(=O)c3ccc(C(F)(F)F)nc3)n2)C1 ZINC000012758093 221226483 /nfs/dbraw/zinc/22/64/83/221226483.db2.gz ZNGMQNKEPZIIGW-TXEJJXNPSA-N 1 1 398.454 4.287 50 0 GIAAMO C[C@@H]1C[C@H](C)C[N@H+](Cc2csc(NC(=O)c3ccc(C(F)(F)F)nc3)n2)C1 ZINC000012758093 221226484 /nfs/dbraw/zinc/22/64/84/221226484.db2.gz ZNGMQNKEPZIIGW-TXEJJXNPSA-N 1 1 398.454 4.287 50 0 GIAAMO CCc1cc2c(C[N@H+]3CCC[C@H]3c3ccc(OC)cc3)cc(=O)oc2cc1O 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SODQXTOCIBGQEP-ZOXUKVPXSA-N 1 1 394.515 4.011 50 0 GIAAMO CCOC(=O)[C@@H]1CCC[N@@H+]([C@@H](C(=O)c2c[nH]c3ccccc23)c2ccccc2)C1 ZINC000013076285 221260417 /nfs/dbraw/zinc/26/04/17/221260417.db2.gz GYOPGVTVUHNRBA-XMSQKQJNSA-N 1 1 390.483 4.367 50 0 GIAAMO CCOC(=O)[C@@H]1CCC[N@H+]([C@@H](C(=O)c2c[nH]c3ccccc23)c2ccccc2)C1 ZINC000013076285 221260420 /nfs/dbraw/zinc/26/04/20/221260420.db2.gz GYOPGVTVUHNRBA-XMSQKQJNSA-N 1 1 390.483 4.367 50 0 GIAAMO Cc1ccc2c(c1)[C@@H]1C[N@@H+](C)CC[C@H]1N2C(=O)c1ccc(OC(F)(F)F)cc1 ZINC000013134190 221261762 /nfs/dbraw/zinc/26/17/62/221261762.db2.gz WXMITVABVFHPFM-PKOBYXMFSA-N 1 1 390.405 4.342 50 0 GIAAMO O[C@@H]1CCC[N@@H+](Cc2cn(Cc3ccccc3)nc2-c2cc3ccccc3o2)C1 ZINC000013594836 221276117 /nfs/dbraw/zinc/27/61/17/221276117.db2.gz NZEIYLCDWYXLLI-OAQYLSRUSA-N 1 1 387.483 4.301 50 0 GIAAMO O=C(NCC[N@H+]1CCC[C@@H](c2ccccc2)C1)c1ccc2nc(C3CC3)oc2c1 ZINC000014972407 221321772 /nfs/dbraw/zinc/32/17/72/221321772.db2.gz GZBBJRPZWHFNPV-HXUWFJFHSA-N 1 1 389.499 4.315 50 0 GIAAMO O=C(NCC[N@H+]1CCC[C@H](c2ccccc2)C1)c1ccc2nc(C3CC3)oc2c1 ZINC000014972411 221322191 /nfs/dbraw/zinc/32/21/91/221322191.db2.gz GZBBJRPZWHFNPV-FQEVSTJZSA-N 1 1 389.499 4.315 50 0 GIAAMO CCCCNC(=O)[C@@H]1C[C@H](COc2cccc(F)c2)C[N@@H+](Cc2ccccc2)C1 ZINC000014744957 221315778 /nfs/dbraw/zinc/31/57/78/221315778.db2.gz HAMNUGQUSZMZMR-LEWJYISDSA-N 1 1 398.522 4.259 50 0 GIAAMO [NH3+][C@H](Cc1c(Cc2ccccc2)[nH]c2ccccc21)C(=O)OCc1ccccc1 ZINC000015413949 221336170 /nfs/dbraw/zinc/33/61/70/221336170.db2.gz JVAHKYMGBRRWPV-JOCHJYFZSA-N 1 1 384.479 4.372 50 0 GIAAMO CC[C@H](C)c1ccc(NC(=O)C[NH+]2CCC(C(=O)N3CCCCCC3)CC2)cc1 ZINC000015518865 221336452 /nfs/dbraw/zinc/33/64/52/221336452.db2.gz MIGBXXSJBYHYFG-IBGZPJMESA-N 1 1 399.579 4.253 50 0 GIAAMO CC[C@@H]([NH2+][C@@H](C)c1nc2ccccc2c(=O)[nH]1)c1ccc(Br)cc1 ZINC000016694703 221369016 /nfs/dbraw/zinc/36/90/16/221369016.db2.gz RQIAEPNVPJIDDN-BLLLJJGKSA-N 1 1 386.293 4.488 50 0 GIAAMO COc1cccc([C@@H]2c3cc4c(cc3O[C@](C)([NH+]3CCCC3)[C@H]2C)OCO4)c1O ZINC000017142519 221379692 /nfs/dbraw/zinc/37/96/92/221379692.db2.gz LDJUMRJNYFZQRI-RUGFAHKUSA-N 1 1 397.471 4.102 50 0 GIAAMO Cc1nn(-c2ccc(F)cc2)c(C)c1CNC1CC[NH+](Cc2ccccc2)CC1 ZINC000017310494 221384029 /nfs/dbraw/zinc/38/40/29/221384029.db2.gz OGAAZYLKFGCECI-UHFFFAOYSA-N 1 1 392.522 4.382 50 0 GIAAMO C[C@@H]1CCC[N@@H+](CCCNC(=O)C2=Cc3sc4c(c3CS2)CCCC4)C1 ZINC000020931398 221519075 /nfs/dbraw/zinc/51/90/75/221519075.db2.gz KTLYLDMTGYBKTC-OAHLLOKOSA-N 1 1 390.618 4.453 50 0 GIAAMO Cc1ccc(C(=O)Nc2ccc(N3CC[NH+](C)CC3)c(Cl)c2)c(Cl)c1 ZINC000004933439 136194104 /nfs/dbraw/zinc/19/41/04/136194104.db2.gz RJOOBRROTROALT-UHFFFAOYSA-N 1 1 378.303 4.306 50 0 GIAAMO C[N@H+](Cc1ccc(F)cc1)Cc1cc(=O)n2c(-c3ccccc3)csc2n1 ZINC000033268828 221781764 /nfs/dbraw/zinc/78/17/64/221781764.db2.gz JSENSILEZBMSQV-UHFFFAOYSA-N 1 1 379.460 4.194 50 0 GIAAMO C[N@@H+](Cc1ccc(F)cc1)Cc1cc(=O)n2c(-c3ccccc3)csc2n1 ZINC000033268828 221781769 /nfs/dbraw/zinc/78/17/69/221781769.db2.gz JSENSILEZBMSQV-UHFFFAOYSA-N 1 1 379.460 4.194 50 0 GIAAMO Cc1ccc2c(c1)CC[C@H]2NC(=O)NC1CC[NH+](Cc2ccc(F)c(F)c2)CC1 ZINC000056851282 222026034 /nfs/dbraw/zinc/02/60/34/222026034.db2.gz KWZSUTIWUUPUQA-JOCHJYFZSA-N 1 1 399.485 4.224 50 0 GIAAMO C[C@H]1CCCC[N@H+]1CCCCNC(=O)N[C@@H]1CCOc2c(Cl)cccc21 ZINC000056805641 222026413 /nfs/dbraw/zinc/02/64/13/222026413.db2.gz HZDIRMRLWZSYKE-MAUKXSAKSA-N 1 1 379.932 4.117 50 0 GIAAMO Cc1cc(F)ccc1NC(=O)C1CC[NH+](Cc2nc(-c3ccccc3)no2)CC1 ZINC000051317161 222004160 /nfs/dbraw/zinc/00/41/60/222004160.db2.gz NEIWVHHTXIEHMI-UHFFFAOYSA-N 1 1 394.450 4.035 50 0 GIAAMO Cc1cc(NC(=O)C2CC[NH+](Cc3nc(-c4ccccc4)no3)CC2)ccc1F ZINC000051317165 222005290 /nfs/dbraw/zinc/00/52/90/222005290.db2.gz GSKSMSMESGJYHU-UHFFFAOYSA-N 1 1 394.450 4.035 50 0 GIAAMO C[C@H](c1cccc(C(F)(F)F)c1)[N@@H+](Cc1cc(=O)n2ccccc2n1)C1CC1 ZINC000054396498 222013415 /nfs/dbraw/zinc/01/34/15/222013415.db2.gz IISXIZLCJPBQSK-CQSZACIVSA-N 1 1 387.405 4.439 50 0 GIAAMO COc1ccccc1C(=O)[C@@H]1CCC[N@@H+](Cc2nc3ccccc3nc2C)C1 ZINC000055118985 222015760 /nfs/dbraw/zinc/01/57/60/222015760.db2.gz HXLFFJMYGZXYGH-QGZVFWFLSA-N 1 1 375.472 4.042 50 0 GIAAMO CCOc1ccccc1OCC[N@@H+](C)Cc1cccc(Oc2ncccn2)c1 ZINC000055271226 222019094 /nfs/dbraw/zinc/01/90/94/222019094.db2.gz WJHOPMQPQBIAOK-UHFFFAOYSA-N 1 1 379.460 4.178 50 0 GIAAMO CCOc1ccc(C[N@@H+](C[C@]2(c3cccc(OC)c3)CCOC2)C2CC2)cc1 ZINC000055404918 222022117 /nfs/dbraw/zinc/02/21/17/222022117.db2.gz BXJLJMCXTAQLLD-XMMPIXPASA-N 1 1 381.516 4.417 50 0 GIAAMO Cc1ccccc1NC(=O)C[NH+]1CCC(c2nc(-c3ccc(F)cc3)no2)CC1 ZINC000065184159 222106987 /nfs/dbraw/zinc/10/69/87/222106987.db2.gz QFKNHSVGFROFDO-UHFFFAOYSA-N 1 1 394.450 4.002 50 0 GIAAMO COc1c(Cl)cc(C(=O)NCc2ccccc2-n2cc[nH+]c2C)cc1Cl ZINC000058365643 222051159 /nfs/dbraw/zinc/05/11/59/222051159.db2.gz DOKFFJQCCFTMCW-UHFFFAOYSA-N 1 1 390.270 4.426 50 0 GIAAMO O=C(NC1CC1)[C@H](c1ccccc1)[NH+]1CCC(C(=O)c2ccc(Cl)cc2)CC1 ZINC000058414207 222052660 /nfs/dbraw/zinc/05/26/60/222052660.db2.gz MJXFPHNHYNDBBG-NRFANRHFSA-N 1 1 396.918 4.255 50 0 GIAAMO Cc1ccc(-n2cc(C[N@@H+](C)Cc3ccncn3)c(-c3ccc(F)cc3)n2)cc1 ZINC000059383359 222058413 /nfs/dbraw/zinc/05/84/13/222058413.db2.gz RKHYXVBXLNHZNH-UHFFFAOYSA-N 1 1 387.462 4.409 50 0 GIAAMO Cc1ccc(-n2cc(C[N@H+](C)Cc3ccncn3)c(-c3ccc(F)cc3)n2)cc1 ZINC000059383359 222058420 /nfs/dbraw/zinc/05/84/20/222058420.db2.gz RKHYXVBXLNHZNH-UHFFFAOYSA-N 1 1 387.462 4.409 50 0 GIAAMO CCOc1ccc(C(=O)N2CCC[N@@H+](CC3CCCCC3)CC2)cc1OCC ZINC000059887174 222058446 /nfs/dbraw/zinc/05/84/46/222058446.db2.gz MJRVTWIBAWPRSV-UHFFFAOYSA-N 1 1 388.552 4.212 50 0 GIAAMO COc1ccc(C[N@@H+](Cc2ccccc2)Cc2cc(=O)n3cccc(C)c3n2)cc1 ZINC000064590809 222074918 /nfs/dbraw/zinc/07/49/18/222074918.db2.gz JNGXIRHAKRXPLA-UHFFFAOYSA-N 1 1 399.494 4.214 50 0 GIAAMO Cc1c(Cl)cccc1NC(=O)N1CC[NH+](Cc2cn(C)c3ccccc23)CC1 ZINC000065330057 222123393 /nfs/dbraw/zinc/12/33/93/222123393.db2.gz SOYJXVAEPBSGFH-UHFFFAOYSA-N 1 1 396.922 4.490 50 0 GIAAMO CC(C)c1[nH+]ccn1[C@H](C)c1nc(CCc2ccccc2)nn1-c1ccccn1 ZINC000065380988 222125763 /nfs/dbraw/zinc/12/57/63/222125763.db2.gz BCKGAZZNDWGYPR-GOSISDBHSA-N 1 1 386.503 4.377 50 0 GIAAMO Cc1csc([C@H]2CCCCN2C(=O)[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)n1 ZINC000065553712 222133341 /nfs/dbraw/zinc/13/33/41/222133341.db2.gz OBZRVCMGVGGFKO-WOJBJXKFSA-N 1 1 383.561 4.417 50 0 GIAAMO CC(C)Cn1cncc1CN1CCC[N@@H+](Cc2ccc(F)cc2)[C@H](C(C)C)C1 ZINC000071750665 222190288 /nfs/dbraw/zinc/19/02/88/222190288.db2.gz AJRXRYYAZWTFHU-QHCPKHFHSA-N 1 1 386.559 4.411 50 0 GIAAMO C[N@H+]1CCC[C@H]1CCN1CCOc2c(O)cc(-c3cccc(Cl)c3)cc2C1 ZINC000067655018 222154552 /nfs/dbraw/zinc/15/45/52/222154552.db2.gz INPMINPLJZJZQQ-FQEVSTJZSA-N 1 1 386.923 4.391 50 0 GIAAMO CCNc1cc[nH+]c(NCc2nc(-c3ccc(C)cc3)c(-c3ccccn3)[nH]2)n1 ZINC000067788036 222159913 /nfs/dbraw/zinc/15/99/13/222159913.db2.gz GUAXGZAWZCZYBH-UHFFFAOYSA-N 1 1 385.475 4.281 50 0 GIAAMO CCNc1cc[nH+]c(NCc2nc(-c3ccccn3)c(-c3ccc(C)cc3)[nH]2)n1 ZINC000067788036 222159917 /nfs/dbraw/zinc/15/99/17/222159917.db2.gz GUAXGZAWZCZYBH-UHFFFAOYSA-N 1 1 385.475 4.281 50 0 GIAAMO Cc1nc(C)c(C[N@H+]2CC[C@]3(C2)CCCN(C(=O)c2cccc(C)c2)C3)s1 ZINC000067805993 222161173 /nfs/dbraw/zinc/16/11/73/222161173.db2.gz UWUDXUYTSUMFSX-QFIPXVFZSA-N 1 1 383.561 4.197 50 0 GIAAMO Cc1ccc(-c2cc(O)c3c(c2)CN(c2[nH+]cnc4[nH]ccc42)CCO3)s1 ZINC000067805510 222162138 /nfs/dbraw/zinc/16/21/38/222162138.db2.gz FUEUFLFUAGGIFG-UHFFFAOYSA-N 1 1 378.457 4.099 50 0 GIAAMO CCCCc1nc(C[N@@H+]2C[C@H](c3ccc(C)cc3)[C@@H]3[C@H]2C2CCN3CC2)c[nH]1 ZINC000072154747 222212188 /nfs/dbraw/zinc/21/21/88/222212188.db2.gz WJZUVOCRYJWOHC-GMKZXUHWSA-N 1 1 378.564 4.123 50 0 GIAAMO CCCCc1nc(C[N@H+]2C[C@H](c3ccc(C)cc3)[C@@H]3[C@H]2C2CCN3CC2)c[nH]1 ZINC000072154747 222212191 /nfs/dbraw/zinc/21/21/91/222212191.db2.gz WJZUVOCRYJWOHC-GMKZXUHWSA-N 1 1 378.564 4.123 50 0 GIAAMO Cc1cccc(-c2nc3cc(C)ccc3cc2C[N@@H+]2[C@@H]3CC[C@H]2CNC(=O)C3)c1 ZINC000072477612 222266669 /nfs/dbraw/zinc/26/66/69/222266669.db2.gz AYBPABWSUXCEAT-YADHBBJMSA-N 1 1 385.511 4.372 50 0 GIAAMO COc1ccc([C@@H]2CCCN2C(=O)[C@@H]2CC[N@H+](C3CCCCC3)C2)c(OC)c1 ZINC000072312737 222225159 /nfs/dbraw/zinc/22/51/59/222225159.db2.gz PALRWKDXEPKPEB-UTKZUKDTSA-N 1 1 386.536 4.022 50 0 GIAAMO COc1ccc(-n2cc(C[N@H+]3CCC[C@@H](O)C3)c(-c3ccccc3Cl)n2)cc1 ZINC000072423323 222256821 /nfs/dbraw/zinc/25/68/21/222256821.db2.gz SKZLTZWMMLFBAL-GOSISDBHSA-N 1 1 397.906 4.158 50 0 GIAAMO O=C(c1ccc(C[NH+]2CCSCC2)cc1)c1ccc(Br)cc1F ZINC000085651285 222325750 /nfs/dbraw/zinc/32/57/50/222325750.db2.gz HWQZUIOMSMUZRH-UHFFFAOYSA-N 1 1 394.309 4.368 50 0 GIAAMO C[C@@H]([NH2+]CC(=O)Nc1cccc(Br)c1)c1cc(F)c(F)c(F)c1 ZINC000095985072 222368248 /nfs/dbraw/zinc/36/82/48/222368248.db2.gz UQDJFPIQQUXBNC-SECBINFHSA-N 1 1 387.199 4.156 50 0 GIAAMO C[C@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)c1ccc(Sc2ccc(Cl)cc2)o1 ZINC000096012408 222370781 /nfs/dbraw/zinc/37/07/81/222370781.db2.gz XPAAYKNJEAYROX-DZGCQCFKSA-N 1 1 376.909 4.393 50 0 GIAAMO CCc1nc(C)c(C(=O)N2CCC3(CC2)C[C@H](c2ccccc2)C[N@H+](CC)C3)o1 ZINC000096141680 222388430 /nfs/dbraw/zinc/38/84/30/222388430.db2.gz VTVOMDHUEQQMRK-FQEVSTJZSA-N 1 1 395.547 4.277 50 0 GIAAMO COc1ccccc1-c1ccc(NC(=O)N2CC([N@H+]3CCCC[C@@H]3C)C2)cc1 ZINC000096165076 222395483 /nfs/dbraw/zinc/39/54/83/222395483.db2.gz WCAILFKOZCKYNN-KRWDZBQOSA-N 1 1 379.504 4.453 50 0 GIAAMO COc1ccc([C@@H](CC[NH+]2CCOCC2)Oc2ccc(F)c(Cl)c2)cc1 ZINC000096281673 222409276 /nfs/dbraw/zinc/40/92/76/222409276.db2.gz ZMKGNPIRPZGEFF-HXUWFJFHSA-N 1 1 379.859 4.330 50 0 GIAAMO CCOc1cc(C[NH2+]Cc2nc3ccccc3[nH]2)cc(Br)c1OC ZINC000113398531 222516199 /nfs/dbraw/zinc/51/61/99/222516199.db2.gz SZLMFVNNVGAVIT-UHFFFAOYSA-N 1 1 390.281 4.023 50 0 GIAAMO COc1ccc([C@@H]2[NH2+][C@H](C(=O)Nc3ccccc3)Cc3c4ccccc4[nH]c32)cc1 ZINC000036367819 518159698 /nfs/dbraw/zinc/15/96/98/518159698.db2.gz NBQRFAPKEVRLBD-GOTSBHOMSA-N 1 1 397.478 4.419 50 0 GIAAMO CC(=O)c1cccc(-c2ccc(C(=O)N3CC([N@@H+]4CCCC[C@H]4C)C3)cc2)c1 ZINC000426640368 527348448 /nfs/dbraw/zinc/34/84/48/527348448.db2.gz GYXXUAHQKIGVDI-QGZVFWFLSA-N 1 1 376.500 4.255 50 0 GIAAMO COc1ccc(CN2CC[NH+](Cc3ccc(C(F)(F)F)cc3)CC2)cc1OC ZINC000019781941 570218487 /nfs/dbraw/zinc/21/84/87/570218487.db2.gz SPHLHPWSZSMAPZ-UHFFFAOYSA-N 1 1 394.437 4.040 50 0 GIAAMO COc1cccc(CN2CC[NH+](Cc3ccc(C(F)(F)F)cc3)CC2)c1OC ZINC000019781580 570218559 /nfs/dbraw/zinc/21/85/59/570218559.db2.gz CDBDWDOOPYOSJN-UHFFFAOYSA-N 1 1 394.437 4.040 50 0 GIAAMO COc1ccc(CNC(=O)c2ccc(C[N@H+]3CCc4ccccc4C3)cc2)cc1 ZINC000019813089 570221555 /nfs/dbraw/zinc/22/15/55/570221555.db2.gz BVMMVYPUSCBFHP-UHFFFAOYSA-N 1 1 386.495 4.184 50 0 GIAAMO CC[C@@H]1CCCCN1C(=O)C[N@@H+]1CCC[C@@H]1c1cccc(Br)c1 ZINC000048273468 570226219 /nfs/dbraw/zinc/22/62/19/570226219.db2.gz PPMMWHJAMQQRFR-QZTJIDSGSA-N 1 1 379.342 4.377 50 0 GIAAMO CC[C@@H]1CCCCN1C(=O)C[N@H+]1CCC[C@@H]1c1cccc(Br)c1 ZINC000048273468 570226222 /nfs/dbraw/zinc/22/62/22/570226222.db2.gz PPMMWHJAMQQRFR-QZTJIDSGSA-N 1 1 379.342 4.377 50 0 GIAAMO Fc1ccc(-c2nc3c([nH]2)CN(C2CCC4(CC[NH2+]CC4)CC2)CC3)c(F)c1 ZINC000097076645 570235904 /nfs/dbraw/zinc/23/59/04/570235904.db2.gz LXRVNLOOEOXRHN-UHFFFAOYSA-N 1 1 386.490 4.025 50 0 GIAAMO CCc1ccc2oc(=O)cc(C[NH+]3CCN(c4cccc(C)c4C)CC3)c2c1 ZINC000020213256 570248674 /nfs/dbraw/zinc/24/86/74/570248674.db2.gz URMBFEAJIHCHLN-UHFFFAOYSA-N 1 1 376.500 4.294 50 0 GIAAMO Cc1c(-c2cccc(Cl)c2)nc2ccccc2c1C(=O)N1CC[NH+](C)CC1 ZINC000020295278 570251616 /nfs/dbraw/zinc/25/16/16/570251616.db2.gz JUIXGFIZLXFLPK-UHFFFAOYSA-N 1 1 379.891 4.251 50 0 GIAAMO COc1ccccc1CNC(=O)c1ccc(C[N@H+]2CCc3ccccc3C2)cc1 ZINC000020326619 570252173 /nfs/dbraw/zinc/25/21/73/570252173.db2.gz OCOZYDOFUGZJJY-UHFFFAOYSA-N 1 1 386.495 4.184 50 0 GIAAMO O=Cc1cc(Cl)ccc1OCCCC[NH+]1CCN(Cc2ccccc2)CC1 ZINC000020500202 570264274 /nfs/dbraw/zinc/26/42/74/570264274.db2.gz UMSMXQVABVSHQL-UHFFFAOYSA-N 1 1 386.923 4.129 50 0 GIAAMO COc1ccccc1C[N@@H+]1CCc2nc(Nc3ccc(F)cc3F)ncc2C1 ZINC000021639520 570293835 /nfs/dbraw/zinc/29/38/35/570293835.db2.gz YJHXLPWJMJVQCO-UHFFFAOYSA-N 1 1 382.414 4.065 50 0 GIAAMO COc1ccccc1C[N@H+]1CCc2nc(Nc3ccc(F)cc3F)ncc2C1 ZINC000021639520 570293839 /nfs/dbraw/zinc/29/38/39/570293839.db2.gz YJHXLPWJMJVQCO-UHFFFAOYSA-N 1 1 382.414 4.065 50 0 GIAAMO Cc1ccc(-c2cc(C(=O)NC[C@@H](c3ccccc3Cl)[NH+](C)C)no2)cc1 ZINC000021807583 570297289 /nfs/dbraw/zinc/29/72/89/570297289.db2.gz HPQYHXVZISXALM-IBGZPJMESA-N 1 1 383.879 4.336 50 0 GIAAMO Cc1noc(C(C)C)c1C(=O)NC[C@@H](c1ccccc1Cl)[NH+]1CCCC1 ZINC000022619749 570323844 /nfs/dbraw/zinc/32/38/44/570323844.db2.gz QLKDQPJRICTHRK-KRWDZBQOSA-N 1 1 375.900 4.327 50 0 GIAAMO Cc1cccc([C@@H]2C[C@H](C(=O)N3CCSCC3)C[N@@H+](Cc3ccccc3)C2)c1 ZINC000034733612 570325866 /nfs/dbraw/zinc/32/58/66/570325866.db2.gz BPEQZQSWFLUXPW-PKTZIBPZSA-N 1 1 394.584 4.176 50 0 GIAAMO CC[C@H](C)c1ccccc1NC(=O)[C@@H](C)N1CC[NH+](Cc2ccccc2)CC1 ZINC000022773291 570327026 /nfs/dbraw/zinc/32/70/26/570327026.db2.gz DTKHTJQCLLDDIE-VQTJNVASSA-N 1 1 379.548 4.345 50 0 GIAAMO CCC(=O)N[C@@H](C)[C@H]1c2cc(OC)c(OC)cc2CC[N@H+]1Cc1cccc(C)c1 ZINC000034855636 570341481 /nfs/dbraw/zinc/34/14/81/570341481.db2.gz YZJIKPQOFXTLCO-XDHUDOTRSA-N 1 1 396.531 4.026 50 0 GIAAMO CCC(=O)N[C@@H](C)[C@H]1c2cc(OC)c(OC)cc2CC[N@@H+]1Cc1cccc(C)c1 ZINC000034855636 570341482 /nfs/dbraw/zinc/34/14/82/570341482.db2.gz YZJIKPQOFXTLCO-XDHUDOTRSA-N 1 1 396.531 4.026 50 0 GIAAMO COc1cccc(C[N@@H+]2CCC[C@@H]2c2ccc(C(=O)Nc3cc[nH]n3)s2)c1 ZINC000023231856 570351262 /nfs/dbraw/zinc/35/12/62/570351262.db2.gz KQBXYTDTKZANQK-MRXNPFEDSA-N 1 1 382.489 4.069 50 0 GIAAMO COc1cccc(C[N@H+]2CCC[C@@H]2c2ccc(C(=O)Nc3cc[nH]n3)s2)c1 ZINC000023231856 570351265 /nfs/dbraw/zinc/35/12/65/570351265.db2.gz KQBXYTDTKZANQK-MRXNPFEDSA-N 1 1 382.489 4.069 50 0 GIAAMO Cc1nn(CC(C)C)c(Cl)c1CNC[C@H](c1cccs1)[NH+]1CCCC1 ZINC000023257828 570353073 /nfs/dbraw/zinc/35/30/73/570353073.db2.gz JSKJSVDGSRABIH-QGZVFWFLSA-N 1 1 380.989 4.489 50 0 GIAAMO O=C(C[NH+]1CCCCC1)N1N=C2c3ccccc3CC[C@H]2[C@@H]1c1ccc(F)cc1 ZINC000004335052 570368963 /nfs/dbraw/zinc/36/89/63/570368963.db2.gz YLABMUXTANIIBN-QPPBQGQZSA-N 1 1 391.490 4.162 50 0 GIAAMO CC(C)[N@@H+](CC(=O)N1CCS[C@@H]1c1ccc(F)cc1)Cc1cccc(F)c1 ZINC000004924032 570370426 /nfs/dbraw/zinc/37/04/26/570370426.db2.gz YOQAXYYYVLHODR-OAQYLSRUSA-N 1 1 390.499 4.449 50 0 GIAAMO CC(C)n1nccc1NC(=O)[C@H](C)[NH+]1CCC(c2nc3ccccc3s2)CC1 ZINC000023828791 570373279 /nfs/dbraw/zinc/37/32/79/570373279.db2.gz RSRUCDQHADDXMP-HNNXBMFYSA-N 1 1 397.548 4.280 50 0 GIAAMO COc1cc(OC)c(OC)cc1C[NH2+][C@@H](C)c1ccccc1Br ZINC000022777505 570377211 /nfs/dbraw/zinc/37/72/11/570377211.db2.gz WRKBCCFCPPTFCE-LBPRGKRZSA-N 1 1 380.282 4.326 50 0 GIAAMO C[C@@H](CCc1ccc2c(c1)OCO2)[NH2+][C@@H](C)c1noc(Cc2ccccc2)n1 ZINC000165385684 570382183 /nfs/dbraw/zinc/38/21/83/570382183.db2.gz VISHCEUPQKJTTJ-HOTGVXAUSA-N 1 1 379.460 4.061 50 0 GIAAMO CCOC(=O)c1c(NC(=O)[C@@H](C)n2cc(C)[nH+]c2C)sc2c1CC[C@H](C)C2 ZINC000024762312 570392284 /nfs/dbraw/zinc/39/22/84/570392284.db2.gz FSXMNEHSJGMBFW-WCQYABFASA-N 1 1 389.521 4.063 50 0 GIAAMO CCOC(=O)c1c(NC(=O)[C@H](C)n2cc(C)[nH+]c2C)sc2c1CC[C@@H](C)C2 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390.487 4.150 50 0 GIAAMO Cc1[nH+]ccn1-c1ccccc1CNC(=O)N(C)Cc1csc(C(C)C)n1 ZINC000426623387 570502624 /nfs/dbraw/zinc/50/26/24/570502624.db2.gz XZNLAVCUYQALIG-UHFFFAOYSA-N 1 1 383.521 4.102 50 0 GIAAMO Cc1ccc(C[N@@H+](C[C@H](O)COc2ccccc2C)C[C@H]2CCCO2)c(C)c1 ZINC000036031195 570517767 /nfs/dbraw/zinc/51/77/67/570517767.db2.gz ZBCWLNGVSAPTBY-XZOQPEGZSA-N 1 1 383.532 4.033 50 0 GIAAMO Cc1cc2c(cc1C)[C@@H]([N@H+](CC(=O)N(C)c1nccs1)C1CC1)CCCO2 ZINC000072309436 570532029 /nfs/dbraw/zinc/53/20/29/570532029.db2.gz WJSVEKWLWGCAGN-SFHVURJKSA-N 1 1 385.533 4.101 50 0 GIAAMO Cc1cc2c(cc1C)[C@@H]([N@@H+](CC(=O)N(C)c1nccs1)C1CC1)CCCO2 ZINC000072309436 570532033 /nfs/dbraw/zinc/53/20/33/570532033.db2.gz WJSVEKWLWGCAGN-SFHVURJKSA-N 1 1 385.533 4.101 50 0 GIAAMO COc1ccc(C[N@H+](Cc2ccccc2)C[C@@H](O)COc2ccccc2)cc1 ZINC000036102153 570539177 /nfs/dbraw/zinc/53/91/77/570539177.db2.gz IXLUWGVOSKWYMK-JOCHJYFZSA-N 1 1 377.484 4.137 50 0 GIAAMO COc1ccc(C(=O)c2c[nH+]c3cc4c(cc3c2N2CCCCC2)OCO4)cc1 ZINC000036102789 570539732 /nfs/dbraw/zinc/53/97/32/570539732.db2.gz XFVFHWULZBGXNU-UHFFFAOYSA-N 1 1 390.439 4.193 50 0 GIAAMO CC[C@H](O)C[N@H+](Cc1ccc(F)cc1)C[C@@H]1CC(c2ccc(Cl)cc2)=NO1 ZINC000036146322 570548919 /nfs/dbraw/zinc/54/89/19/570548919.db2.gz UUXLYPPOFPHERF-PMACEKPBSA-N 1 1 390.886 4.245 50 0 GIAAMO C[C@H](OCc1ccccc1)C(=O)NC[C@@H](c1cccc(Cl)c1)[NH+]1CCCC1 ZINC000040089240 570550199 /nfs/dbraw/zinc/55/01/99/570550199.db2.gz KOHGZBRGMGKVDC-UWJYYQICSA-N 1 1 386.923 4.198 50 0 GIAAMO COc1ccc([C@@H]2c3cc4c(cc3O[C@@](C)([NH+]3CCCC3)[C@@H]2C)OCO4)cc1 ZINC000035361730 570551981 /nfs/dbraw/zinc/55/19/81/570551981.db2.gz HIXCOBNUFVJSMU-DURYTUKUSA-N 1 1 381.472 4.396 50 0 GIAAMO COC(=O)c1ccc(C[N@H+]2CCC[C@](CO)(CCCc3ccccc3)C2)cc1 ZINC000039364267 570589931 /nfs/dbraw/zinc/58/99/31/570589931.db2.gz NKXXXDAQXNEFMC-XMMPIXPASA-N 1 1 381.516 4.071 50 0 GIAAMO Cc1c2cc(Br)ccc2oc1C(=O)NC[C@@H](c1ccco1)[NH+](C)C ZINC000005451901 570597414 /nfs/dbraw/zinc/59/74/14/570597414.db2.gz DHCAQXFOJBKFDK-AWEZNQCLSA-N 1 1 391.265 4.129 50 0 GIAAMO COc1ccccc1C(=O)[C@H]1CCC[N@@H+](Cc2ccc(OC(F)F)cc2)C1 ZINC000012057433 570603072 /nfs/dbraw/zinc/60/30/72/570603072.db2.gz OCUCFKRRXPCRKO-INIZCTEOSA-N 1 1 375.415 4.392 50 0 GIAAMO COc1cc([C@@H]2C[C@H]3CN(Cc4ccccc4C)C(=O)[C@]34CCC[N@@H+]24)ccc1F ZINC000012058213 570603524 /nfs/dbraw/zinc/60/35/24/570603524.db2.gz QMRSGQNAAQOORD-PTLVVNQVSA-N 1 1 394.490 4.081 50 0 GIAAMO CC(C)(C)OC(=O)N[C@@H]1C[N@H+](Cc2cccc(Cl)n2)C[C@H]1c1ccccc1 ZINC000225733902 570610723 /nfs/dbraw/zinc/61/07/23/570610723.db2.gz GQNHTXPXMZWUTE-ZWKOTPCHSA-N 1 1 387.911 4.228 50 0 GIAAMO CC(C)(C)OC(=O)N[C@@H]1C[N@@H+](Cc2cccc(Cl)n2)C[C@H]1c1ccccc1 ZINC000225733902 570610725 /nfs/dbraw/zinc/61/07/25/570610725.db2.gz GQNHTXPXMZWUTE-ZWKOTPCHSA-N 1 1 387.911 4.228 50 0 GIAAMO CC1CC[NH+](CC(=O)N2N=C(c3ccc(F)cc3)C[C@@H]2c2ccccc2F)CC1 ZINC000036341466 570626014 /nfs/dbraw/zinc/62/60/14/570626014.db2.gz KBTYRSYWCQBUEK-JOCHJYFZSA-N 1 1 397.469 4.374 50 0 GIAAMO CCOc1ccc([C@@H]2CC(c3ccccc3)=NN2C(=O)C[NH+]2CCCCC2)cc1 ZINC000036344066 570626545 /nfs/dbraw/zinc/62/65/45/570626545.db2.gz ICCSKOPWADFSQL-QHCPKHFHSA-N 1 1 391.515 4.249 50 0 GIAAMO O=C(NCCCc1ccccc1)C1CC[NH+](Cc2c(F)cccc2Cl)CC1 ZINC000044909293 570642490 /nfs/dbraw/zinc/64/24/90/570642490.db2.gz MPSDQHDYELTDNA-UHFFFAOYSA-N 1 1 388.914 4.440 50 0 GIAAMO CC[N@H+]1CCC[C@@H]1CNC(=S)N[C@@H](c1cccs1)c1ccc2c(c1)CCC2 ZINC000229583243 570665454 /nfs/dbraw/zinc/66/54/54/570665454.db2.gz WRTUEGUHJIBRCH-TZIWHRDSSA-N 1 1 399.629 4.275 50 0 GIAAMO O=C(NC[C@@H](c1ccccc1Cl)[NH+]1CCCC1)c1ccc(Br)o1 ZINC000033028450 570666123 /nfs/dbraw/zinc/66/61/23/570666123.db2.gz YLEMNEHTZZRBDA-AWEZNQCLSA-N 1 1 397.700 4.262 50 0 GIAAMO CCOc1ccc(NC(=O)N2CCC[C@H](C[N@H+]3CCc4ccccc4C3)C2)cc1 ZINC000006877397 570668524 /nfs/dbraw/zinc/66/85/24/570668524.db2.gz PQAJVRNODHZPTH-LJQANCHMSA-N 1 1 393.531 4.388 50 0 GIAAMO Cc1ccccc1[C@@H](C)NC(=O)C[N@@H+]1CCC[C@H]1c1ccc2c(c1)OCCCO2 ZINC000036420460 570699224 /nfs/dbraw/zinc/69/92/24/570699224.db2.gz KWOYVXFZQXERPH-NQIIRXRSSA-N 1 1 394.515 4.171 50 0 GIAAMO Cc1ccccc1[C@@H](C)NC(=O)C[N@H+]1CCC[C@H]1c1ccc2c(c1)OCCCO2 ZINC000036420460 570699226 /nfs/dbraw/zinc/69/92/26/570699226.db2.gz KWOYVXFZQXERPH-NQIIRXRSSA-N 1 1 394.515 4.171 50 0 GIAAMO O=C(Nc1ccccc1O)C1CC[NH+](Cc2csc(-c3ccsc3)n2)CC1 ZINC000012795374 570715634 /nfs/dbraw/zinc/71/56/34/570715634.db2.gz OEEMABNAGKVGQE-UHFFFAOYSA-N 1 1 399.541 4.428 50 0 GIAAMO Cc1ccc(C)c(NC(=O)[C@H]2CCC[N@H+](Cc3nc4ccccc4n3C)C2)c1 ZINC000247720475 570715711 /nfs/dbraw/zinc/71/57/11/570715711.db2.gz ABMIQOSLPJOBGB-SFHVURJKSA-N 1 1 376.504 4.041 50 0 GIAAMO Cc1ccccc1[C@@H]1CC(=O)N(C[N@@H+]2CCC[C@H](c3nc4ccccc4o3)C2)C1 ZINC000058175412 570716370 /nfs/dbraw/zinc/71/63/70/570716370.db2.gz OBOFGLUVINSUBG-RBUKOAKNSA-N 1 1 389.499 4.289 50 0 GIAAMO Cc1ccccc1[C@@H]1CC(=O)N(C[N@H+]2CCC[C@H](c3nc4ccccc4o3)C2)C1 ZINC000058175412 570716373 /nfs/dbraw/zinc/71/63/73/570716373.db2.gz OBOFGLUVINSUBG-RBUKOAKNSA-N 1 1 389.499 4.289 50 0 GIAAMO COc1ccc(C[NH2+]Cc2nn(Cc3ccccc3)nc2-c2ccccc2)cc1 ZINC000247870289 570716555 /nfs/dbraw/zinc/71/65/55/570716555.db2.gz CTGPKTPSKBKWTC-UHFFFAOYSA-N 1 1 384.483 4.292 50 0 GIAAMO CCCN(C(=O)[C@H]1CCC[N@@H+](Cc2nc3ccccc3n2C(C)C)C1)C(C)C ZINC000247963273 570717862 /nfs/dbraw/zinc/71/78/62/570717862.db2.gz ALYLIGSAMHRUAB-IBGZPJMESA-N 1 1 384.568 4.476 50 0 GIAAMO CCCc1ccc(NC(=O)[C@H]2CCC[N@H+](Cc3nc4ccccc4n3C)C2)cc1 ZINC000248094391 570721030 /nfs/dbraw/zinc/72/10/30/570721030.db2.gz XEKWTTPJTXZFDL-IBGZPJMESA-N 1 1 390.531 4.377 50 0 GIAAMO CCCc1ccc(NC(=O)[C@H]2CCC[N@@H+](Cc3nc4ccccc4n3C)C2)cc1 ZINC000248094391 570721032 /nfs/dbraw/zinc/72/10/32/570721032.db2.gz XEKWTTPJTXZFDL-IBGZPJMESA-N 1 1 390.531 4.377 50 0 GIAAMO CCCCN(CCCC)C(=O)[C@@H]1CCC[N@@H+](Cc2nc3ccccc3n2C)C1 ZINC000248097100 570721038 /nfs/dbraw/zinc/72/10/38/570721038.db2.gz YIEUHINYTOONIV-LJQANCHMSA-N 1 1 384.568 4.214 50 0 GIAAMO CCc1cc2oc(=O)cc(C[N@@H+](C)Cc3ccc4c(c3)OCO4)c2cc1Cl ZINC000032738521 570790319 /nfs/dbraw/zinc/79/03/19/570790319.db2.gz FOEXQGWBHPKMGI-UHFFFAOYSA-N 1 1 385.847 4.370 50 0 GIAAMO CC(C)[N@@H+](CC(=O)N1CCS[C@H]1c1ccc(F)cc1)Cc1ccc(F)cc1 ZINC000004461248 570793350 /nfs/dbraw/zinc/79/33/50/570793350.db2.gz XRYASJUYPLKJGD-NRFANRHFSA-N 1 1 390.499 4.449 50 0 GIAAMO O=C(NCCC[N@H+]1CCO[C@H](c2ccccc2)C1)c1ccc(Cl)cc1Cl ZINC000036699955 570794722 /nfs/dbraw/zinc/79/47/22/570794722.db2.gz QNJDYKYVGYHOOF-IBGZPJMESA-N 1 1 393.314 4.187 50 0 GIAAMO O=C(NCCC[N@@H+]1CCO[C@H](c2ccccc2)C1)c1ccc(Cl)cc1Cl ZINC000036699955 570794718 /nfs/dbraw/zinc/79/47/18/570794718.db2.gz QNJDYKYVGYHOOF-IBGZPJMESA-N 1 1 393.314 4.187 50 0 GIAAMO Cc1cc(C)c(C(=O)NCCCC[N@@H+]2CCO[C@@H](c3ccccc3)C2)c(C)c1 ZINC000036700095 570794841 /nfs/dbraw/zinc/79/48/41/570794841.db2.gz YTFDGRRDUWEXFH-JOCHJYFZSA-N 1 1 380.532 4.195 50 0 GIAAMO Cc1cc(C)c(C(=O)NCCCC[N@H+]2CCO[C@@H](c3ccccc3)C2)c(C)c1 ZINC000036700095 570794844 /nfs/dbraw/zinc/79/48/44/570794844.db2.gz YTFDGRRDUWEXFH-JOCHJYFZSA-N 1 1 380.532 4.195 50 0 GIAAMO CC[NH+]1CCN(C(=O)Cc2c3ccccc3[nH]c2Sc2ccccc2)CC1 ZINC000033116292 570814130 /nfs/dbraw/zinc/81/41/30/570814130.db2.gz FJZSUDGHFMIFNF-UHFFFAOYSA-N 1 1 379.529 4.026 50 0 GIAAMO CC(C)[C@@H](C)[N@@H+](CC(=O)Nc1ccccc1C(=O)NCc1ccccc1)C1CC1 ZINC000032825568 570839896 /nfs/dbraw/zinc/83/98/96/570839896.db2.gz SFRMHSHOOOHJHY-GOSISDBHSA-N 1 1 393.531 4.064 50 0 GIAAMO CC(=O)Nc1ccc2c(C[N@@H+](C)Cc3ccc([C@@H]4C[C@@H]4C)o3)cc(=O)oc2c1 ZINC000032844974 570852291 /nfs/dbraw/zinc/85/22/91/570852291.db2.gz GSQMQZZPHYUAPL-ORAYPTAESA-N 1 1 380.444 4.100 50 0 GIAAMO CC(=O)Nc1ccc2c(C[N@H+](C)Cc3ccc([C@@H]4C[C@@H]4C)o3)cc(=O)oc2c1 ZINC000032844974 570852297 /nfs/dbraw/zinc/85/22/97/570852297.db2.gz GSQMQZZPHYUAPL-ORAYPTAESA-N 1 1 380.444 4.100 50 0 GIAAMO C[C@@H](c1nc2ccccc2n1C(F)F)N1CC[NH+](Cc2cccs2)CC1 ZINC000096983480 570885244 /nfs/dbraw/zinc/88/52/44/570885244.db2.gz CZGRUGKJPKNWPS-AWEZNQCLSA-N 1 1 376.476 4.372 50 0 GIAAMO COc1ccc(-c2[nH]c(SCCN3CCOCC3)nc2-c2ccccc2)cc1 ZINC000013233452 570886055 /nfs/dbraw/zinc/88/60/55/570886055.db2.gz KVJLFUNXQLJGEN-UHFFFAOYSA-N 1 1 395.528 4.177 50 0 GIAAMO O=C(Nc1ccc(C2CCCCC2)cc1)N1CC[N@@H+](CC2CC2)[C@@H](CCO)C1 ZINC000299771768 570894044 /nfs/dbraw/zinc/89/40/44/570894044.db2.gz WZUDIPINCCFBTO-QFIPXVFZSA-N 1 1 385.552 4.045 50 0 GIAAMO COc1ccc(CC(=O)Nc2cc(C(F)(F)F)ccc2-n2cc[nH+]c2C)cc1 ZINC000097112517 570895530 /nfs/dbraw/zinc/89/55/30/570895530.db2.gz LKDAWWFUARKHNM-UHFFFAOYSA-N 1 1 389.377 4.389 50 0 GIAAMO O=C(C[N@H+](Cc1cccc(-c2cccnc2)c1)C1CC1)Nc1ccccc1F ZINC000089814123 570915824 /nfs/dbraw/zinc/91/58/24/570915824.db2.gz FZOGHFRXDQEBOD-UHFFFAOYSA-N 1 1 375.447 4.491 50 0 GIAAMO O=C(C[N@@H+](Cc1cccc(-c2cccnc2)c1)C1CC1)Nc1ccccc1F ZINC000089814123 570915825 /nfs/dbraw/zinc/91/58/25/570915825.db2.gz FZOGHFRXDQEBOD-UHFFFAOYSA-N 1 1 375.447 4.491 50 0 GIAAMO COc1nc2ccccc2cc1-c1cccc(C(=O)NCC[C@@H]2CCC[N@H+]2C)c1 ZINC000534649387 570917783 /nfs/dbraw/zinc/91/77/83/570917783.db2.gz QXOHBQHQRRPSKO-FQEVSTJZSA-N 1 1 389.499 4.125 50 0 GIAAMO Fc1ccc(-c2cnc(C[N@H+]3CCC[C@@H]3Cn3cnc4ccccc43)o2)cc1 ZINC000089878677 570918332 /nfs/dbraw/zinc/91/83/32/570918332.db2.gz UBFLYVRTCONTRR-GOSISDBHSA-N 1 1 376.435 4.495 50 0 GIAAMO C[C@@H]1CCC[N@@H+](CCOCCOc2ccc(Br)cc2Cl)C1 ZINC000002821977 570933277 /nfs/dbraw/zinc/93/32/77/570933277.db2.gz ZSSRJISHTMTSOJ-CYBMUJFWSA-N 1 1 376.722 4.230 50 0 GIAAMO COc1c2c(cc3c1[C@@H](C[C@H](O)c1ccc(CC(C)C)cc1)[N@@H+](C)CC3)OCO2 ZINC000002087335 570937577 /nfs/dbraw/zinc/93/75/77/570937577.db2.gz OVAVSXLWDUCRCT-UXHICEINSA-N 1 1 397.515 4.275 50 0 GIAAMO C[C@H]1CCCC[N@H+]1CCCCNC(=O)C1(c2ccc(Br)cc2)CC1 ZINC000046988668 570937855 /nfs/dbraw/zinc/93/78/55/570937855.db2.gz MIIMBQUBQYUXTG-INIZCTEOSA-N 1 1 393.369 4.252 50 0 GIAAMO C[C@@H]1C[C@@H]1c1ccc(CCC(=O)NC[C@H]2CCC[N@@H+](Cc3cccs3)C2)o1 ZINC000252193017 570953865 /nfs/dbraw/zinc/95/38/65/570953865.db2.gz VDWLYYQKNNUWEP-HLIPFELVSA-N 1 1 386.561 4.426 50 0 GIAAMO C[C@H](C(=O)c1c[nH]c2ccccc12)[N@@H+]1CCC[C@H]1c1ccc2c(c1)OCCO2 ZINC000252444155 570957222 /nfs/dbraw/zinc/95/72/22/570957222.db2.gz GNHGHQQJEIYMIO-QRWLVFNGSA-N 1 1 376.456 4.347 50 0 GIAAMO C[C@H](C(=O)c1c[nH]c2ccccc12)[N@H+]1CCC[C@H]1c1ccc2c(c1)OCCO2 ZINC000252444155 570957224 /nfs/dbraw/zinc/95/72/24/570957224.db2.gz GNHGHQQJEIYMIO-QRWLVFNGSA-N 1 1 376.456 4.347 50 0 GIAAMO Cc1ccc2c(c1)c1ncnc(N3CC[NH+](C/C=C/c4ccccc4)CC3)c1n2C ZINC000002201937 571001095 /nfs/dbraw/zinc/00/10/95/571001095.db2.gz BKTVEQMNMYWKIW-RMKNXTFCSA-N 1 1 397.526 4.265 50 0 GIAAMO CCCn1c(C(=O)N2CC[NH+](Cc3ccccc3)CC2)cc2sc(C)cc21 ZINC000037541925 571029572 /nfs/dbraw/zinc/02/95/72/571029572.db2.gz KGLXPGARISZMIV-UHFFFAOYSA-N 1 1 381.545 4.379 50 0 GIAAMO COc1ccccc1NC(=O)N1C[C@H]2CC[C@@H]1C[N@@H+](CCCc1ccccc1)C2 ZINC000092099463 571044735 /nfs/dbraw/zinc/04/47/35/571044735.db2.gz PHNKSUHILCWLQA-LEWJYISDSA-N 1 1 393.531 4.256 50 0 GIAAMO O=C(NC1CC1)[C@@H](c1ccccc1)[N@@H+]1CCC[C@H]1c1ccc2c(c1)OCCCO2 ZINC000247743959 571048612 /nfs/dbraw/zinc/04/86/12/571048612.db2.gz PJFQPIXXJSCBHA-NZQKXSOJSA-N 1 1 392.499 4.005 50 0 GIAAMO O=C(NC1CC1)[C@@H](c1ccccc1)[N@H+]1CCC[C@H]1c1ccc2c(c1)OCCCO2 ZINC000247743959 571048614 /nfs/dbraw/zinc/04/86/14/571048614.db2.gz PJFQPIXXJSCBHA-NZQKXSOJSA-N 1 1 392.499 4.005 50 0 GIAAMO Clc1cccc2ccc(CN3C[C@H]4CC[C@@H]3C[N@@H+](Cc3cccnc3)C4)nc12 ZINC000095367857 571059372 /nfs/dbraw/zinc/05/93/72/571059372.db2.gz NCXWKHXUVYHXHJ-GHTZIAJQSA-N 1 1 392.934 4.380 50 0 GIAAMO Clc1cccc2ccc(C[N@@H+]3C[C@H]4CC[C@@H]3CN(Cc3cccnc3)C4)nc12 ZINC000095367857 571059375 /nfs/dbraw/zinc/05/93/75/571059375.db2.gz NCXWKHXUVYHXHJ-GHTZIAJQSA-N 1 1 392.934 4.380 50 0 GIAAMO Clc1cccc2ccc(C[N@H+]3C[C@H]4CC[C@@H]3CN(Cc3cccnc3)C4)nc12 ZINC000095367857 571059377 /nfs/dbraw/zinc/05/93/77/571059377.db2.gz NCXWKHXUVYHXHJ-GHTZIAJQSA-N 1 1 392.934 4.380 50 0 GIAAMO CCN(CCc1nc2ccc(C)cc2[nH]1)C(=O)c1ccc([C@@H]2CCC[NH2+]C2)cc1 ZINC000095370622 571060823 /nfs/dbraw/zinc/06/08/23/571060823.db2.gz WNPAZGSVAVJHGX-HXUWFJFHSA-N 1 1 390.531 4.043 50 0 GIAAMO O=C(c1c(F)cccc1Cl)N1C[C@H]2CC[C@@H]1C[N@@H+](Cc1ccc(F)cc1)C2 ZINC000095374641 571063387 /nfs/dbraw/zinc/06/33/87/571063387.db2.gz WRIMYRZMOQUJDG-DOTOQJQBSA-N 1 1 390.861 4.355 50 0 GIAAMO