smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CCOC(=O)[C@]12CCO[C@H]1CCN(c1nc(C[NH+]3CCCC3)nc3sc(C)c(C)c31)C2 ZINC001164434707 718978929 /nfs/dbraw/zinc/97/89/29/718978929.db2.gz VEDUAHXUIGKJFI-SBUREZEXSA-N 1 1 444.601 3.452 20 0 IGADMO CCOC(=O)C1CCN(c2ccc(N3CCC[C@H]4C[N@@H+](Cc5ccccc5)C[C@H]43)nn2)CC1 ZINC001164629068 719087473 /nfs/dbraw/zinc/08/74/73/719087473.db2.gz QTFGMHYFBSATJF-XZOQPEGZSA-N 1 1 449.599 3.357 20 0 IGADMO CC1(C)NC(=O)N(Cc2ccc(N3CCC[C@@H]4C[N@@H+](Cc5ccccc5)C[C@H]43)nc2)C1=O ZINC001164630414 719100717 /nfs/dbraw/zinc/10/07/17/719100717.db2.gz WEWLGCQUXFVYED-NHCUHLMSSA-N 1 1 433.556 3.013 20 0 IGADMO CC1CC[NH+](Cc2nc3scc(-c4cccs4)c3c(N(C)C[C@@H](O)CO)n2)CC1 ZINC001164670058 719366172 /nfs/dbraw/zinc/36/61/72/719366172.db2.gz SMBQKRVAFJSEIR-OAHLLOKOSA-N 1 1 432.615 3.441 20 0 IGADMO C[N@H+]1CCO[C@@H]2CN(c3nc(CN4CCCCC4)nc4sc5c(c43)CCCC5)C[C@@H]21 ZINC001164675190 719441628 /nfs/dbraw/zinc/44/16/28/719441628.db2.gz ZMXNDFCLNPVMDT-ZWKOTPCHSA-N 1 1 427.618 3.075 20 0 IGADMO CNC(=O)C[N@H+]1CCCC12CCN(c1nc(-c3cccc(OC)c3)nc3ccccc31)CC2 ZINC001164689845 719747409 /nfs/dbraw/zinc/74/74/09/719747409.db2.gz LSCATZPJMXEDCX-UHFFFAOYSA-N 1 1 445.567 3.486 20 0 IGADMO O=C1C[C@@H]2[C@@H](CCN2c2ccc3c(n2)CC[N@H+](Cc2ccccc2)C3)N1Cc1cccnc1 ZINC001164691058 719765456 /nfs/dbraw/zinc/76/54/56/719765456.db2.gz KQOGXBLAKPNRRY-JWQCQUIFSA-N 1 1 439.563 3.415 20 0 IGADMO CCOC(=O)c1nnc(SC)nc1N1CCC2(CCC[N@H+]2Cc2csc(C)n2)CC1 ZINC001164692576 719806537 /nfs/dbraw/zinc/80/65/37/719806537.db2.gz JVIRHJJZPDYJPO-UHFFFAOYSA-N 1 1 448.618 3.170 20 0 IGADMO COC(=O)[C@]1(C)C[C@@H]([NH+]2CCOCC2)CCN1c1nc(Cl)ncc1-c1ccccc1 ZINC001164705614 719855437 /nfs/dbraw/zinc/85/54/37/719855437.db2.gz UUQGDXBOUDXTCZ-JTSKRJEESA-N 1 1 430.936 3.030 20 0 IGADMO COC(=O)[C@@]1(C)C[C@H]([NH+]2CCOCC2)CCN1c1nc(N2CCCC2)cc2ccccc21 ZINC001164707611 719870837 /nfs/dbraw/zinc/87/08/37/719870837.db2.gz UKCDDEZOXQBLLI-CJFMBICVSA-N 1 1 438.572 3.068 20 0 IGADMO COC(=O)[C@@]1(C)C[C@@H]([NH+]2CCOCC2)CCN1c1nnc(Cl)c2ccc(Cl)cc21 ZINC001164708218 719874362 /nfs/dbraw/zinc/87/43/62/719874362.db2.gz YRKPOTVUNWVLHW-VBKZILBWSA-N 1 1 439.343 3.169 20 0 IGADMO COC(=O)c1c[nH]c2nc(N3CCC4(CC3)C[N@@H+](Cc3cccs3)CCO4)ccc12 ZINC001164695268 719889854 /nfs/dbraw/zinc/88/98/54/719889854.db2.gz KOPGHVNVTSMUKW-UHFFFAOYSA-N 1 1 426.542 3.282 20 0 IGADMO COCCn1ccc2c1ncnc2N1CCC2(CC1)C[N@@H+](Cc1cccs1)CCO2 ZINC001164698401 719893715 /nfs/dbraw/zinc/89/37/15/719893715.db2.gz SHIUBFDEYBMVTP-UHFFFAOYSA-N 1 1 427.574 3.011 20 0 IGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(C(F)(F)c1ccc(C(=O)OC)c(Cl)n1)C2 ZINC001164813075 720091096 /nfs/dbraw/zinc/09/10/96/720091096.db2.gz SDKYRFXAKYIHJY-QRWLVFNGSA-N 1 1 443.922 3.251 20 0 IGADMO COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1ccc(Cl)c(C(=O)OC)n1)CC2 ZINC001164719678 720116326 /nfs/dbraw/zinc/11/63/26/720116326.db2.gz ZWXIXUKCQVNWRA-SFHVURJKSA-N 1 1 444.963 3.424 20 0 IGADMO CCOC(=O)c1cc(C)cnc1N1CCC2(C[C@@H](COC)[N@@H+](Cc3ccccn3)C2)CC1 ZINC001164718649 720118703 /nfs/dbraw/zinc/11/87/03/720118703.db2.gz UIQFNQGKTAHPJL-NRFANRHFSA-N 1 1 438.572 3.469 20 0 IGADMO CCOC(=O)c1cc(N2CCC3(C[C@H](COC)[N@@H+](Cc4ccccn4)C3)CC2)ncc1C ZINC001164717381 720121957 /nfs/dbraw/zinc/12/19/57/720121957.db2.gz OCSPDZXCVKWQPB-OAQYLSRUSA-N 1 1 438.572 3.469 20 0 IGADMO COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1nccc(N3CCCCC3)n1)CC2 ZINC001164714158 720128466 /nfs/dbraw/zinc/12/84/66/720128466.db2.gz WMYBDFHKTAEMGC-QFIPXVFZSA-N 1 1 436.604 3.369 20 0 IGADMO COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1ccnc(N3CCCCC3)n1)CC2 ZINC001164711741 720138384 /nfs/dbraw/zinc/13/83/84/720138384.db2.gz JDKDWXVVNWAKHO-QFIPXVFZSA-N 1 1 436.604 3.369 20 0 IGADMO COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1cc(-c3ccccn3)ncn1)CC2 ZINC001164714790 720144985 /nfs/dbraw/zinc/14/49/85/720144985.db2.gz ZBXCSYVEMBEOGV-OAQYLSRUSA-N 1 1 430.556 3.441 20 0 IGADMO COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1ccc(-c3ccccn3)nn1)CC2 ZINC001164714394 720148541 /nfs/dbraw/zinc/14/85/41/720148541.db2.gz WVWXNVABNHKWOU-NRFANRHFSA-N 1 1 430.556 3.441 20 0 IGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(C(F)(F)c1cnc3c(Cl)ncnc3c1)C2 ZINC001164818010 720153261 /nfs/dbraw/zinc/15/32/61/720153261.db2.gz REPNNYZTXQZADO-OXQOHEQNSA-N 1 1 437.922 3.408 20 0 IGADMO CCOC(=O)Cc1ccnc(N2CCC3(C[C@H](COC)[N@@H+](Cc4ccccn4)C3)CC2)c1 ZINC001164715083 720156328 /nfs/dbraw/zinc/15/63/28/720156328.db2.gz SNWPMFUZQAZCGT-JOCHJYFZSA-N 1 1 438.572 3.090 20 0 IGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1ccc(-c3ccc(OC)cc3OC)nn1)C2 ZINC001164817382 720181960 /nfs/dbraw/zinc/18/19/60/720181960.db2.gz PDWRPKORYSMPPU-UQBPGWFLSA-N 1 1 438.572 3.346 20 0 IGADMO CC(C)[N@@H+](C)Cc1cc(=O)n2c(n1)CN(c1nnc(Cl)c3ccc(F)cc31)CCC2 ZINC001164812901 720242163 /nfs/dbraw/zinc/24/21/63/720242163.db2.gz KDHYDKMQHITMIU-UHFFFAOYSA-N 1 1 430.915 3.230 20 0 IGADMO CC(=O)NC[C@H]1c2ncn(C(C)C)c2CCN1c1nc(Cl)ccc1C[NH+]1CCCC1 ZINC001164721907 720314678 /nfs/dbraw/zinc/31/46/78/720314678.db2.gz IVFFYEQCVXKFDA-IBGZPJMESA-N 1 1 430.984 3.348 20 0 IGADMO CCOC(=O)c1cnc(C(F)(F)N2CC[C@@H]3[C@@H]2CC[N@@H+]3Cc2cccnc2)nc1Cl ZINC001164724934 720336616 /nfs/dbraw/zinc/33/66/16/720336616.db2.gz LVFHTXSDGUFFIE-CVEARBPZSA-N 1 1 437.878 3.100 20 0 IGADMO CCOC(=O)c1cnc(C(F)(F)N2CC[C@@H]3[C@@H]2CC[N@H+]3Cc2cccnc2)nc1Cl ZINC001164724934 720336618 /nfs/dbraw/zinc/33/66/18/720336618.db2.gz LVFHTXSDGUFFIE-CVEARBPZSA-N 1 1 437.878 3.100 20 0 IGADMO Cc1nc(CO[C@@H]2CN(c3cc(OC4CC[NH+](C)CC4)ccn3)[C@H]3CCCO[C@@H]23)cs1 ZINC001164821775 720393083 /nfs/dbraw/zinc/39/30/83/720393083.db2.gz IMKQLUQPAIDVJQ-QZNHQXDQSA-N 1 1 444.601 3.273 20 0 IGADMO CCOC(=O)c1cnc(Cl)cc1N1CC[C@@H]2[C@@H](C[C@H](Cn3cccn3)[N@H+]2C(C)C)C1 ZINC001164832397 720508007 /nfs/dbraw/zinc/50/80/07/720508007.db2.gz ANVCVBOONWODQO-YQVWRLOYSA-N 1 1 431.968 3.486 20 0 IGADMO CC(C)[N@@H+]1[C@@H]2CCN(c3nc(Cl)nc4c3CSCC4)C[C@H]2C[C@H]1Cn1cccn1 ZINC001164841755 720517324 /nfs/dbraw/zinc/51/73/24/720517324.db2.gz ZZFCNGXFBHHNAD-JTDSTZFVSA-N 1 1 433.025 3.494 20 0 IGADMO CCOC(=O)c1ccc2ncnc(N3CC[C@@H]4[C@H](C[C@H](Cn5cccn5)[N@H+]4C(C)C)C3)c2c1 ZINC001164834969 720545111 /nfs/dbraw/zinc/54/51/11/720545111.db2.gz GCYVRHCGWVUZEQ-TXTKFYIRSA-N 1 1 448.571 3.381 20 0 IGADMO COC(=O)c1c(Cl)cnc(N2CC[C@@H]3[C@H](C[C@H](Cn4cccn4)[N@H+]3C(C)C)C2)c1OC ZINC001164843102 720587355 /nfs/dbraw/zinc/58/73/55/720587355.db2.gz WJAXPIIAZGRQGW-JFIYKMOQSA-N 1 1 447.967 3.105 20 0 IGADMO CCOC(=O)c1cnc2cc(N3CC[C@@H]4[C@H](C[C@H](Cn5cccn5)[N@@H+]4C(C)C)C3)[nH]cc1-2 ZINC001164840826 720592187 /nfs/dbraw/zinc/59/21/87/720592187.db2.gz QYECULDINBRLIV-JBYIUTFZSA-N 1 1 436.560 3.314 20 0 IGADMO CCOC(=O)c1cnc2cc(N3CC[C@@H]4[C@H](C[C@H](Cn5cccn5)[N@H+]4C(C)C)C3)[nH]cc1-2 ZINC001164840826 720592190 /nfs/dbraw/zinc/59/21/90/720592190.db2.gz QYECULDINBRLIV-JBYIUTFZSA-N 1 1 436.560 3.314 20 0 IGADMO CSc1ccc(C(F)(F)N2CC[N@@H+]3C[C@@H](Oc4cncnc4)C[C@@H]3C2)nc1Cl ZINC001164739664 720714444 /nfs/dbraw/zinc/71/44/44/720714444.db2.gz OOGFNJLQSOOKGZ-OLZOCXBDSA-N 1 1 427.908 3.134 20 0 IGADMO CSc1ccc(C(F)(F)N2CC[N@H+]3C[C@@H](Oc4cncnc4)C[C@@H]3C2)nc1Cl ZINC001164739664 720714448 /nfs/dbraw/zinc/71/44/48/720714448.db2.gz OOGFNJLQSOOKGZ-OLZOCXBDSA-N 1 1 427.908 3.134 20 0 IGADMO C[N@@H+](Cc1ccccc1)[C@H]1COC2(C1)CCN(c1ccc(C(=O)NC3CCCC3)nn1)CC2 ZINC001164838199 720717854 /nfs/dbraw/zinc/71/78/54/720717854.db2.gz HDXSGBDGHANWDI-JOCHJYFZSA-N 1 1 449.599 3.409 20 0 IGADMO Fc1ccc(-c2nc(Cl)cc(N3CC[N@H+]4C[C@@H](Oc5cncnc5)C[C@@H]4C3)n2)cc1 ZINC001164738905 720774475 /nfs/dbraw/zinc/77/44/75/720774475.db2.gz GYEXXMRSCRMSRJ-SJORKVTESA-N 1 1 426.883 3.068 20 0 IGADMO Fc1ccc(-c2ccc(Cl)nn2)c(N2CC[N@H+]3C[C@H](Oc4cncnc4)C[C@H]3C2)c1 ZINC001164741875 720780581 /nfs/dbraw/zinc/78/05/81/720780581.db2.gz NGAYRIOUFHXUAL-JKSUJKDBSA-N 1 1 426.883 3.068 20 0 IGADMO Cc1ccccc1Oc1nc(Cl)ncc1N1CC[N@H+]2C[C@@H](Oc3cncnc3)C[C@H]2C1 ZINC001164740709 720802903 /nfs/dbraw/zinc/80/29/03/720802903.db2.gz AFIBAXAIGFCHRT-IRXDYDNUSA-N 1 1 438.919 3.363 20 0 IGADMO Fc1ccc2nc(Cl)nc(N3CC[C@@H]4[C@@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)c2c1 ZINC001164745453 720814383 /nfs/dbraw/zinc/81/43/83/720814383.db2.gz KKCQGVPJKVKGFV-RIFZZMRRSA-N 1 1 441.942 3.393 20 0 IGADMO FC(F)(Oc1cccc(Cl)n1)N1CC[C@@H]2[C@H](C[C@@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164738788 720820908 /nfs/dbraw/zinc/82/09/08/720820908.db2.gz GNCWLIOVBBZFIV-IXDOHACOSA-N 1 1 438.910 3.131 20 0 IGADMO CCC[N@H+]1CCCC[C@@H]1c1ccc(N2CC[C@@H]3O[C@H](C(=O)N4CCCO4)CC[C@@H]32)nc1 ZINC001164848844 720822800 /nfs/dbraw/zinc/82/28/00/720822800.db2.gz NKVWGKLJAMYJJF-MLNNCEHLSA-N 1 1 428.577 3.309 20 0 IGADMO Fc1cc(C(F)(F)N2CC[C@@H]3[C@H](C[C@@H](Cn4cncn4)[N@H+]3CC3CC3)C2)cnc1Cl ZINC001164741555 720825587 /nfs/dbraw/zinc/82/55/87/720825587.db2.gz NXGQRVOKWLMURO-UWWQBHOKSA-N 1 1 440.901 3.390 20 0 IGADMO CCc1c(Cl)nnc(N2CC[C@@H]3[C@H](C[C@H](Cn4cncn4)[N@H+]3CC3CC3)C2)c1CC ZINC001164743292 720830035 /nfs/dbraw/zinc/83/00/35/720830035.db2.gz RYAOIVSEEREMPN-MBOZVWFJSA-N 1 1 430.000 3.226 20 0 IGADMO COc1cccc(-c2ccnc(N3CC[C@@H]4[C@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)n2)c1 ZINC001164748327 720838805 /nfs/dbraw/zinc/83/88/05/720838805.db2.gz UEUQAUIYFAEHCN-ZFGGDYGUSA-N 1 1 445.571 3.123 20 0 IGADMO Cc1c[nH]c2nc(Cl)cc(N3CC[C@@H]4[C@@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)c12 ZINC001164740013 720845183 /nfs/dbraw/zinc/84/51/83/720845183.db2.gz BMWQZTRJGFOWKP-RCCFBDPRSA-N 1 1 425.968 3.496 20 0 IGADMO Cc1ccc(-c2ccc(N3CC[C@@H]4[C@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)nn2)cc1 ZINC001164742481 720845267 /nfs/dbraw/zinc/84/52/67/720845267.db2.gz GSDYXLHRKXZCMS-AOHZBQACSA-N 1 1 429.572 3.423 20 0 IGADMO COc1ccc(-c2ccc(N3CC[C@@H]4[C@@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)nn2)cc1 ZINC001164745156 720846711 /nfs/dbraw/zinc/84/67/11/720846711.db2.gz LWFDSCZXVQFHRZ-YZUZCNPQSA-N 1 1 445.571 3.123 20 0 IGADMO Fc1ccc(-c2cc(N3CC[C@@H]4[C@@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)ncn2)cc1 ZINC001164745915 720850471 /nfs/dbraw/zinc/85/04/71/720850471.db2.gz OEGRYXYCTUGYGG-IEIRFRATSA-N 1 1 433.535 3.254 20 0 IGADMO Cc1nc(C2CC2)nc(Cl)c1N1CC[C@@H]2[C@H](C[C@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164747895 720850507 /nfs/dbraw/zinc/85/05/07/720850507.db2.gz RYDMKRMXJQYVAM-GUDVDZBRSA-N 1 1 427.984 3.287 20 0 IGADMO COCC[N@H+]1CCO[C@@H]2CN(C(F)(F)c3nc(Cl)c4cc(F)ccc4n3)CC[C@H]2C1 ZINC001164854849 720852785 /nfs/dbraw/zinc/85/27/85/720852785.db2.gz LERXIRNZFRRYKW-SUMWQHHRSA-N 1 1 444.885 3.141 20 0 IGADMO Fc1cnc(N2CC[C@@H]3[C@H](C[C@H](Cn4cncn4)[N@H+]3CC3CC3)C2)nc1-c1ccsc1 ZINC001164753600 720858172 /nfs/dbraw/zinc/85/81/72/720858172.db2.gz YOZAGVRUJKVXFE-QWFCFKBJSA-N 1 1 439.564 3.315 20 0 IGADMO Fc1cnc(N2CC[C@@H]3[C@@H](C[C@H](Cn4cncn4)[N@H+]3CC3CC3)C2)nc1-c1ccsc1 ZINC001164753599 720858281 /nfs/dbraw/zinc/85/82/81/720858281.db2.gz YOZAGVRUJKVXFE-NLWGTHIKSA-N 1 1 439.564 3.315 20 0 IGADMO CCOC(=O)c1c(Cl)c2ccccc2nc1N1CC[C@@H]2C[N@@H+](CCOC)CCO[C@@H]2C1 ZINC001164855160 720874071 /nfs/dbraw/zinc/87/40/71/720874071.db2.gz GKEGQYCJBZZVBM-VQIMIIECSA-N 1 1 447.963 3.238 20 0 IGADMO Cc1nc(N(C)C)cc(N2CC[C@]3(C2)C[N@H+](CC2CC2)C[C@@H]3COCc2cccnc2)n1 ZINC001164755897 720874455 /nfs/dbraw/zinc/87/44/55/720874455.db2.gz ZSPCCOGSXQLGMT-RCZVLFRGSA-N 1 1 436.604 3.001 20 0 IGADMO Cc1nc(N(C)C)cc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COCc2cccnc2)n1 ZINC001164755897 720874458 /nfs/dbraw/zinc/87/44/58/720874458.db2.gz ZSPCCOGSXQLGMT-RCZVLFRGSA-N 1 1 436.604 3.001 20 0 IGADMO c1cncc(COC[C@@H]2C[N@@H+](CC3CC3)C[C@]23CCN(c2ncnc4ncccc42)C3)c1 ZINC001164754512 720876290 /nfs/dbraw/zinc/87/62/90/720876290.db2.gz RZJNJKNKJVOZNS-OFVILXPXSA-N 1 1 430.556 3.175 20 0 IGADMO c1cncc(COC[C@@H]2C[N@@H+](CC3CC3)C[C@@]23CCN(c2ncnc4cccnc42)C3)c1 ZINC001164749034 720876367 /nfs/dbraw/zinc/87/63/67/720876367.db2.gz GHRQNWYHMDCNMQ-SQJMNOBHSA-N 1 1 430.556 3.175 20 0 IGADMO Cn1cnc2c1ccnc2N1CC[C@@]2(C1)C[N@@H+](CC1CC1)C[C@H]2COCc1cccnc1 ZINC001164752440 720876953 /nfs/dbraw/zinc/87/69/53/720876953.db2.gz NAFZGNSUEITDMN-OFVILXPXSA-N 1 1 432.572 3.118 20 0 IGADMO COCC[N@H+]1CCO[C@H]2CN(c3nc(C)nc4sc5c(c43)CCCCC5)CC[C@@H]2C1 ZINC001164862317 720877435 /nfs/dbraw/zinc/87/74/35/720877435.db2.gz ROTDFWSXAZBTLV-MJGOQNOKSA-N 1 1 430.618 3.442 20 0 IGADMO COCC[N@H+]1CCO[C@H]2CN(c3nc(C(F)F)nc4ccc(Cl)cc43)CC[C@@H]2C1 ZINC001164860818 720885954 /nfs/dbraw/zinc/88/59/54/720885954.db2.gz PEOORESARNYKGB-DYVFJYSZSA-N 1 1 426.895 3.394 20 0 IGADMO COCC[N@H+]1CCO[C@H]2CN(c3cnc(Cl)nc3Oc3ccccc3F)CC[C@@H]2C1 ZINC001164854388 720888734 /nfs/dbraw/zinc/88/87/34/720888734.db2.gz FFBXIEAUNXWMMM-BEFAXECRSA-N 1 1 436.915 3.235 20 0 IGADMO COCC[N@H+]1CCO[C@@H]2CN(c3cnc(Cl)nc3Oc3cccc(OC)c3)CC[C@@H]2C1 ZINC001164862157 720889600 /nfs/dbraw/zinc/88/96/00/720889600.db2.gz QWPMXOHCXMFUOI-OXQOHEQNSA-N 1 1 448.951 3.104 20 0 IGADMO Cc1nc2ccc(N3CC[C@@]4(C3)C[N@@H+](CC3CC3)C[C@@H]4COCc3cccnc3)nc2n1C ZINC001164755084 720890251 /nfs/dbraw/zinc/89/02/51/720890251.db2.gz KPYBZPKMMCFCRH-GJZUVCINSA-N 1 1 446.599 3.427 20 0 IGADMO Cc1nc2ccc(N3CC[C@]4(C3)C[N@@H+](CC3CC3)C[C@H]4COCc3cccnc3)nc2n1C ZINC001164755082 720890470 /nfs/dbraw/zinc/89/04/70/720890470.db2.gz KPYBZPKMMCFCRH-BKMJKUGQSA-N 1 1 446.599 3.427 20 0 IGADMO COCOc1ccc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COCc2cccnc2)nc1 ZINC001164753867 720891877 /nfs/dbraw/zinc/89/18/77/720891877.db2.gz HJWNDWZHPUIRDZ-DHLKQENFSA-N 1 1 438.572 3.214 20 0 IGADMO CC(=O)Nc1c(C)ccnc1N1CC[C@@]2(C1)C[N@@H+](CC1CC1)C[C@H]2COCc1cccnc1 ZINC001164758177 720904520 /nfs/dbraw/zinc/90/45/20/720904520.db2.gz XKJOAINHZIDURE-OZXSUGGESA-N 1 1 449.599 3.499 20 0 IGADMO COc1ncc(Cl)c(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COCc2cccnc2)n1 ZINC001164746499 720929306 /nfs/dbraw/zinc/92/93/06/720929306.db2.gz BAMSKLBUQXPHIA-WMZHIEFXSA-N 1 1 443.979 3.289 20 0 IGADMO CCOC(=O)c1cnc(N2CCn3c(C[N@@H+](C)C(C)C)cnc3[C@H]2C)cc1C(=O)OCC ZINC001164859617 721021832 /nfs/dbraw/zinc/02/18/32/721021832.db2.gz KCSUXKAZYPQNAI-MRXNPFEDSA-N 1 1 443.548 3.053 20 0 IGADMO FC(F)(c1nc(Cl)ncc1Cl)N1CC[N@H+]2C[C@H](OCc3cccnc3)C[C@@H]2C1 ZINC001164868651 721064471 /nfs/dbraw/zinc/06/44/71/721064471.db2.gz OZXIMYBUEUIGFD-ZIAGYGMSSA-N 1 1 430.286 3.203 20 0 IGADMO FC(F)(c1nc(Cl)ncc1Cl)N1CC[N@H+]2C[C@@H](OCc3cccnc3)C[C@H]2C1 ZINC001164868648 721064514 /nfs/dbraw/zinc/06/45/14/721064514.db2.gz OZXIMYBUEUIGFD-KBPBESRZSA-N 1 1 430.286 3.203 20 0 IGADMO CCOC(=O)c1cc(N2CC[N@H+]3C[C@@H](OCc4cccnc4)C[C@H]3C2)nc2ccccc21 ZINC001164865630 721084452 /nfs/dbraw/zinc/08/44/52/721084452.db2.gz NSHABPHKAALRDO-PMACEKPBSA-N 1 1 432.524 3.286 20 0 IGADMO CCOC(=O)c1cnc(Cl)c(C)c1N1CC[N@H+]2C[C@@H](OCc3cccnc3)C[C@H]2C1 ZINC001164862857 721099320 /nfs/dbraw/zinc/09/93/20/721099320.db2.gz BGLUOQUMWXBJKJ-ROUUACIJSA-N 1 1 430.936 3.095 20 0 IGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4cc(Cl)ncc4C(=O)OC(C)(C)C)C[C@H]3C2)cn1 ZINC001164768342 721155217 /nfs/dbraw/zinc/15/52/17/721155217.db2.gz OHUVAKNEAJHPHV-IAGOWNOFSA-N 1 1 431.968 3.382 20 0 IGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(C(F)(F)Oc4ccc5c(Cl)ncnc5c4)C[C@@H]3C2)cn1 ZINC001164774427 721174371 /nfs/dbraw/zinc/17/43/71/721174371.db2.gz ZCJIVRWNSSCUKQ-HOTGVXAUSA-N 1 1 448.905 3.400 20 0 IGADMO COc1ccc(Oc2cc(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@H]4C3)nc(C)n2)cc1 ZINC001164873578 721175216 /nfs/dbraw/zinc/17/52/16/721175216.db2.gz IQXCCFYJYOWXGA-REWPJTCUSA-N 1 1 447.539 3.461 20 0 IGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(C(F)(F)Cc4nc(Cl)cc(Cl)n4)C[C@@H]3C2)cn1 ZINC001164772339 721180556 /nfs/dbraw/zinc/18/05/56/721180556.db2.gz SJCHWWDZBSRMGJ-KGLIPLIRSA-N 1 1 431.318 3.106 20 0 IGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@]2(CCCN(C(F)(F)c3cc(Cl)ncn3)C2)C1 ZINC001164777662 721330572 /nfs/dbraw/zinc/33/05/72/721330572.db2.gz PBOBBOQIJXXAHN-LJQANCHMSA-N 1 1 441.910 3.399 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@]2(CCCN(C(F)(F)c3cc(Cl)ncn3)C2)C1 ZINC001164777662 721330575 /nfs/dbraw/zinc/33/05/75/721330575.db2.gz PBOBBOQIJXXAHN-LJQANCHMSA-N 1 1 441.910 3.399 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@]2(CCCN(c3nc(Cl)nc4[nH]ccc43)C2)C1 ZINC001164776360 721331500 /nfs/dbraw/zinc/33/15/00/721331500.db2.gz DYNCMSRWOVYQPN-OAQYLSRUSA-N 1 1 430.940 3.335 20 0 IGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@]2(CCCN(c3cnc4ccc(F)cc4n3)C2)C1 ZINC001164776447 721347771 /nfs/dbraw/zinc/34/77/71/721347771.db2.gz BMMVMMBQKBIQFT-HSZRJFAPSA-N 1 1 425.508 3.493 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@]2(CCCN(c3cnc4ccc(F)cc4n3)C2)C1 ZINC001164776447 721347777 /nfs/dbraw/zinc/34/77/77/721347777.db2.gz BMMVMMBQKBIQFT-HSZRJFAPSA-N 1 1 425.508 3.493 20 0 IGADMO COC(=O)c1nc(N2CCC[C@]3(C2)COCC[N@H+](Cc2c(C)noc2C)C3)ccc1Cl ZINC001164779051 721349816 /nfs/dbraw/zinc/34/98/16/721349816.db2.gz PORXUMOBUUJLNG-QFIPXVFZSA-N 1 1 448.951 3.245 20 0 IGADMO COC(=O)c1nc(N2CCC[C@]3(C2)COCC[N@@H+](Cc2c(C)noc2C)C3)ccc1Cl ZINC001164779051 721349817 /nfs/dbraw/zinc/34/98/17/721349817.db2.gz PORXUMOBUUJLNG-QFIPXVFZSA-N 1 1 448.951 3.245 20 0 IGADMO COc1ccc2nc(N3CCC[C@]4(C3)COCC[N@H+](Cc3c(C)noc3C)C4)ncc2c1 ZINC001164779349 721352734 /nfs/dbraw/zinc/35/27/34/721352734.db2.gz SISYYEPJVPKLNM-DEOSSOPVSA-N 1 1 437.544 3.362 20 0 IGADMO COc1ccc2nc(N3CCC[C@]4(C3)COCC[N@@H+](Cc3c(C)noc3C)C4)ncc2c1 ZINC001164779349 721352738 /nfs/dbraw/zinc/35/27/38/721352738.db2.gz SISYYEPJVPKLNM-DEOSSOPVSA-N 1 1 437.544 3.362 20 0 IGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@@]2(CCCN(c3ncc4cc(F)ccc4n3)C2)C1 ZINC001164784322 721360889 /nfs/dbraw/zinc/36/08/89/721360889.db2.gz RHCUTIDIPBILBG-QHCPKHFHSA-N 1 1 425.508 3.493 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@@]2(CCCN(c3ncc4cc(F)ccc4n3)C2)C1 ZINC001164784322 721360893 /nfs/dbraw/zinc/36/08/93/721360893.db2.gz RHCUTIDIPBILBG-QHCPKHFHSA-N 1 1 425.508 3.493 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@]2(CCCN(c3ncccc3C(=O)OC(C)C)C2)C1 ZINC001164779828 721373524 /nfs/dbraw/zinc/37/35/24/721373524.db2.gz CMXKBGXEYYHFBC-XMMPIXPASA-N 1 1 442.560 3.371 20 0 IGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@]2(CCCN(c3ncccc3C(=O)OC(C)C)C2)C1 ZINC001164779828 721373533 /nfs/dbraw/zinc/37/35/33/721373533.db2.gz CMXKBGXEYYHFBC-XMMPIXPASA-N 1 1 442.560 3.371 20 0 IGADMO CS(=O)(=O)N1CCCC[C@@]12CCCN(c1nc(Cl)ccc1C[NH+]1CCCC1)C2 ZINC001164886704 721375971 /nfs/dbraw/zinc/37/59/71/721375971.db2.gz NIRPUDGVNFIBKB-FQEVSTJZSA-N 1 1 427.014 3.115 20 0 IGADMO CSc1nc2sccc2c(N2CC[C@]3(C2)CCC[C@H](CN2CC[NH+](C)CC2)O3)n1 ZINC001164888066 721388035 /nfs/dbraw/zinc/38/80/35/721388035.db2.gz JFFCYHSGOZOQPC-IERDGZPVSA-N 1 1 433.647 3.179 20 0 IGADMO Cc1cccc2c1nc(Cl)nc2N1CC[C@@]2(C1)CCC[C@@H](CN1CC[NH+](C)CC1)O2 ZINC001164888344 721401172 /nfs/dbraw/zinc/40/11/72/721401172.db2.gz OKBYGDDENMHGBM-FDDCHVKYSA-N 1 1 429.996 3.357 20 0 IGADMO C[NH+]1CCN(C[C@H]2CCC[C@]3(CCN(c4nccc(-c5ccc(F)cc5)n4)C3)O2)CC1 ZINC001164888333 721407535 /nfs/dbraw/zinc/40/75/35/721407535.db2.gz OGGBPZBWCIMFAI-ZJSXRUAMSA-N 1 1 425.552 3.048 20 0 IGADMO CCOC(=O)c1cnc2ccc(Cl)nc2c1N1C[C@@H]2C[N@@H+](Cc3nccs3)C[C@@H]2C1 ZINC001164782428 721407747 /nfs/dbraw/zinc/40/77/47/721407747.db2.gz GKMIMADKSKZOTA-OKILXGFUSA-N 1 1 443.960 3.485 20 0 IGADMO CCOC(=O)c1cnc2ccc(Cl)nc2c1N1C[C@@H]2C[N@H+](Cc3nccs3)C[C@@H]2C1 ZINC001164782428 721407752 /nfs/dbraw/zinc/40/77/52/721407752.db2.gz GKMIMADKSKZOTA-OKILXGFUSA-N 1 1 443.960 3.485 20 0 IGADMO CCOC(Cc1c(Cl)ncnc1N1C[C@@H]2C[NH+](Cc3nccs3)C[C@H]2C1)OCC ZINC001164780576 721410844 /nfs/dbraw/zinc/41/08/44/721410844.db2.gz BGADPTKXJVGXSB-GJZGRUSLSA-N 1 1 437.997 3.096 20 0 IGADMO Fc1ccc(Oc2nc(Cl)nc(N3C[C@@H]4C[NH+](Cc5nccs5)C[C@H]4C3)n2)cc1 ZINC001164787156 721417034 /nfs/dbraw/zinc/41/70/34/721417034.db2.gz PIEZHHTZJSKHTG-STQMWFEESA-N 1 1 432.912 3.481 20 0 IGADMO Cc1ccc(Cl)nc1C(F)(F)N1CC[C@@]2(C1)CCC[C@@H](CN1CC[NH+](C)CC1)O2 ZINC001164886281 721421269 /nfs/dbraw/zinc/42/12/69/721421269.db2.gz IPSBFXKMQKEMMO-FXAWDEMLSA-N 1 1 428.955 3.354 20 0 IGADMO Cc1nc2c3ccccc3oc2c(N2CC[C@]3(C2)CCC[C@H](CN2CC[NH+](C)CC2)O3)n1 ZINC001164884009 721421858 /nfs/dbraw/zinc/42/18/58/721421858.db2.gz CXOZDJWSYGGZTG-CLOONOSVSA-N 1 1 435.572 3.450 20 0 IGADMO Cc1nc2c3ccccc3oc2c(N2CC[C@@]3(C2)CCC[C@H](CN2CC[NH+](C)CC2)O3)n1 ZINC001164884015 721422214 /nfs/dbraw/zinc/42/22/14/721422214.db2.gz CXOZDJWSYGGZTG-KBMIEXCESA-N 1 1 435.572 3.450 20 0 IGADMO Cc1cccc2nc(Cl)nc(N3CC[C@@]4(C3)CCC[C@H](CN3CC[NH+](C)CC3)O4)c12 ZINC001164892353 721425339 /nfs/dbraw/zinc/42/53/39/721425339.db2.gz IFJVIJKFQZGPCE-WZONZLPQSA-N 1 1 429.996 3.357 20 0 IGADMO C[NH+]1CCN(C[C@@H]2CCC[C@]3(CCN(c4cc(F)cc5ncnc(Cl)c54)C3)O2)CC1 ZINC001164892362 721428664 /nfs/dbraw/zinc/42/86/64/721428664.db2.gz IGVOPBSYAMKHRQ-HTAPYJJXSA-N 1 1 433.959 3.188 20 0 IGADMO O=C(NC1CCCC1)c1cnc(N2C[C@@H]3C[N@@H+](Cc4nccs4)C[C@@H]3C2)c(Cl)c1 ZINC001164782761 721428788 /nfs/dbraw/zinc/42/87/88/721428788.db2.gz HTYHWOYOASUFFH-IYBDPMFKSA-N 1 1 431.993 3.432 20 0 IGADMO O=C(NC1CCCC1)c1cnc(N2C[C@@H]3C[N@H+](Cc4nccs4)C[C@@H]3C2)c(Cl)c1 ZINC001164782761 721428790 /nfs/dbraw/zinc/42/87/90/721428790.db2.gz HTYHWOYOASUFFH-IYBDPMFKSA-N 1 1 431.993 3.432 20 0 IGADMO C[NH+]1CCN(C[C@@H]2CCC[C@@]3(CCN(c4cc5nc(Cl)cnc5cc4F)C3)O2)CC1 ZINC001164891777 721439799 /nfs/dbraw/zinc/43/97/99/721439799.db2.gz HKMTWFFJKPGFEH-AOMKIAJQSA-N 1 1 433.959 3.188 20 0 IGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1nnc(Cl)c3ccncc31)CC2 ZINC001164785208 721452454 /nfs/dbraw/zinc/45/24/54/721452454.db2.gz HGXBPFRQPNRVRX-GOSISDBHSA-N 1 1 445.995 3.412 20 0 IGADMO CC[C@H](C)c1nc2[nH]ccc2c(N2CC[C@@]3(C2)CCC[C@H](CN2CC[NH+](C)CC2)O3)n1 ZINC001164889710 721453471 /nfs/dbraw/zinc/45/34/71/721453471.db2.gz PLVGBYRCHBEEGS-XLNZFTOWSA-N 1 1 426.609 3.237 20 0 IGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1ncnc3cc(OC)ccc31)CC2 ZINC001164785694 721459978 /nfs/dbraw/zinc/45/99/78/721459978.db2.gz MRZQEKOTIOFTQI-HXUWFJFHSA-N 1 1 440.588 3.372 20 0 IGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1cncc(N3CCCCC3)n1)CC2 ZINC001164787725 721463678 /nfs/dbraw/zinc/46/36/78/721463678.db2.gz RWJPLUPCHKVKLN-QFIPXVFZSA-N 1 1 443.636 3.201 20 0 IGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1cc(-c3nc(C)no3)ccn1)CC2 ZINC001164789540 721468028 /nfs/dbraw/zinc/46/80/28/721468028.db2.gz NZFUIUVBVAEZHB-OAQYLSRUSA-N 1 1 441.576 3.174 20 0 IGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1ccc(-c3ccco3)nn1)CC2 ZINC001164791290 721468327 /nfs/dbraw/zinc/46/83/27/721468327.db2.gz WOEBALLTVFKWIX-FQEVSTJZSA-N 1 1 426.561 3.471 20 0 IGADMO CC(C)NS(=O)(=O)c1ccc(N2CCC3(CC([N@@H+](C)Cc4ccncc4)C3)CC2)nc1 ZINC001164795120 721499834 /nfs/dbraw/zinc/49/98/34/721499834.db2.gz DOYGFPRLVRBOFY-UHFFFAOYSA-N 1 1 443.617 3.044 20 0 IGADMO CCOC(=O)c1cc(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@H]32)ncc1Cl ZINC001164805506 721531150 /nfs/dbraw/zinc/53/11/50/721531150.db2.gz LYMMUGOBXKNGPX-SVFBPWRDSA-N 1 1 430.936 3.175 20 0 IGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2nnc(Cl)cc2-c2ccncc2)[C@H]2CCCO[C@H]12 ZINC001164807804 721534517 /nfs/dbraw/zinc/53/45/17/721534517.db2.gz RJFACWKGVZZSSE-VWPQPMDRSA-N 1 1 436.947 3.455 20 0 IGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2nnc(Cl)cc2-c2ccncc2)[C@H]2CCCO[C@H]12 ZINC001164807804 721534521 /nfs/dbraw/zinc/53/45/21/721534521.db2.gz RJFACWKGVZZSSE-VWPQPMDRSA-N 1 1 436.947 3.455 20 0 IGADMO CCOC(=O)c1c(C)nc(Cl)cc1N1C[C@H]([N@@H+](C)Cc2cccnc2)[C@@H]2OCCC[C@@H]21 ZINC001164809437 721544336 /nfs/dbraw/zinc/54/43/36/721544336.db2.gz UPMNUBOSRDLLCG-LQBOVUBWSA-N 1 1 444.963 3.483 20 0 IGADMO COC(=O)c1ccc2nc(N3C[C@H]([N@@H+](C)Cc4cccnc4)[C@H]4OCCC[C@@H]43)ccc2c1 ZINC001164804588 721548136 /nfs/dbraw/zinc/54/81/36/721548136.db2.gz KOPFAIJVRONYSN-FIXSFTCYSA-N 1 1 432.524 3.285 20 0 IGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(C(F)(F)COc2ccnc(Cl)c2)[C@H]2CCCO[C@@H]12 ZINC001164802992 721551760 /nfs/dbraw/zinc/55/17/60/721551760.db2.gz HCHHOIXRIZRVKH-NLWGTHIKSA-N 1 1 438.906 3.465 20 0 IGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(C(F)(F)COc2ccnc(Cl)c2)[C@H]2CCCO[C@@H]12 ZINC001164802992 721551764 /nfs/dbraw/zinc/55/17/64/721551764.db2.gz HCHHOIXRIZRVKH-NLWGTHIKSA-N 1 1 438.906 3.465 20 0 IGADMO CCOC(=O)c1cc(Cl)nc(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@H]3OCCC[C@H]32)c1C ZINC001164804559 721552855 /nfs/dbraw/zinc/55/28/55/721552855.db2.gz KHFAYSKFIAGRPE-DYXWJJEUSA-N 1 1 444.963 3.483 20 0 IGADMO Fc1cccc(O[C@@H]2C[C@H]3CN(C(F)(F)COc4ccc(Cl)nn4)CC[N@H+]3C2)c1 ZINC001164903548 721553347 /nfs/dbraw/zinc/55/33/47/721553347.db2.gz CFLPCBYLAUUYIP-GOEBONIOSA-N 1 1 428.842 3.078 20 0 IGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2nccc(OCc3ccccc3)n2)[C@@H]2CCCO[C@@H]12 ZINC001164803127 721553380 /nfs/dbraw/zinc/55/33/80/721553380.db2.gz IFHQUEMPHCJXQW-CQOQZXRMSA-N 1 1 431.540 3.319 20 0 IGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2nccc(OCc3ccccc3)n2)[C@@H]2CCCO[C@@H]12 ZINC001164803127 721553382 /nfs/dbraw/zinc/55/33/82/721553382.db2.gz IFHQUEMPHCJXQW-CQOQZXRMSA-N 1 1 431.540 3.319 20 0 IGADMO Fc1cccc(O[C@@H]2C[C@H]3CN(c4nc(Cl)nc5c(Cl)ncnc54)CC[N@H+]3C2)c1 ZINC001164911063 721562174 /nfs/dbraw/zinc/56/21/74/721562174.db2.gz YHFGKRWYOMIASH-GXTWGEPZSA-N 1 1 435.290 3.208 20 0 IGADMO COc1ccccc1-c1cc(N2C[C@H]([N@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@@H]32)ncn1 ZINC001164809449 721581664 /nfs/dbraw/zinc/58/16/64/721581664.db2.gz SAOWCSXFKNTATL-WRALFONMSA-N 1 1 431.540 3.415 20 0 IGADMO COc1ccccc1-c1cc(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@@H]32)ncn1 ZINC001164809449 721581667 /nfs/dbraw/zinc/58/16/67/721581667.db2.gz SAOWCSXFKNTATL-WRALFONMSA-N 1 1 431.540 3.415 20 0 IGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2ncnc3c2ncn3-c2ccccc2)[C@H]2CCCO[C@H]12 ZINC001164799368 721587422 /nfs/dbraw/zinc/58/74/22/721587422.db2.gz AZNKUYQHPUAKAQ-XJUOHMSHSA-N 1 1 441.539 3.079 20 0 IGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2ncnc3c2ncn3-c2ccccc2)[C@H]2CCCO[C@H]12 ZINC001164799368 721587425 /nfs/dbraw/zinc/58/74/25/721587425.db2.gz AZNKUYQHPUAKAQ-XJUOHMSHSA-N 1 1 441.539 3.079 20 0 IGADMO COC(=O)c1cc(Cl)c(N2C[C@H]([N@H+](C)Cc3cccnc3)[C@H]3OCCC[C@@H]32)nc1C ZINC001164805790 721588637 /nfs/dbraw/zinc/58/86/37/721588637.db2.gz LXHPHVDXHRUEMS-UFYCRDLUSA-N 1 1 430.936 3.093 20 0 IGADMO COC(=O)c1cc(Cl)c(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@H]3OCCC[C@@H]32)nc1C ZINC001164805790 721588639 /nfs/dbraw/zinc/58/86/39/721588639.db2.gz LXHPHVDXHRUEMS-UFYCRDLUSA-N 1 1 430.936 3.093 20 0 IGADMO COC(=O)c1cc(Cl)c(N2C[C@H]([N@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@H]32)nc1C ZINC001164805786 721589001 /nfs/dbraw/zinc/58/90/01/721589001.db2.gz LXHPHVDXHRUEMS-HSALFYBXSA-N 1 1 430.936 3.093 20 0 IGADMO COC(=O)c1cc(Cl)c(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@H]32)nc1C ZINC001164805786 721589002 /nfs/dbraw/zinc/58/90/02/721589002.db2.gz LXHPHVDXHRUEMS-HSALFYBXSA-N 1 1 430.936 3.093 20 0 IGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2ncc(C(N)=S)c3ccsc32)[C@@H]2CCCO[C@@H]12 ZINC001164805092 721591428 /nfs/dbraw/zinc/59/14/28/721591428.db2.gz KQJMYIKZBJFQSI-GUDVDZBRSA-N 1 1 439.610 3.194 20 0 IGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2ncc(C(N)=S)c3ccsc32)[C@@H]2CCCO[C@@H]12 ZINC001164805092 721591430 /nfs/dbraw/zinc/59/14/30/721591430.db2.gz KQJMYIKZBJFQSI-GUDVDZBRSA-N 1 1 439.610 3.194 20 0 IGADMO CC(C)c1nc(N(C)C)nc(N2CCC(F)(F)[C@]3(CC[N@@H+](Cc4ccccn4)C3)C2)n1 ZINC001164908549 721710844 /nfs/dbraw/zinc/71/08/44/721710844.db2.gz XWIMCQRYTJZJBK-NRFANRHFSA-N 1 1 431.535 3.194 20 0 IGADMO CNC(=O)c1nc(N2CCC(F)(F)[C@@]3(CC[N@@H+](Cc4ccccn4)C3)C2)ccc1Cl ZINC001164904156 721712762 /nfs/dbraw/zinc/71/27/62/721712762.db2.gz AHWQHFIXHXBKAG-HXUWFJFHSA-N 1 1 435.906 3.227 20 0 IGADMO COc1cnc2c(c1)ncnc2N1CCC(F)(F)[C@@]2(CC[N@@H+](Cc3ccccn3)C2)C1 ZINC001164904256 721718809 /nfs/dbraw/zinc/71/88/09/721718809.db2.gz AYLPKIZDMCXPOH-OAQYLSRUSA-N 1 1 426.471 3.166 20 0 IGADMO FC1(F)CCN(c2cc(N3CCSCC3)ncn2)C[C@]12CC[N@@H+](Cc1ccccn1)C2 ZINC001164913103 721731683 /nfs/dbraw/zinc/73/16/83/721731683.db2.gz SSROITUTCQPGJH-OAQYLSRUSA-N 1 1 446.571 3.163 20 0 IGADMO CCOC(=O)c1cnc(CC)nc1N1CCC(F)(F)[C@@]2(CC[N@@H+](Cc3ccccn3)C2)C1 ZINC001164913156 721732874 /nfs/dbraw/zinc/73/28/74/721732874.db2.gz UMYDSGIORSJWTH-JOCHJYFZSA-N 1 1 445.514 3.348 20 0 IGADMO F[C@@H](Oc1cncc(Cl)n1)N1CCC(F)(F)[C@@]2(CC[N@@H+](Cc3ccccn3)C2)C1 ZINC001164911240 721733679 /nfs/dbraw/zinc/73/36/79/721733679.db2.gz JFONKRGRPRILSH-QZTJIDSGSA-N 1 1 427.858 3.390 20 0 IGADMO CN(C)C(=O)C[NH+]1CCC2(CCCN2C(F)(F)c2cc3cc[nH]c3c(Cl)n2)CC1 ZINC001165010987 721743596 /nfs/dbraw/zinc/74/35/96/721743596.db2.gz RSIAUUSOEWWJNQ-UHFFFAOYSA-N 1 1 425.911 3.284 20 0 IGADMO Cc1nc2cc(Cl)ccc2c(N2CCO[C@@]3(C2)COCC[N@H+](Cc2cccnc2)C3)n1 ZINC001164915583 721783488 /nfs/dbraw/zinc/78/34/88/721783488.db2.gz LMHRGTBRGIJGTF-QHCPKHFHSA-N 1 1 439.947 3.094 20 0 IGADMO Cc1nc2cc(Cl)ccc2c(N2CCO[C@@]3(C2)COCC[N@@H+](Cc2cccnc2)C3)n1 ZINC001164915583 721783489 /nfs/dbraw/zinc/78/34/89/721783489.db2.gz LMHRGTBRGIJGTF-QHCPKHFHSA-N 1 1 439.947 3.094 20 0 IGADMO Cc1sc2nc(C[NH+]3CCCC3)nc(N3C[C@@H]4C(=O)N(c5cccnc5)C[C@@H]4C3)c2c1C ZINC001165022729 721792085 /nfs/dbraw/zinc/79/20/85/721792085.db2.gz OBVSJRMQBLCTBW-HKUYNNGSSA-N 1 1 448.596 3.398 20 0 IGADMO CCOC(=O)c1cnc(Cl)nc1N1C[C@@H]2CCC[C@@H]([N@@H+](C)Cc3ccccn3)[C@H]2C1 ZINC001165025415 721800336 /nfs/dbraw/zinc/80/03/36/721800336.db2.gz NZPKHJXKUOMJBO-ZYSHUDEJSA-N 1 1 429.952 3.439 20 0 IGADMO COC(=O)c1cc2c(OC)[nH]c(N3C[C@@H]4CCC[C@@H]([N@@H+](C)Cc5ccccn5)[C@@H]4C3)cc-2n1 ZINC001165027085 721811086 /nfs/dbraw/zinc/81/10/86/721811086.db2.gz SARAZBPAYUIDJS-DKZVUGQWSA-N 1 1 449.555 3.490 20 0 IGADMO C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@@H]2CN(c3nc(Cl)ccc3S(C)(=O)=O)C[C@H]21 ZINC001165021440 721821695 /nfs/dbraw/zinc/82/16/95/721821695.db2.gz FPVJBFFPRCVBNW-KBAYOESNSA-N 1 1 434.993 3.270 20 0 IGADMO CCOC(=O)[C@@H]1CCc2nnc(N3C[C@@H]4CCC[C@H]([N@@H+](C)Cc5ccccn5)[C@H]4C3)cc2C1 ZINC001165026359 721831793 /nfs/dbraw/zinc/83/17/93/721831793.db2.gz PCRYBFLJMVTCFP-OQZHBAMCSA-N 1 1 449.599 3.277 20 0 IGADMO CCc1cc2c(nc(Cl)nc2N2CCC3(CC2)C(=O)NCC[N@H+]3Cc2ccccc2)[nH]1 ZINC001164948215 721977705 /nfs/dbraw/zinc/97/77/05/721977705.db2.gz VLDGMGHADWXKBA-UHFFFAOYSA-N 1 1 438.963 3.145 20 0 IGADMO CCc1cc2c(nc(Cl)nc2N2CCC3(CC2)C(=O)NCC[N@@H+]3Cc2ccccc2)[nH]1 ZINC001164948215 721977708 /nfs/dbraw/zinc/97/77/08/721977708.db2.gz VLDGMGHADWXKBA-UHFFFAOYSA-N 1 1 438.963 3.145 20 0 IGADMO CC[NH+](CC)C1CCN(c2nccc(NC(=O)C(C)(C)C)c2CN2CC[C@H](CO)C2)CC1 ZINC001165054126 722004723 /nfs/dbraw/zinc/00/47/23/722004723.db2.gz ZYBPLKFNLIDCHE-IBGZPJMESA-N 1 1 445.652 3.191 20 0 IGADMO CCC[N@H+]1CCCC[C@@H]1c1ccc(N2CC[C@]3(C2)C[C@@H](NC(=O)N(C)C)CCO3)nc1 ZINC001164952742 722010820 /nfs/dbraw/zinc/01/08/20/722010820.db2.gz AYVOMEQFLLYTOT-YZUZCNPQSA-N 1 1 429.609 3.418 20 0 IGADMO COc1nc(-c2ccccc2)nc(N2CCC3(CC2)COCC[N@@H+](Cc2ccncc2)C3)n1 ZINC001164963815 722057284 /nfs/dbraw/zinc/05/72/84/722057284.db2.gz MGHNWGOCMSWYMU-UHFFFAOYSA-N 1 1 446.555 3.061 20 0 IGADMO CCOC(=O)/C=C\c1ccc(N2CCC3(CC2)COCC[N@@H+](Cc2ccncc2)C3)nc1 ZINC001164961651 722057648 /nfs/dbraw/zinc/05/76/48/722057648.db2.gz NQKDRLPNTYICJU-XQRVVYSFSA-N 1 1 436.556 3.172 20 0 IGADMO FC(F)(c1cc(Cl)nc(Cl)n1)N1CC[C@H]2C[N@@H+](Cc3cccnc3)CCO[C@H]2C1 ZINC001164983999 722101596 /nfs/dbraw/zinc/10/15/96/722101596.db2.gz RMQGEWAMBMGMQP-GJZGRUSLSA-N 1 1 444.313 3.451 20 0 IGADMO COCc1cc(N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)nc(-c2ccccc2)n1 ZINC001164976346 722102653 /nfs/dbraw/zinc/10/26/53/722102653.db2.gz CQJQERGSVJWJPC-ISKFKSNPSA-N 1 1 445.567 3.412 20 0 IGADMO CC1(C)OCc2c1nc(Cl)nc2N1CC[C@H]2C[N@@H+](Cc3cccnc3)CCO[C@H]2C1 ZINC001164983219 722108868 /nfs/dbraw/zinc/10/88/68/722108868.db2.gz YNDYVIPFEPJWCZ-WMZOPIPTSA-N 1 1 429.952 3.018 20 0 IGADMO c1cncc(C[N@H+]2CCO[C@H]3CN(c4nccnc4C4SCCCS4)CC[C@@H]3C2)c1 ZINC001164979768 722109146 /nfs/dbraw/zinc/10/91/46/722109146.db2.gz PVJBUINXICLJEC-MOPGFXCFSA-N 1 1 443.642 3.468 20 0 IGADMO c1cncc(C[N@H+]2CCO[C@H]3CN(c4nccnc4C4SCCCS4)CC[C@H]3C2)c1 ZINC001164979769 722109333 /nfs/dbraw/zinc/10/93/33/722109333.db2.gz PVJBUINXICLJEC-OALUTQOASA-N 1 1 443.642 3.468 20 0 IGADMO COc1ccc2nc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)c(Cl)nc2c1 ZINC001164975705 722111048 /nfs/dbraw/zinc/11/10/48/722111048.db2.gz KKJBLZMXLCKAOP-UTKZUKDTSA-N 1 1 439.947 3.414 20 0 IGADMO COC(=O)c1ccc2ccnc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)c2c1 ZINC001164979226 722111223 /nfs/dbraw/zinc/11/12/23/722111223.db2.gz PQWABNJBLSFCFN-GGAORHGYSA-N 1 1 432.524 3.144 20 0 IGADMO COc1cc2ccnc(N3CC[C@H]4C[N@H+](Cc5cccnc5)CCO[C@H]4C3)c2cc1OC ZINC001164980563 722122818 /nfs/dbraw/zinc/12/28/18/722122818.db2.gz RVMYKNUHCLZGSO-RDPSFJRHSA-N 1 1 434.540 3.374 20 0 IGADMO COc1cc2ccnc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)c2cc1OC ZINC001164980563 722122820 /nfs/dbraw/zinc/12/28/20/722122820.db2.gz RVMYKNUHCLZGSO-RDPSFJRHSA-N 1 1 434.540 3.374 20 0 IGADMO COC(=O)c1cc2ccccc2nc1N1CC[C@@H]2C[N@@H+](Cc3cccnc3)CCO[C@@H]2C1 ZINC001164979562 722129991 /nfs/dbraw/zinc/12/99/91/722129991.db2.gz LFBSZILPCQVMNT-NFBKMPQASA-N 1 1 432.524 3.144 20 0 IGADMO COc1ccc(-c2cc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)ncn2)cc1 ZINC001164975233 722144554 /nfs/dbraw/zinc/14/45/54/722144554.db2.gz GDGHMLCIXPJPPQ-URXFXBBRSA-N 1 1 431.540 3.275 20 0 IGADMO COC(=O)c1cc2ccccc2c(N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)n1 ZINC001164980257 722144816 /nfs/dbraw/zinc/14/48/16/722144816.db2.gz MFZYUVPKVRFQJX-NZQKXSOJSA-N 1 1 432.524 3.144 20 0 IGADMO c1cncc(C[N@H+]2CCO[C@H]3CN(c4nc(-c5cccnc5)nc5c4CCC5)CC[C@@H]3C2)c1 ZINC001164985497 722149524 /nfs/dbraw/zinc/14/95/24/722149524.db2.gz ZQZGBWZKPWXCFG-QPPBQGQZSA-N 1 1 442.567 3.150 20 0 IGADMO COC(=O)c1cccc2nc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)ccc21 ZINC001164977099 722149745 /nfs/dbraw/zinc/14/97/45/722149745.db2.gz ISHDQROOVMDSNJ-XXBNENTESA-N 1 1 432.524 3.144 20 0 IGADMO CCOC(=O)N1CCc2nnc(N3CCC[C@]4(CC[N@H+]4Cc4cccc(F)c4)C3)cc2C1 ZINC001164997196 722208546 /nfs/dbraw/zinc/20/85/46/722208546.db2.gz WZXXYYMQUXJCPD-DEOSSOPVSA-N 1 1 439.535 3.375 20 0 IGADMO CC(C)NC(=O)[C@@H]1C[C@H]2OCCN(c3ccc4c(n3)CC[N@H+](Cc3ccccc3)C4)[C@@H]2C1 ZINC001164994314 722214712 /nfs/dbraw/zinc/21/47/12/722214712.db2.gz ALRJLLFZQVSDIU-QPTUXGOLSA-N 1 1 434.584 3.148 20 0 IGADMO C[NH+]1CCN(c2ncnc3c2CCN(c2nc(Cl)nc4cccc(Cl)c42)CC3)CC1 ZINC001164997932 722233293 /nfs/dbraw/zinc/23/32/93/722233293.db2.gz YVBBTVOVUBKSFU-UHFFFAOYSA-N 1 1 444.370 3.084 20 0 IGADMO Cc1cc2nc(Cl)c(N3CCc4ncnc(N5CC[NH+](C)CC5)c4CC3)nc2cc1C ZINC001164997607 722235304 /nfs/dbraw/zinc/23/53/04/722235304.db2.gz RVGWEWVSUCUVHT-UHFFFAOYSA-N 1 1 437.979 3.047 20 0 IGADMO CCOC(=O)[C@@]12CCO[C@@H]1CCN(c1nc(C[NH+]3CCCC3)nc3sc(C)c(C)c31)C2 ZINC001164434709 718978990 /nfs/dbraw/zinc/97/89/90/718978990.db2.gz VEDUAHXUIGKJFI-UZUQRXQVSA-N 1 1 444.601 3.452 20 0 IGADMO Cc1noc([C@@H]2C[C@H]3CCN(c4ncnc5c4CC[N@H+](Cc4ccccc4)C5)C[C@H]3O2)n1 ZINC001164647118 719298868 /nfs/dbraw/zinc/29/88/68/719298868.db2.gz CLLPDZCRQJULJO-BVYCBKJFSA-N 1 1 432.528 3.083 20 0 IGADMO Cc1noc([C@@H]2C[C@H]3CCN(c4ncnc5c4CC[N@@H+](Cc4ccccc4)C5)C[C@H]3O2)n1 ZINC001164647118 719298873 /nfs/dbraw/zinc/29/88/73/719298873.db2.gz CLLPDZCRQJULJO-BVYCBKJFSA-N 1 1 432.528 3.083 20 0 IGADMO CC(C)n1nc(C[NH+](C)C)c2c1CN(c1ncnc3c1ncn3Cc1ccccc1F)CC2 ZINC001164650386 719312355 /nfs/dbraw/zinc/31/23/55/719312355.db2.gz XRAPARRBWOKCTC-UHFFFAOYSA-N 1 1 448.550 3.415 20 0 IGADMO COC(=O)[C@@]1(C)C[C@H]([NH+]2CCOCC2)CCN1c1nc(Cl)nc2c(Cl)cccc21 ZINC001164703110 719851156 /nfs/dbraw/zinc/85/11/56/719851156.db2.gz OPOKWJXWFHDUGW-ZUOKHONESA-N 1 1 439.343 3.169 20 0 IGADMO COC(=O)[C@@]1(C)C[C@@H]([NH+]2CCOCC2)CCN1c1nc(Cl)nc2c(Cl)cccc21 ZINC001164703101 719851436 /nfs/dbraw/zinc/85/14/36/719851436.db2.gz OPOKWJXWFHDUGW-RNODOKPDSA-N 1 1 439.343 3.169 20 0 IGADMO COC(=O)[C@@]1(C)C[C@@H]([NH+]2CCOCC2)CCN1c1nc(Cl)cc2cc(OC)ccc21 ZINC001164700116 719861830 /nfs/dbraw/zinc/86/18/30/719861830.db2.gz GMOIHOABHPSTGG-KSFYIVLOSA-N 1 1 433.936 3.130 20 0 IGADMO COC(=O)[C@]1(C)C[C@@H]([NH+]2CCOCC2)CCN1c1nc(C)nc2sc3c(c21)CCCC3 ZINC001164701671 719866818 /nfs/dbraw/zinc/86/68/18/719866818.db2.gz GPBINTHBCRFQDD-HJPURHCSSA-N 1 1 444.601 3.111 20 0 IGADMO COC(=O)[C@@]1(C)C[C@H]([NH+]2CCOCC2)CCN1c1cc(F)ccc1-c1ccc(Cl)nn1 ZINC001164699203 719872312 /nfs/dbraw/zinc/87/23/12/719872312.db2.gz AXLRKQVLCBNXOF-OPAMFIHVSA-N 1 1 448.926 3.169 20 0 IGADMO [O-][n+]1ccc(C(F)(F)N2CCC3(CC2)C[N@@H+](Cc2cccs2)CCO3)cc1Cl ZINC001164706802 719909602 /nfs/dbraw/zinc/90/96/02/719909602.db2.gz KNAKCVQJQJERBA-UHFFFAOYSA-N 1 1 429.920 3.451 20 0 IGADMO CCC[N@H+]1CCCC[C@@H]1c1ccc(N2C[C@@H]3COC[C@H](C(=O)N4CCCCO4)[C@H]3C2)nc1 ZINC001164704186 719924552 /nfs/dbraw/zinc/92/45/52/719924552.db2.gz OPJVANAPMRASRS-WZYRSQIMSA-N 1 1 442.604 3.271 20 0 IGADMO CCOC(=O)c1sc2ncnc(N3CC[C@]4(C3)C[N@@H+](CC3CC3)C[C@H]4COC)c2c1C ZINC001164806433 720068814 /nfs/dbraw/zinc/06/88/14/720068814.db2.gz CSUPREQOMKIWHF-GAJHUEQPSA-N 1 1 444.601 3.361 20 0 IGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1ncccc1C(=O)NC1CCCCC1)C2 ZINC001164805885 720077778 /nfs/dbraw/zinc/07/77/78/720077778.db2.gz AIZFDISIJIQZAZ-CJFMBICVSA-N 1 1 426.605 3.329 20 0 IGADMO COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1ncccc1C(=O)N1CCCC1)CC2 ZINC001164712108 720094728 /nfs/dbraw/zinc/09/47/28/720094728.db2.gz VOGWCTMDHRUCDT-QFIPXVFZSA-N 1 1 449.599 3.220 20 0 IGADMO COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1c(C)nc(Cl)nc1OC)CC2 ZINC001164719573 720117350 /nfs/dbraw/zinc/11/73/50/720117350.db2.gz ZHEVHNCJJMLUBB-GOSISDBHSA-N 1 1 431.968 3.350 20 0 IGADMO CCN(CC)C(=O)c1cc(Cl)nc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COC)c1 ZINC001164815920 720128158 /nfs/dbraw/zinc/12/81/58/720128158.db2.gz XKYXMPKCULBRIH-XXBNENTESA-N 1 1 435.012 3.402 20 0 IGADMO COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1cc(C(=O)N3CCCC3)ccn1)CC2 ZINC001164714572 720130036 /nfs/dbraw/zinc/13/00/36/720130036.db2.gz XIAUOCPHAFTSSJ-HSZRJFAPSA-N 1 1 449.599 3.220 20 0 IGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(C(F)(F)c1cc(C(=O)OC)cnc1Cl)C2 ZINC001164819741 720154613 /nfs/dbraw/zinc/15/46/13/720154613.db2.gz XYKFVCPDNMXPHO-JXFKEZNVSA-N 1 1 443.922 3.251 20 0 IGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1ccc(-c3cc(OC)ccc3OC)nn1)C2 ZINC001164814401 720182721 /nfs/dbraw/zinc/18/27/21/720182721.db2.gz GCJNQBFANUMWRC-DFBJGRDBSA-N 1 1 438.572 3.346 20 0 IGADMO CC(=O)NC[C@@H]1c2ncn(C(C)C)c2CCN1c1nc(Cl)ccc1C[NH+]1CCCC1 ZINC001164721909 720315219 /nfs/dbraw/zinc/31/52/19/720315219.db2.gz IVFFYEQCVXKFDA-LJQANCHMSA-N 1 1 430.984 3.348 20 0 IGADMO CCC[N@H+]1CCCC[C@@H]1c1ccc(N2CC[C@@H]3O[C@@H](COCC(=O)N(C)C)CC[C@@H]32)nc1 ZINC001164727241 720324704 /nfs/dbraw/zinc/32/47/04/720324704.db2.gz RVYGVSBIMASUNU-LUKWVAJMSA-N 1 1 444.620 3.250 20 0 IGADMO CCOC(=O)c1cnc(Cl)nc1C(F)(F)N1CC[C@H]2[C@@H]1CC[N@@H+]2Cc1cccnc1 ZINC001164725591 720335027 /nfs/dbraw/zinc/33/50/27/720335027.db2.gz NZDMSSRUYKVSEQ-HOTGVXAUSA-N 1 1 437.878 3.100 20 0 IGADMO CCOC(=O)c1cnc(Cl)nc1C(F)(F)N1CC[C@H]2[C@@H]1CC[N@H+]2Cc1cccnc1 ZINC001164725591 720335031 /nfs/dbraw/zinc/33/50/31/720335031.db2.gz NZDMSSRUYKVSEQ-HOTGVXAUSA-N 1 1 437.878 3.100 20 0 IGADMO CCOC(=O)c1c(Cl)nc(SC)nc1N1CC[C@H]2[C@H]1CC[N@H+]2Cc1cccnc1 ZINC001164723081 720381472 /nfs/dbraw/zinc/38/14/72/720381472.db2.gz GADLNRDQOYGAFF-LSDHHAIUSA-N 1 1 433.965 3.277 20 0 IGADMO c1ccc(N2CCN(c3cc(N4CC[C@@H]5[C@H]4CC[N@@H+]5Cc4cccnc4)ncn3)CC2)cc1 ZINC001164730084 720460801 /nfs/dbraw/zinc/46/08/01/720460801.db2.gz HQQCJQFGVPEYCW-DNQXCXABSA-N 1 1 441.583 3.051 20 0 IGADMO c1cncc(C[N@H+]2CC[C@H]3[C@@H]2CCN3c2ccc(-c3ccc(N4CCOCC4)cc3)nn2)c1 ZINC001164723064 720466336 /nfs/dbraw/zinc/46/63/36/720466336.db2.gz BTWCYJWQWVPZAL-DQEYMECFSA-N 1 1 442.567 3.228 20 0 IGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@H]2CN(c3nc(Cl)nc4c3COC4(C)C)CC[C@@H]21 ZINC001164836047 720524513 /nfs/dbraw/zinc/52/45/13/720524513.db2.gz LXLRUTYMMFFLGV-BQFCYCMXSA-N 1 1 430.984 3.470 20 0 IGADMO CCOC(=O)c1cc2cccnc2nc1N1CC[C@@H]2[C@H](C[C@H](Cn3cccn3)[N@H+]2C(C)C)C1 ZINC001164835055 720542457 /nfs/dbraw/zinc/54/24/57/720542457.db2.gz GVEYJVJLZVWRDJ-KCZVDYSFSA-N 1 1 448.571 3.381 20 0 IGADMO COc1nc(Cl)ncc1C(F)(F)N1CC[C@@H]2[C@H](C[C@@H](Cn3cccn3)[N@H+]2C(C)C)C1 ZINC001164838768 720587768 /nfs/dbraw/zinc/58/77/68/720587768.db2.gz LPYXLLGAYVADFS-HLLBOEOZSA-N 1 1 440.926 3.258 20 0 IGADMO CCOC(=O)c1cnc2cc(N3CC[C@@H]4[C@@H](C[C@H](Cn5cccn5)[N@@H+]4C(C)C)C3)[nH]cc1-2 ZINC001164840830 720593992 /nfs/dbraw/zinc/59/39/92/720593992.db2.gz QYECULDINBRLIV-NJNPRVFISA-N 1 1 436.560 3.314 20 0 IGADMO CCOC(=O)c1cnc2cc(N3CC[C@@H]4[C@@H](C[C@H](Cn5cccn5)[N@H+]4C(C)C)C3)[nH]cc1-2 ZINC001164840830 720594014 /nfs/dbraw/zinc/59/40/14/720594014.db2.gz QYECULDINBRLIV-NJNPRVFISA-N 1 1 436.560 3.314 20 0 IGADMO COc1cc(OC)c2ncnc(N3CC[C@@H]4[C@@H](C[C@H](Cn5cccn5)[N@H+]4C(C)C)C3)c2c1 ZINC001164842514 720644863 /nfs/dbraw/zinc/64/48/63/720644863.db2.gz RUDJCIMYSIEWSJ-WAOWUJCRSA-N 1 1 436.560 3.221 20 0 IGADMO c1nc2n(c1-c1cccnc1)CCN(c1ncccc1CN1CCCC1)C21CC[NH2+]CC1 ZINC001164843039 720743531 /nfs/dbraw/zinc/74/35/31/720743531.db2.gz HJUJDNZBPOABIK-UHFFFAOYSA-N 1 1 429.572 3.035 20 0 IGADMO Fc1ccc2nc(Cl)nc(N3CC[C@@H]4[C@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)c2c1 ZINC001164745450 720814491 /nfs/dbraw/zinc/81/44/91/720814491.db2.gz KKCQGVPJKVKGFV-OXFYSEKESA-N 1 1 441.942 3.393 20 0 IGADMO Fc1ccc2nc(Cl)nc(N3CC[C@@H]4[C@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)c2c1 ZINC001164745455 720814609 /nfs/dbraw/zinc/81/46/09/720814609.db2.gz KKCQGVPJKVKGFV-WRWLIDTKSA-N 1 1 441.942 3.393 20 0 IGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2C[C@@H]3COC[C@]3(C(=O)NCCc3ccccc3)C2)nc1 ZINC001164848599 720817138 /nfs/dbraw/zinc/81/71/38/720817138.db2.gz DEZOGPFPGSSFRU-FKCDAAJZSA-N 1 1 448.611 3.440 20 0 IGADMO c1ncn(C[C@H]2C[C@@H]3CN(c4nccc(Oc5ccccc5)n4)CC[C@H]3[N@H+]2CC2CC2)n1 ZINC001164745049 720819267 /nfs/dbraw/zinc/81/92/67/720819267.db2.gz VZLLTZYJMNJOAJ-KCZVDYSFSA-N 1 1 431.544 3.240 20 0 IGADMO COCC[N@H+]1CCO[C@H]2CN(C(F)(F)c3nc(Cl)c4ccccc4n3)CC[C@@H]2C1 ZINC001164852574 720835858 /nfs/dbraw/zinc/83/58/58/720835858.db2.gz KYQPOBLAJXJNIY-PBHICJAKSA-N 1 1 426.895 3.002 20 0 IGADMO CCCN(CCC)c1cncc(N2CC[C@@H]3[C@@H](C[C@@H](Cn4cncn4)[N@H+]3CC3CC3)C2)n1 ZINC001164751028 720839995 /nfs/dbraw/zinc/83/99/95/720839995.db2.gz XWMSDNJNFGFAMP-FDFHNCONSA-N 1 1 438.624 3.074 20 0 IGADMO Cc1cccc(-c2ccc(N3CC[C@@H]4[C@@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)nn2)c1 ZINC001164740464 720847961 /nfs/dbraw/zinc/84/79/61/720847961.db2.gz BSZADPQNGOHZIE-WPFOTENUSA-N 1 1 429.572 3.423 20 0 IGADMO COc1ccccc1-c1ccnc(N2CC[C@@H]3[C@@H](C[C@@H](Cn4cncn4)[N@H+]3CC3CC3)C2)n1 ZINC001164749712 720849673 /nfs/dbraw/zinc/84/96/73/720849673.db2.gz WPWLLXBHILOBLQ-SXWKCWPCSA-N 1 1 445.571 3.123 20 0 IGADMO CCc1nc(Cl)c(N2CC[C@@H]3[C@H](C[C@@H](Cn4cncn4)[N@H+]3CC3CC3)C2)c(Cl)n1 ZINC001164745193 720850732 /nfs/dbraw/zinc/85/07/32/720850732.db2.gz MNNQCNMYWZCKIM-OWCLPIDISA-N 1 1 436.391 3.317 20 0 IGADMO COCC[N@H+]1CCO[C@@H]2CN(c3nc(-c4ccccc4)nc(-c4ccccc4)n3)CC[C@@H]2C1 ZINC001164850150 720851930 /nfs/dbraw/zinc/85/19/30/720851930.db2.gz DPIVGAHUOFTCEX-DHIUTWEWSA-N 1 1 445.567 3.379 20 0 IGADMO Fc1cccc(-c2ccc(N3CC[C@@H]4[C@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)nn2)c1 ZINC001164751971 720852217 /nfs/dbraw/zinc/85/22/17/720852217.db2.gz RYNQKGMIZNHPES-KJXAQDMKSA-N 1 1 433.535 3.254 20 0 IGADMO COc1cc2nc(N3CC[C@@H]4[C@@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)ccc2c(OC)c1 ZINC001164752636 720856649 /nfs/dbraw/zinc/85/66/49/720856649.db2.gz TZKMJDSAWQBDKC-SFYKDHMMSA-N 1 1 448.571 3.223 20 0 IGADMO COc1cc2nc(N3CC[C@@H]4[C@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)ccc2c(OC)c1 ZINC001164752634 720856979 /nfs/dbraw/zinc/85/69/79/720856979.db2.gz TZKMJDSAWQBDKC-SELNLUPBSA-N 1 1 448.571 3.223 20 0 IGADMO COCC[N@H+]1CCO[C@@H]2CN(C(F)(F)c3nc4ccccc4nc3Cl)CC[C@@H]2C1 ZINC001164853109 720863499 /nfs/dbraw/zinc/86/34/99/720863499.db2.gz GMPCIVLKUQMPGW-RHSMWYFYSA-N 1 1 426.895 3.002 20 0 IGADMO c1cncc(COC[C@@H]2C[N@@H+](CC3CC3)C[C@@]23CCN(c2nccc(NC4CC4)n2)C3)c1 ZINC001164754420 720867996 /nfs/dbraw/zinc/86/79/96/720867996.db2.gz RRPBCNTZEZCEJJ-SQJMNOBHSA-N 1 1 434.588 3.201 20 0 IGADMO COc1cnc(Cl)nc1N1CC[C@]2(C1)C[N@@H+](CC1CC1)C[C@@H]2COCc1cccnc1 ZINC001164752399 720870834 /nfs/dbraw/zinc/87/08/34/720870834.db2.gz MWQBXGQZIFJRSJ-AUSIDOKSSA-N 1 1 443.979 3.289 20 0 IGADMO COCC[N@H+]1CCO[C@@H]2CN(c3cc(F)ccc3Oc3ccc(Cl)nn3)CC[C@@H]2C1 ZINC001164854455 720874962 /nfs/dbraw/zinc/87/49/62/720874962.db2.gz FGLRLPCMSJULCS-DNVCBOLYSA-N 1 1 436.915 3.235 20 0 IGADMO c1cncc(COC[C@H]2C[N@@H+](CC3CC3)C[C@@]23CCN(c2ncnc4ncccc42)C3)c1 ZINC001164754517 720876423 /nfs/dbraw/zinc/87/64/23/720876423.db2.gz RZJNJKNKJVOZNS-PXDATVDWSA-N 1 1 430.556 3.175 20 0 IGADMO c1cncc(COC[C@@H]2C[N@@H+](CC3CC3)C[C@]23CCN(c2ncnc4cccnc42)C3)c1 ZINC001164749032 720876695 /nfs/dbraw/zinc/87/66/95/720876695.db2.gz GHRQNWYHMDCNMQ-OFVILXPXSA-N 1 1 430.556 3.175 20 0 IGADMO Cn1ccc2c1ncnc2N1CC[C@]2(C1)C[N@@H+](CC1CC1)C[C@H]2COCc1cccnc1 ZINC001164754851 720876986 /nfs/dbraw/zinc/87/69/86/720876986.db2.gz TXUDFVWJEAHZJK-SQJMNOBHSA-N 1 1 432.572 3.118 20 0 IGADMO CSc1cc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COCc2cccnc2)ncn1 ZINC001164749043 720877025 /nfs/dbraw/zinc/87/70/25/720877025.db2.gz GLHUYNOLROZRGD-NFBKMPQASA-N 1 1 425.602 3.349 20 0 IGADMO COCC[N@H+]1CCO[C@@H]2CN(c3cnc(Cl)nc3Oc3ccc(F)cc3)CC[C@H]2C1 ZINC001164864249 720877685 /nfs/dbraw/zinc/87/76/85/720877685.db2.gz VFQYKGDKMNYEKM-HNAYVOBHSA-N 1 1 436.915 3.235 20 0 IGADMO COCC[N@H+]1CCO[C@@H]2CN(c3cnc(Cl)nc3Oc3ccccc3C)CC[C@H]2C1 ZINC001164858556 720888894 /nfs/dbraw/zinc/88/88/94/720888894.db2.gz LDKDBZLIAZRBQC-FXAWDEMLSA-N 1 1 432.952 3.404 20 0 IGADMO COCC[N@H+]1CCO[C@@H]2CN(c3cnc(Cl)nc3Oc3ccc(OC)cc3)CC[C@@H]2C1 ZINC001164864819 720889323 /nfs/dbraw/zinc/88/93/23/720889323.db2.gz XLHSRCQGJUKGAM-OXQOHEQNSA-N 1 1 448.951 3.104 20 0 IGADMO COCC[N@H+]1CCO[C@H]2CN(c3cnc(Cl)nc3Oc3ccc(OC)cc3)CC[C@@H]2C1 ZINC001164864822 720889422 /nfs/dbraw/zinc/88/94/22/720889422.db2.gz XLHSRCQGJUKGAM-UZLBHIALSA-N 1 1 448.951 3.104 20 0 IGADMO COCC[N@H+]1CCO[C@@H]2CN(c3cnc(Cl)nc3Oc3ccccc3OC)CC[C@H]2C1 ZINC001164865028 720890089 /nfs/dbraw/zinc/89/00/89/720890089.db2.gz XZXUGOGBDFVXOK-OXJNMPFZSA-N 1 1 448.951 3.104 20 0 IGADMO FC(F)Oc1cnc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COCc2cccnc2)nc1 ZINC001164754504 720896857 /nfs/dbraw/zinc/89/68/57/720896857.db2.gz JCOPTCNFTKFMAQ-CVDCTZTESA-N 1 1 445.514 3.228 20 0 IGADMO CC(=O)Nc1c(C)ccnc1N1CC[C@]2(C1)C[N@@H+](CC1CC1)C[C@H]2COCc1cccnc1 ZINC001164758176 720903559 /nfs/dbraw/zinc/90/35/59/720903559.db2.gz XKJOAINHZIDURE-JYFHCDHNSA-N 1 1 449.599 3.499 20 0 IGADMO CC(C)Oc1nccnc1N1CC[C@]2(C1)C[N@@H+](CC1CC1)C[C@H]2COCc1cccnc1 ZINC001164752701 720924643 /nfs/dbraw/zinc/92/46/43/720924643.db2.gz OLPFGPOOJPBDON-WIOPSUGQSA-N 1 1 437.588 3.414 20 0 IGADMO Cc1cnc2c(ccnc2N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COCc2cccnc2)n1 ZINC001164755037 720925455 /nfs/dbraw/zinc/92/54/55/720925455.db2.gz XWCCTLRSZLZNBC-NVQXNPDNSA-N 1 1 444.583 3.483 20 0 IGADMO COC(=O)c1c[nH]c2nc(Cl)nc(N3CCn4c(C[N@@H+](C)C(C)C)cnc4[C@@H]3C)c12 ZINC001164857172 720994997 /nfs/dbraw/zinc/99/49/97/720994997.db2.gz CPMCKIFKULFLCB-LBPRGKRZSA-N 1 1 431.928 3.016 20 0 IGADMO COC(=O)c1c[nH]c2nc(Cl)nc(N3CCn4c(C[N@@H+](C)C(C)C)cnc4[C@H]3C)c12 ZINC001164857170 720997813 /nfs/dbraw/zinc/99/78/13/720997813.db2.gz CPMCKIFKULFLCB-GFCCVEGCSA-N 1 1 431.928 3.016 20 0 IGADMO C[NH+]1CCC(Oc2ccnc(N3CCC[C@@]4(C[C@H](OCc5ccccn5)CO4)C3)c2)CC1 ZINC001164761473 721032097 /nfs/dbraw/zinc/03/20/97/721032097.db2.gz GFHXQBYCYKVQON-UKILVPOCSA-N 1 1 438.572 3.294 20 0 IGADMO c1cnn(Cc2cnc3n2CCN(c2ccc4c(n2)CC[N@H+](Cc2ccccc2)C4)CC3)c1 ZINC001164861481 721032139 /nfs/dbraw/zinc/03/21/39/721032139.db2.gz HYKFCHQKBFAMGW-UHFFFAOYSA-N 1 1 439.567 3.144 20 0 IGADMO c1cncc(CO[C@H]2C[C@@H]3CN(c4nccnc4C4SCCCS4)CC[N@H+]3C2)c1 ZINC001164868215 721070884 /nfs/dbraw/zinc/07/08/84/721070884.db2.gz NQSXLJHQJUYLRQ-MSOLQXFVSA-N 1 1 429.615 3.220 20 0 IGADMO CCOc1cc2ncnc(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@H]4C3)c2cc1OCC ZINC001164866936 721090415 /nfs/dbraw/zinc/09/04/15/721090415.db2.gz VGVTYOGEGONCKS-VQTJNVASSA-N 1 1 449.555 3.302 20 0 IGADMO COc1ccc2nc(Cl)cc(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@H]4C3)c2n1 ZINC001164865180 721096611 /nfs/dbraw/zinc/09/66/11/721096611.db2.gz JKXSPCCIGPYUOI-IRXDYDNUSA-N 1 1 425.920 3.167 20 0 IGADMO CCN(CC)C(=O)c1cc(Cl)nc(N2CC[N@H+]3C[C@H](OCc4cccnc4)C[C@@H]3C2)c1 ZINC001164867224 721099916 /nfs/dbraw/zinc/09/99/16/721099916.db2.gz XAZYTGVYQRQDBJ-WOJBJXKFSA-N 1 1 443.979 3.092 20 0 IGADMO c1ccc2nc(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@@H]4C3)c(N3CCCC3)nc2c1 ZINC001164878350 721136523 /nfs/dbraw/zinc/13/65/23/721136523.db2.gz PXKQGPQQSFBERQ-RTWAWAEBSA-N 1 1 430.556 3.105 20 0 IGADMO CCOC(=O)c1cc2c(N3C[C@@H]4CC[N@@H+](Cc5cnn(C)c5)C[C@@H]4C3)[nH]c(C)c(C)c-2n1 ZINC001164773552 721159169 /nfs/dbraw/zinc/15/91/69/721159169.db2.gz YIPYZFWXMQGRNR-RBUKOAKNSA-N 1 1 436.560 3.048 20 0 IGADMO COc1ccc(Oc2cc(N3C[C@@H]4CC[N@@H+](Cc5cnn(C)c5)C[C@@H]4C3)nc(C)n2)cc1 ZINC001164760668 721231853 /nfs/dbraw/zinc/23/18/53/721231853.db2.gz FRPQYRCVYMCWJA-VQTJNVASSA-N 1 1 434.544 3.278 20 0 IGADMO COc1ccc(Cc2c(C)nc(N3C[C@@H]4CC[N@@H+](Cc5cnn(C)c5)C[C@@H]4C3)nc2C)cc1 ZINC001164763897 721234588 /nfs/dbraw/zinc/23/45/88/721234588.db2.gz NXABHXSIDUSKEM-XZOQPEGZSA-N 1 1 446.599 3.385 20 0 IGADMO CC[N@H+]1CCCC[C@H]1c1ccc(N2C[C@@H]3CN(S(=O)(=O)c4ccccc4)C[C@@H]3C2)nc1 ZINC001164877329 721309846 /nfs/dbraw/zinc/30/98/46/721309846.db2.gz IKGZPEXRIUDCNV-XJUOHMSHSA-N 1 1 440.613 3.385 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@@]2(CCCN(c3nc(Cl)nc4ncccc43)C2)C1 ZINC001164778388 721338271 /nfs/dbraw/zinc/33/82/71/721338271.db2.gz VAGRFMCNDPPEEO-QFIPXVFZSA-N 1 1 442.951 3.402 20 0 IGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@@]2(CCCN(C(F)(F)c3cnc(Cl)nc3)C2)C1 ZINC001164777821 721339679 /nfs/dbraw/zinc/33/96/79/721339679.db2.gz IJOLORGRHQBFGJ-IBGZPJMESA-N 1 1 441.910 3.399 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@@]2(CCCN(C(F)(F)c3cnc(Cl)nc3)C2)C1 ZINC001164777821 721339684 /nfs/dbraw/zinc/33/96/84/721339684.db2.gz IJOLORGRHQBFGJ-IBGZPJMESA-N 1 1 441.910 3.399 20 0 IGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@@]2(CCCN(c3nccc4c3C(=O)OC4(C)C)C2)C1 ZINC001164779290 721346285 /nfs/dbraw/zinc/34/62/85/721346285.db2.gz SBQCUIQJLXYYCQ-DEOSSOPVSA-N 1 1 440.544 3.211 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@@]2(CCCN(c3nccc4c3C(=O)OC4(C)C)C2)C1 ZINC001164779290 721346288 /nfs/dbraw/zinc/34/62/88/721346288.db2.gz SBQCUIQJLXYYCQ-DEOSSOPVSA-N 1 1 440.544 3.211 20 0 IGADMO C=C(OCC)c1ccc(N2CCC[C@]3(C2)COCC[N@H+](Cc2c(C)noc2C)C3)nn1 ZINC001164779366 721350311 /nfs/dbraw/zinc/35/03/11/721350311.db2.gz SORAXDTXNXNVGX-QHCPKHFHSA-N 1 1 427.549 3.208 20 0 IGADMO C=C(OCC)c1ccc(N2CCC[C@]3(C2)COCC[N@@H+](Cc2c(C)noc2C)C3)nn1 ZINC001164779366 721350312 /nfs/dbraw/zinc/35/03/12/721350312.db2.gz SORAXDTXNXNVGX-QHCPKHFHSA-N 1 1 427.549 3.208 20 0 IGADMO Cc1noc(C)c1CN1CCOC[C@@]2(CCCN(c3cc(N4CCCC4)cc[nH+]3)C2)C1 ZINC001164780060 721358777 /nfs/dbraw/zinc/35/87/77/721358777.db2.gz CUMJQIVQNGKQKY-DEOSSOPVSA-N 1 1 425.577 3.406 20 0 IGADMO CCOC(=O)c1c(C)ccnc1N1CCC[C@]2(C1)COCC[N@H+](Cc1c(C)noc1C)C2 ZINC001164781660 721360410 /nfs/dbraw/zinc/36/04/10/721360410.db2.gz KKWMGTIZIKUUDZ-DEOSSOPVSA-N 1 1 442.560 3.291 20 0 IGADMO CCOC(=O)c1c(C)ccnc1N1CCC[C@]2(C1)COCC[N@@H+](Cc1c(C)noc1C)C2 ZINC001164781660 721360415 /nfs/dbraw/zinc/36/04/15/721360415.db2.gz KKWMGTIZIKUUDZ-DEOSSOPVSA-N 1 1 442.560 3.291 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@@]2(CCCN(c3ncccc3C(=O)OC(C)C)C2)C1 ZINC001164779827 721373220 /nfs/dbraw/zinc/37/32/20/721373220.db2.gz CMXKBGXEYYHFBC-DEOSSOPVSA-N 1 1 442.560 3.371 20 0 IGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@@]2(CCCN(c3ncccc3C(=O)OC(C)C)C2)C1 ZINC001164779827 721373227 /nfs/dbraw/zinc/37/32/27/721373227.db2.gz CMXKBGXEYYHFBC-DEOSSOPVSA-N 1 1 442.560 3.371 20 0 IGADMO C[NH+]1CCN(C[C@H]2CCC[C@]3(CCN(C(F)(F)c4ccc(F)c(Cl)n4)C3)O2)CC1 ZINC001164886755 721389774 /nfs/dbraw/zinc/38/97/74/721389774.db2.gz GDTMQFCWYAGNSQ-DNVCBOLYSA-N 1 1 432.918 3.184 20 0 IGADMO CCOC(=O)c1cnc(-c2cccs2)nc1N1C[C@@H]2C[N@@H+](Cc3nccs3)C[C@@H]2C1 ZINC001164786849 721405709 /nfs/dbraw/zinc/40/57/09/721405709.db2.gz PHVGTXJGAUQNIZ-GASCZTMLSA-N 1 1 441.582 3.407 20 0 IGADMO CCOC(=O)c1cnc(-c2cccs2)nc1N1C[C@@H]2C[N@H+](Cc3nccs3)C[C@@H]2C1 ZINC001164786849 721405711 /nfs/dbraw/zinc/40/57/11/721405711.db2.gz PHVGTXJGAUQNIZ-GASCZTMLSA-N 1 1 441.582 3.407 20 0 IGADMO C[NH+]1CCN(C[C@H]2CCC[C@@]3(CCN(C(F)(F)c4cnc(Cl)c(F)c4)C3)O2)CC1 ZINC001164885629 721406857 /nfs/dbraw/zinc/40/68/57/721406857.db2.gz GWGBKCSWFWIPPO-APWZRJJASA-N 1 1 432.918 3.184 20 0 IGADMO COc1ccc2nc(Cl)cc(N3CC[C@@]4(C3)CCC[C@H](CN3CC[NH+](C)CC3)O4)c2n1 ZINC001164891472 721416694 /nfs/dbraw/zinc/41/66/94/721416694.db2.gz WIFIKPZAIAUXOM-UZUQRXQVSA-N 1 1 445.995 3.057 20 0 IGADMO COc1cccc2nc(Cl)nc(N3CC[C@]4(C3)CCC[C@@H](CN3CC[NH+](C)CC3)O4)c21 ZINC001164891938 721417250 /nfs/dbraw/zinc/41/72/50/721417250.db2.gz WTHUHPRRRFSOQN-SBUREZEXSA-N 1 1 445.995 3.057 20 0 IGADMO CSc1nc2ccccc2c(N2CC[C@@]3(C2)CCC[C@@H](CN2CC[NH+](C)CC2)O3)n1 ZINC001164888989 721417380 /nfs/dbraw/zinc/41/73/80/721417380.db2.gz PZPQTCBVDYFHCO-FDDCHVKYSA-N 1 1 427.618 3.117 20 0 IGADMO Fc1cccc(Oc2nc(Cl)nc(N3C[C@@H]4C[NH+](Cc5nccs5)C[C@H]4C3)n2)c1 ZINC001164781730 721417792 /nfs/dbraw/zinc/41/77/92/721417792.db2.gz DJUXGIBDGNGNMP-STQMWFEESA-N 1 1 432.912 3.481 20 0 IGADMO Cc1ccc(Cl)nc1C(F)(F)N1CC[C@]2(C1)CCC[C@H](CN1CC[NH+](C)CC1)O2 ZINC001164886285 721420971 /nfs/dbraw/zinc/42/09/71/721420971.db2.gz IPSBFXKMQKEMMO-XLIONFOSSA-N 1 1 428.955 3.354 20 0 IGADMO C[NH+]1CCN(C[C@H]2CCC[C@]3(CCN(c4ccc(-c5ccc(F)cc5)nn4)C3)O2)CC1 ZINC001164896078 721438915 /nfs/dbraw/zinc/43/89/15/721438915.db2.gz QKCLAVVXOXNOAG-ZJSXRUAMSA-N 1 1 425.552 3.048 20 0 IGADMO CCc1ccc(-c2ccc(N3CC[C@]4(C3)CCC[C@H](CN3CC[NH+](C)CC3)O4)nn2)cc1 ZINC001164894428 721440160 /nfs/dbraw/zinc/44/01/60/721440160.db2.gz MOLMXXAQOFTUHX-BVAGGSTKSA-N 1 1 435.616 3.471 20 0 IGADMO C[NH+]1CCN(C[C@H]2CCC[C@@]3(CCN(c4ccc(-c5ccccc5F)nn4)C3)O2)CC1 ZINC001164899173 721441053 /nfs/dbraw/zinc/44/10/53/721441053.db2.gz YBNFJRGPEXNXAW-DVECYGJZSA-N 1 1 425.552 3.048 20 0 IGADMO COCC[N@@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1nc(C)cc(N3CCCC3)n1)CC2 ZINC001164790336 721447976 /nfs/dbraw/zinc/44/79/76/721447976.db2.gz YJWFMXVYFMOEGQ-JOCHJYFZSA-N 1 1 443.636 3.119 20 0 IGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1nc(C)cc(N3CCCC3)n1)CC2 ZINC001164790336 721447979 /nfs/dbraw/zinc/44/79/79/721447979.db2.gz YJWFMXVYFMOEGQ-JOCHJYFZSA-N 1 1 443.636 3.119 20 0 IGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1ncc(C)c(NC3CC3)n1)CC2 ZINC001164787706 721447985 /nfs/dbraw/zinc/44/79/85/721447985.db2.gz PYCZNUPQFSCDCP-NRFANRHFSA-N 1 1 429.609 3.093 20 0 IGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(C(F)(F)c1cc(Cl)ncn1)CC2 ZINC001164786783 721448442 /nfs/dbraw/zinc/44/84/42/721448442.db2.gz NNRGZVDRXVIXOU-KRWDZBQOSA-N 1 1 444.954 3.409 20 0 IGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1cnc(-c3ccco3)cn1)CC2 ZINC001164784736 721458002 /nfs/dbraw/zinc/45/80/02/721458002.db2.gz JYCIHJOEMVTSCG-HXUWFJFHSA-N 1 1 426.561 3.471 20 0 IGADMO CCOC(=O)c1cc(C)cnc1N1CCC2(C[C@@H](COCC3CC3)[N@@H+](CCOC)C2)CC1 ZINC001164789213 721459809 /nfs/dbraw/zinc/45/98/09/721459809.db2.gz VWGXHSOEPOLWEK-NRFANRHFSA-N 1 1 445.604 3.301 20 0 IGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1ncc3cc(OC)ccc3n1)CC2 ZINC001164790028 721460885 /nfs/dbraw/zinc/46/08/85/721460885.db2.gz ZBFHURPCYYNYLU-OAQYLSRUSA-N 1 1 440.588 3.372 20 0 IGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1nccc(C)c1NC(C)=O)CC2 ZINC001164789909 721464789 /nfs/dbraw/zinc/46/47/89/721464789.db2.gz YKFFMXVIRZGLQB-OAQYLSRUSA-N 1 1 430.593 3.082 20 0 IGADMO CCC[N@H+]1CCCC[C@@H]1c1ccc(N2C[C@@H]3COC[C@]3(CC(=O)NCC3CC3)C2)nc1 ZINC001164893903 721484630 /nfs/dbraw/zinc/48/46/30/721484630.db2.gz FSNOIGKSPCOGNF-RQTOMXEWSA-N 1 1 426.605 3.388 20 0 IGADMO c1cnn(C[C@H]2Cn3ccnc3CN(c3ccc4c(n3)CC[N@H+](Cc3ccccc3)C4)C2)c1 ZINC001164893839 721486158 /nfs/dbraw/zinc/48/61/58/721486158.db2.gz DNSVBLHDLQLYMA-QFIPXVFZSA-N 1 1 439.567 3.370 20 0 IGADMO C[N@@H+](Cc1ccncc1)C1CC2(C1)CCN(c1nc(Cl)ncc1N1CCOCC1)CC2 ZINC001164792221 721496032 /nfs/dbraw/zinc/49/60/32/721496032.db2.gz KNHLKSVFXFLVFX-UHFFFAOYSA-N 1 1 442.995 3.243 20 0 IGADMO CC(C)(C)OC(=O)Nc1nccc(N2CC[N@H+]3C[C@H](Oc4cccc(F)c4)C[C@@H]3C2)n1 ZINC001164902092 721525369 /nfs/dbraw/zinc/52/53/69/721525369.db2.gz ZDDWXKMPKORBCQ-SJLPKXTDSA-N 1 1 429.496 3.305 20 0 IGADMO CCOC(=O)c1cnc(N2CC[N@H+]3C[C@@H](Oc4cccc(F)c4)C[C@H]3C2)cc1OCC ZINC001164911276 721532244 /nfs/dbraw/zinc/53/22/44/721532244.db2.gz VYHRSJYHRKNWLA-HKUYNNGSSA-N 1 1 429.492 3.138 20 0 IGADMO CCOC(=O)c1ccc2ncnc(N3CC[N@H+]4C[C@H](Oc5cccc(F)c5)C[C@@H]4C3)c2c1 ZINC001164912061 721534106 /nfs/dbraw/zinc/53/41/06/721534106.db2.gz YMJHTHDGYPJDGZ-UYAOXDASSA-N 1 1 436.487 3.288 20 0 IGADMO COc1cc2nc(C)nc(N3CC[N@H+]4C[C@H](Oc5cccc(F)c5)C[C@H]4C3)c2cc1OC ZINC001164910345 721535293 /nfs/dbraw/zinc/53/52/93/721535293.db2.gz UJCVGGROCRGKCO-PKOBYXMFSA-N 1 1 438.503 3.436 20 0 IGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2cc(NC(=O)OC(C)(C)C)ncn2)[C@H]2CCCO[C@H]12 ZINC001164808950 721536374 /nfs/dbraw/zinc/53/63/74/721536374.db2.gz SNKKBCNVORCYRC-UEXGIBASSA-N 1 1 440.548 3.087 20 0 IGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2cc(NC(=O)OC(C)(C)C)ncn2)[C@H]2CCCO[C@H]12 ZINC001164808950 721536378 /nfs/dbraw/zinc/53/63/78/721536378.db2.gz SNKKBCNVORCYRC-UEXGIBASSA-N 1 1 440.548 3.087 20 0 IGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2nc(Cl)nc3c2COC3(C)C)[C@H]2CCCO[C@@H]12 ZINC001164805521 721542412 /nfs/dbraw/zinc/54/24/12/721542412.db2.gz MANFTLHKFQEBRO-RCCFBDPRSA-N 1 1 429.952 3.159 20 0 IGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2nc(Cl)nc3c2COC3(C)C)[C@H]2CCCO[C@@H]12 ZINC001164805521 721542419 /nfs/dbraw/zinc/54/24/19/721542419.db2.gz MANFTLHKFQEBRO-RCCFBDPRSA-N 1 1 429.952 3.159 20 0 IGADMO COC(=O)/C=C\c1cc2cc[nH]c2c(N2CC[N@H+]3C[C@H](Oc4cccc(F)c4)C[C@@H]3C2)n1 ZINC001164908658 721547343 /nfs/dbraw/zinc/54/73/43/721547343.db2.gz QBJPSSVRAACBSV-HFYBBEMZSA-N 1 1 436.487 3.230 20 0 IGADMO COC(=O)c1ccc2nc(N3C[C@H]([N@@H+](C)Cc4cccnc4)[C@@H]4OCCC[C@H]43)ccc2c1 ZINC001164804587 721548696 /nfs/dbraw/zinc/54/86/96/721548696.db2.gz KOPFAIJVRONYSN-AOHZBQACSA-N 1 1 432.524 3.285 20 0 IGADMO C[C@@H]1CCCN(C(=O)c2ccc(N3CC[N@H+]4C[C@@H](Oc5cccc(F)c5)C[C@H]4C3)nc2)C1 ZINC001164910306 721552815 /nfs/dbraw/zinc/55/28/15/721552815.db2.gz WGAUQBGVDGXOCR-JZWVFAODSA-N 1 1 438.547 3.435 20 0 IGADMO CC1CCN(C(=O)c2ccc(N3CC[N@H+]4C[C@@H](Oc5cccc(F)c5)C[C@H]4C3)nc2)CC1 ZINC001164908578 721553110 /nfs/dbraw/zinc/55/31/10/721553110.db2.gz QMOUICJBLRZCLN-GMAHTHKFSA-N 1 1 438.547 3.435 20 0 IGADMO Fc1cccc(O[C@H]2C[C@H]3CN(C(F)(F)COc4ccc(Cl)nn4)CC[N@H+]3C2)c1 ZINC001164903549 721553538 /nfs/dbraw/zinc/55/35/38/721553538.db2.gz CFLPCBYLAUUYIP-HOCLYGCPSA-N 1 1 428.842 3.078 20 0 IGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(C(F)(F)COc2cccc(Cl)n2)[C@H]2CCCO[C@@H]12 ZINC001164809384 721564247 /nfs/dbraw/zinc/56/42/47/721564247.db2.gz WRSHHTBMCNONLW-SQGPQFPESA-N 1 1 438.906 3.465 20 0 IGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(C(F)(F)COc2cccc(Cl)n2)[C@H]2CCCO[C@@H]12 ZINC001164809384 721564256 /nfs/dbraw/zinc/56/42/56/721564256.db2.gz WRSHHTBMCNONLW-SQGPQFPESA-N 1 1 438.906 3.465 20 0 IGADMO COC(=O)c1cc2ccccc2nc1N1C[C@H]([N@H+](C)Cc2cccnc2)[C@@H]2OCCC[C@@H]21 ZINC001164799617 721566144 /nfs/dbraw/zinc/56/61/44/721566144.db2.gz CZCDELOUOUIJJK-RJGXRXQPSA-N 1 1 432.524 3.285 20 0 IGADMO COC(=O)c1cc2ccccc2nc1N1C[C@H]([N@@H+](C)Cc2cccnc2)[C@@H]2OCCC[C@@H]21 ZINC001164799617 721566147 /nfs/dbraw/zinc/56/61/47/721566147.db2.gz CZCDELOUOUIJJK-RJGXRXQPSA-N 1 1 432.524 3.285 20 0 IGADMO COC(=O)/C=C\c1cc2cc[nH]c2c(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@H]32)n1 ZINC001164806690 721570382 /nfs/dbraw/zinc/57/03/82/721570382.db2.gz QUGQYZXJYKDGJY-HDCCZPKPSA-N 1 1 447.539 3.012 20 0 IGADMO Cc1nc(-c2ccncc2)nc(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@H]3OCCC[C@@H]32)c1C ZINC001164811988 721584858 /nfs/dbraw/zinc/58/48/58/721584858.db2.gz ZGNLKRQFFIHOPY-VABKMULXSA-N 1 1 430.556 3.419 20 0 IGADMO NC(=O)c1cc(F)c(Cl)nc1N1CCC(F)(F)[C@]2(CC[N@@H+](Cc3ccccn3)C2)C1 ZINC001164907059 721694641 /nfs/dbraw/zinc/69/46/41/721694641.db2.gz QTNIQYPLNLBKPW-IBGZPJMESA-N 1 1 439.869 3.106 20 0 IGADMO CCOC(=O)c1ncnc(N2CCC(F)(F)[C@@]3(CC[N@@H+](Cc4ccccn4)C3)C2)c1C ZINC001164907396 721709784 /nfs/dbraw/zinc/70/97/84/721709784.db2.gz RNUGIAUIGRSJLQ-OAQYLSRUSA-N 1 1 431.487 3.094 20 0 IGADMO COC(=O)c1cc2c[nH]c(N3CCC(F)(F)[C@]4(CC[N@@H+](Cc5ccccn5)C4)C3)cc-2n1 ZINC001164907425 721719062 /nfs/dbraw/zinc/71/90/62/721719062.db2.gz RXKTYDBPJQOMSU-QFIPXVFZSA-N 1 1 441.482 3.482 20 0 IGADMO COc1nc(N2CCC(F)(F)[C@@]3(CC[N@@H+](Cc4ccccn4)C3)C2)nc2c1ccn2C ZINC001164913141 721736217 /nfs/dbraw/zinc/73/62/17/721736217.db2.gz UJCSYOJRJSARDK-OAQYLSRUSA-N 1 1 428.487 3.110 20 0 IGADMO c1ccc(C[N@@H+]2CCc3c(ncnc3N3CC[C@]4(C[C@@H](Oc5cccnc5)CO4)C3)C2)cc1 ZINC001164916514 721805547 /nfs/dbraw/zinc/80/55/47/721805547.db2.gz PSGRHXHPMJBBOA-GJZUVCINSA-N 1 1 443.551 3.247 20 0 IGADMO c1ccc(C[N@H+]2CCc3c(ncnc3N3CC[C@]4(C[C@@H](Oc5cccnc5)CO4)C3)C2)cc1 ZINC001164916514 721805548 /nfs/dbraw/zinc/80/55/48/721805548.db2.gz PSGRHXHPMJBBOA-GJZUVCINSA-N 1 1 443.551 3.247 20 0 IGADMO CCc1cc(N2C[C@@H]3CCC[C@@H]([N@H+](C)Cc4ccccn4)[C@@H]3C2)nc(N2CCOCC2)n1 ZINC001165025350 721817817 /nfs/dbraw/zinc/81/78/17/721817817.db2.gz MRYDJIVJBJAURT-WWPVKYPJSA-N 1 1 436.604 3.008 20 0 IGADMO CCc1cc(N2C[C@@H]3CCC[C@@H]([N@@H+](C)Cc4ccccn4)[C@@H]3C2)nc(N2CCOCC2)n1 ZINC001165025350 721817819 /nfs/dbraw/zinc/81/78/19/721817819.db2.gz MRYDJIVJBJAURT-WWPVKYPJSA-N 1 1 436.604 3.008 20 0 IGADMO Cc1sc2nc(CN3CCCC3)nc(N3CC[C@@H]4[C@H]3CC[N@@H+]4CCN(C)C)c2c1C ZINC001164929521 721879458 /nfs/dbraw/zinc/87/94/58/721879458.db2.gz BNOSWEODVGURLP-RTBURBONSA-N 1 1 428.650 3.119 20 0 IGADMO Cc1sc2nc(CN3CCCC3)nc(N3CC[C@@H]4[C@H]3CCN4CC[NH+](C)C)c2c1C ZINC001164929521 721879459 /nfs/dbraw/zinc/87/94/59/721879459.db2.gz BNOSWEODVGURLP-RTBURBONSA-N 1 1 428.650 3.119 20 0 IGADMO Cc1sc2nc(CN3CCCC3)nc(N3CC[C@@H]4[C@@H]3CC[N@@H+]4CCN(C)C)c2c1C ZINC001164929500 721879469 /nfs/dbraw/zinc/87/94/69/721879469.db2.gz BNOSWEODVGURLP-MOPGFXCFSA-N 1 1 428.650 3.119 20 0 IGADMO Cc1sc2nc(CN3CCCC3)nc(N3CC[C@@H]4[C@@H]3CCN4CC[NH+](C)C)c2c1C ZINC001164929500 721879471 /nfs/dbraw/zinc/87/94/71/721879471.db2.gz BNOSWEODVGURLP-MOPGFXCFSA-N 1 1 428.650 3.119 20 0 IGADMO O=C(C[C@@H]1OC[C@H]2CN(c3nc(Cl)ccc3C[NH+]3CCCC3)CC[C@@H]21)NC1CCC1 ZINC001164932762 721896289 /nfs/dbraw/zinc/89/62/89/721896289.db2.gz IEGVWZGCZYXVJG-HOJAQTOUSA-N 1 1 432.996 3.231 20 0 IGADMO Cc1ccc(C[N@H+]2CCOC3(CCN(c4nc(Cl)cc5c4CNC5=O)CC3)C2)cc1 ZINC001164939176 721928364 /nfs/dbraw/zinc/92/83/64/721928364.db2.gz KBZMKPZUTRKGSM-UHFFFAOYSA-N 1 1 426.948 3.158 20 0 IGADMO COC(OC)c1c(CO)ccnc1N1CCC2(CC1)C[N@@H+](Cc1ccc(C)cc1)CCO2 ZINC001164940114 721928969 /nfs/dbraw/zinc/92/89/69/721928969.db2.gz QFWOJNNHQRAXNC-UHFFFAOYSA-N 1 1 441.572 3.045 20 0 IGADMO O=C1NCC[N@@H+](Cc2ccccc2)C12CCN(c1nc(Cl)nc3c(F)cccc31)CC2 ZINC001164946855 721973379 /nfs/dbraw/zinc/97/33/79/721973379.db2.gz XLKHKYRDAGJPSD-UHFFFAOYSA-N 1 1 439.922 3.393 20 0 IGADMO O=C1NCC[N@H+](Cc2ccccc2)C12CCN(c1nc(Cl)nc3c(F)cccc31)CC2 ZINC001164946855 721973381 /nfs/dbraw/zinc/97/33/81/721973381.db2.gz XLKHKYRDAGJPSD-UHFFFAOYSA-N 1 1 439.922 3.393 20 0 IGADMO O=C1NCC[N@@H+](Cc2ccccc2)C12CCN(c1c(F)ccc3c(Cl)ncnc31)CC2 ZINC001164950597 721981219 /nfs/dbraw/zinc/98/12/19/721981219.db2.gz WADVXPLVTAZPLZ-UHFFFAOYSA-N 1 1 439.922 3.393 20 0 IGADMO O=C1NCC[N@H+](Cc2ccccc2)C12CCN(c1c(F)ccc3c(Cl)ncnc31)CC2 ZINC001164950597 721981221 /nfs/dbraw/zinc/98/12/21/721981221.db2.gz WADVXPLVTAZPLZ-UHFFFAOYSA-N 1 1 439.922 3.393 20 0 IGADMO O=C1NCC[N@H+](Cc2ccccc2)C12CCN(c1nc(C3CCC3)nc3[nH]ccc31)CC2 ZINC001164945645 721982022 /nfs/dbraw/zinc/98/20/22/721982022.db2.gz CIZRFHAPKIFACJ-UHFFFAOYSA-N 1 1 430.556 3.196 20 0 IGADMO O=C1NCC[N@@H+](Cc2ccccc2)C12CCN(c1nc(C3CCC3)nc3[nH]ccc31)CC2 ZINC001164945645 721982024 /nfs/dbraw/zinc/98/20/24/721982024.db2.gz CIZRFHAPKIFACJ-UHFFFAOYSA-N 1 1 430.556 3.196 20 0 IGADMO Cc1ccc2c([nH+]1)N(Cc1cccnc1)CCN(c1nc(Cl)nc3c1CN(C)CC3)C2 ZINC001164954368 722006782 /nfs/dbraw/zinc/00/67/82/722006782.db2.gz WTZMQTASQXVNPK-UHFFFAOYSA-N 1 1 435.963 3.243 20 0 IGADMO CN(C)C(=O)N[C@@H]1CCO[C@]2(CCN(c3ccc4c(n3)CC[N@H+](Cc3ccccc3)C4)C2)C1 ZINC001164954354 722008275 /nfs/dbraw/zinc/00/82/75/722008275.db2.gz LTDIALUJQJWGOP-ATIYNZHBSA-N 1 1 449.599 3.039 20 0 IGADMO CCOC(=O)c1nc2ccn(C)c2c(N2CCC3(CC[N@@H+](Cc4cccnc4)C3)CC2)n1 ZINC001164955500 722020628 /nfs/dbraw/zinc/02/06/28/722020628.db2.gz JMBGMVWUWDTMQK-UHFFFAOYSA-N 1 1 434.544 3.033 20 0 IGADMO Cc1noc(C[C@@H]2C[C@H]3CN(c4ccc5c(n4)CC[N@H+](Cc4ccccc4)C5)C[C@@H]3O2)n1 ZINC001164961829 722040910 /nfs/dbraw/zinc/04/09/10/722040910.db2.gz NJDOTSSNYSKFAS-FUDKSRODSA-N 1 1 431.540 3.168 20 0 IGADMO COC(=O)c1cnc(N2CCC3(CC2)COCC[N@@H+](Cc2ccncc2)C3)c(Cl)c1 ZINC001164959408 722051794 /nfs/dbraw/zinc/05/17/94/722051794.db2.gz ILVZKBWVBHKRDY-UHFFFAOYSA-N 1 1 430.936 3.036 20 0 IGADMO CCOC(=O)c1cnc2cc(N3CCC4(CC3)COCC[N@H+](Cc3ccncc3)C4)[nH]cc1-2 ZINC001164961485 722059502 /nfs/dbraw/zinc/05/95/02/722059502.db2.gz KTDVWGJSWOBYER-UHFFFAOYSA-N 1 1 449.555 3.254 20 0 IGADMO CCOC(=O)c1cnc2cc(N3CCC4(CC3)COCC[N@@H+](Cc3ccncc3)C4)[nH]cc1-2 ZINC001164961485 722059503 /nfs/dbraw/zinc/05/95/03/722059503.db2.gz KTDVWGJSWOBYER-UHFFFAOYSA-N 1 1 449.555 3.254 20 0 IGADMO COC(=O)c1cc(Cl)c(N2CCC3(CC2)COCC[N@@H+](Cc2ccncc2)C3)nc1C ZINC001164964407 722061759 /nfs/dbraw/zinc/06/17/59/722061759.db2.gz GLNRAPVDCKIKPR-UHFFFAOYSA-N 1 1 444.963 3.344 20 0 IGADMO CC(=O)N1[C@H](Cn2cccn2)C[C@@H]2CN(c3nc(Cl)ccc3C[NH+]3CCCC3)CC[C@@H]21 ZINC001164969526 722080459 /nfs/dbraw/zinc/08/04/59/722080459.db2.gz LERXATSQCUYIQO-HKBOAZHASA-N 1 1 442.995 3.043 20 0 IGADMO CS(=O)(=O)N1C[C@@H]2CN(c3nc(Cl)ccc3C[NH+]3CCCC3)C[C@H]2c2ccccc21 ZINC001164972377 722090270 /nfs/dbraw/zinc/09/02/70/722090270.db2.gz GTPRYIIVLWMATK-PKOBYXMFSA-N 1 1 447.004 3.330 20 0 IGADMO CN(C)C(=O)N[C@H]1c2ccccc2[C@H]2CN(c3cc(OC4CC[NH+](C)CC4)ccn3)C[C@@H]12 ZINC001164985727 722098215 /nfs/dbraw/zinc/09/82/15/722098215.db2.gz WJPWRAKKTDXXMB-AKFKNWHVSA-N 1 1 435.572 3.101 20 0 IGADMO COc1cc(C(F)(F)N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)cc(Cl)n1 ZINC001164984684 722103524 /nfs/dbraw/zinc/10/35/24/722103524.db2.gz TYWSDEIRVPTOJG-SJLPKXTDSA-N 1 1 438.906 3.411 20 0 IGADMO CCOC(=O)c1c(C)nc(Cl)cc1N1CC[C@H]2C[N@@H+](Cc3cccnc3)CCO[C@H]2C1 ZINC001164983102 722109097 /nfs/dbraw/zinc/10/90/97/722109097.db2.gz YHCFXUZTSKJBQY-ICSRJNTNSA-N 1 1 444.963 3.342 20 0 IGADMO COc1cc2c(cc1Cl)ncnc2N1CC[C@H]2C[N@@H+](Cc3cccnc3)CCO[C@@H]2C1 ZINC001164981995 722119689 /nfs/dbraw/zinc/11/96/89/722119689.db2.gz VPYILDWYERGWRF-HTAPYJJXSA-N 1 1 439.947 3.414 20 0 IGADMO CCOC(=O)c1cnc(Cl)c(C)c1N1CC[C@H]2C[N@@H+](Cc3cccnc3)CCO[C@H]2C1 ZINC001164973842 722124669 /nfs/dbraw/zinc/12/46/69/722124669.db2.gz HLWQNXRALPMNJY-ICSRJNTNSA-N 1 1 444.963 3.342 20 0 IGADMO COC(=O)c1cc2ccccc2nc1N1CC[C@@H]2C[N@@H+](Cc3cccnc3)CCO[C@H]2C1 ZINC001164979567 722129558 /nfs/dbraw/zinc/12/95/58/722129558.db2.gz LFBSZILPCQVMNT-OFNKIYASSA-N 1 1 432.524 3.144 20 0 IGADMO CCOC(=O)c1nc(N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)ccc1Cl ZINC001164974186 722135053 /nfs/dbraw/zinc/13/50/53/722135053.db2.gz CLLAGKREDGPCNQ-PKOBYXMFSA-N 1 1 430.936 3.034 20 0 IGADMO FC(F)(c1c2c(nnc1Cl)CCC2)N1CC[C@@H]2C[N@@H+](Cc3cccnc3)CCO[C@@H]2C1 ZINC001164982717 722142835 /nfs/dbraw/zinc/14/28/35/722142835.db2.gz SETMZUXMSALMOM-VQIMIIECSA-N 1 1 449.933 3.286 20 0 IGADMO COc1ccccc1-c1cc(N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)ncn1 ZINC001164980885 722144460 /nfs/dbraw/zinc/14/44/60/722144460.db2.gz NHPJZEXDYSHTPV-RDPSFJRHSA-N 1 1 431.540 3.275 20 0 IGADMO COc1cc2nc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)ccc2c(OC)c1 ZINC001164976365 722153349 /nfs/dbraw/zinc/15/33/49/722153349.db2.gz WTGSGRYNXYZDEJ-NTKDMRAZSA-N 1 1 434.540 3.374 20 0 IGADMO Cc1nc2sc3c(c2c(N2CCc4ncnc(N5CC[NH+](C)CC5)c4CC2)n1)CCCC3 ZINC001165002769 722236970 /nfs/dbraw/zinc/23/69/70/722236970.db2.gz YMHITIFZKFMMKY-UHFFFAOYSA-N 1 1 449.628 3.026 20 0 IGADMO C[NH+]1CCN(c2ncnc3c2CCN(C(F)(F)C2(c4ccc(Cl)nc4)CC2)CC3)CC1 ZINC001165002714 722240311 /nfs/dbraw/zinc/24/03/11/722240311.db2.gz FLAXETSIDVFHQZ-UHFFFAOYSA-N 1 1 448.949 3.002 20 0 IGADMO C[NH+]1CCN(c2ncnc3c2CCN(C(F)(F)c2cnc(Cl)c(C4CC4)c2)CC3)CC1 ZINC001165003276 722240410 /nfs/dbraw/zinc/24/04/10/722240410.db2.gz JAKCBXNQNHULOE-UHFFFAOYSA-N 1 1 448.949 3.304 20 0 IGADMO c1ccc(CN2CC[NH+](CCCNc3ccc4nnc(-c5ccccc5)n4n3)CC2)cc1 ZINC000020355789 563024631 /nfs/dbraw/zinc/02/46/31/563024631.db2.gz JQOJWONYNBKTTE-UHFFFAOYSA-N 1 1 427.556 3.411 20 0 IGADMO O=C(CCCCCn1c(=O)c2ccccc2[nH]c1=S)N1CCN(c2cc[nH+]cc2)CC1 ZINC000024087344 563027281 /nfs/dbraw/zinc/02/72/81/563027281.db2.gz CXQAJWJXWIRDIN-UHFFFAOYSA-N 1 1 437.569 3.363 20 0 IGADMO CCN(CC)S(=O)(=O)c1ccc(N2CCC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)nc1 ZINC001164626840 719097444 /nfs/dbraw/zinc/09/74/44/719097444.db2.gz JEKMLIAVYZUVHR-IFMALSPDSA-N 1 1 428.602 3.213 20 0 IGADMO COCCN1CC[N@H+](C)C2(CCN(c3c(Cl)ccc4ccc(Cl)nc43)CC2)C1=O ZINC001164644095 719284176 /nfs/dbraw/zinc/28/41/76/719284176.db2.gz CKKFNQMZNYRWEQ-UHFFFAOYSA-N 1 1 437.371 3.301 20 0 IGADMO COCCN1CC[N@@H+](C)C2(CCN(c3c(Cl)ccc4ccc(Cl)nc43)CC2)C1=O ZINC001164644095 719284179 /nfs/dbraw/zinc/28/41/79/719284179.db2.gz CKKFNQMZNYRWEQ-UHFFFAOYSA-N 1 1 437.371 3.301 20 0 IGADMO COC(=O)c1ccc2nc(Cl)c(N3CCc4c(C[NH+](C)C)nn(C(C)C)c4C3)nc2c1 ZINC001164649708 719307765 /nfs/dbraw/zinc/30/77/65/719307765.db2.gz WQTXDYIENIBLNZ-UHFFFAOYSA-N 1 1 442.951 3.472 20 0 IGADMO CC(C)n1nc(CN(C)C)c2c1CN(c1ncnc3c1CC[N@H+](Cc1ccccc1)C3)CC2 ZINC001164647534 719310612 /nfs/dbraw/zinc/31/06/12/719310612.db2.gz CMMCUYZUFOAZFZ-UHFFFAOYSA-N 1 1 445.615 3.437 20 0 IGADMO CC(C)n1nc(CN(C)C)c2c1CN(c1ncnc3c1CC[N@@H+](Cc1ccccc1)C3)CC2 ZINC001164647534 719310615 /nfs/dbraw/zinc/31/06/15/719310615.db2.gz CMMCUYZUFOAZFZ-UHFFFAOYSA-N 1 1 445.615 3.437 20 0 IGADMO CN(C)c1nc(N2CCOC[C@@]3(CCCN([C@@H](F)c4ccnc(Cl)c4)C3)C2)cc[nH+]1 ZINC001164663790 719357100 /nfs/dbraw/zinc/35/71/00/719357100.db2.gz HEKCVYBWNUSZCF-CTNGQTDRSA-N 1 1 434.947 3.178 20 0 IGADMO NC(=O)c1cc2ccccc2c(N2CCC3(CC2)COCC[N@@H+]3Cc2ccc(F)cc2)n1 ZINC001164673981 719525173 /nfs/dbraw/zinc/52/51/73/719525173.db2.gz WUPUXZGDTBPCDU-UHFFFAOYSA-N 1 1 434.515 3.344 20 0 IGADMO NC(=O)c1cc2ccccc2c(N2CCC3(CC2)COCC[N@H+]3Cc2ccc(F)cc2)n1 ZINC001164673981 719525181 /nfs/dbraw/zinc/52/51/81/719525181.db2.gz WUPUXZGDTBPCDU-UHFFFAOYSA-N 1 1 434.515 3.344 20 0 IGADMO CNC(=O)C[N@H+]1CCCC12CCN(c1nc(-c3ccccc3)nc(-c3ccccc3)n1)CC2 ZINC001164682147 719715131 /nfs/dbraw/zinc/71/51/31/719715131.db2.gz BJBZRKNICVICHQ-UHFFFAOYSA-N 1 1 442.567 3.386 20 0 IGADMO CNC(=O)C[N@H+]1CCCC12CCN(C(F)(F)c1cc(-c3ccco3)nnc1Cl)CC2 ZINC001164690039 719742416 /nfs/dbraw/zinc/74/24/16/719742416.db2.gz QKVXUXBFQWDJIT-UHFFFAOYSA-N 1 1 439.894 3.116 20 0 IGADMO Cc1nc(CN2CCCC23CCN(c2ccc(OCC4CC[NH2+]CC4)nn2)CC3)cs1 ZINC001164692626 719815948 /nfs/dbraw/zinc/81/59/48/719815948.db2.gz PODMPTXRUDGOFK-UHFFFAOYSA-N 1 1 442.633 3.255 20 0 IGADMO COC(=O)[C@@]1(C)C[C@@H]([NH+]2CCOCC2)CCN1c1cc(F)ccc1-c1ccc(Cl)nn1 ZINC001164699201 719872397 /nfs/dbraw/zinc/87/23/97/719872397.db2.gz AXLRKQVLCBNXOF-KSFYIVLOSA-N 1 1 448.926 3.169 20 0 IGADMO COC(=O)[C@]1(C)C[C@H]([NH+]2CCOCC2)CCN1c1c(Cl)ccc2c(Cl)ncnc21 ZINC001164700820 719879540 /nfs/dbraw/zinc/87/95/40/719879540.db2.gz MFEUXGUWWVQQSX-XCLFUZPHSA-N 1 1 439.343 3.169 20 0 IGADMO COC(=O)c1ccc2ncnc(N3CCC4(CC3)C[N@@H+](Cc3cccs3)CCO4)c2c1 ZINC001164694990 719888017 /nfs/dbraw/zinc/88/80/17/719888017.db2.gz IWLGYGUFPFAIOI-UHFFFAOYSA-N 1 1 438.553 3.349 20 0 IGADMO COC(=O)c1cc2c[nH]c(N3CCC4(CC3)C[N@@H+](Cc3cccs3)CCO4)cc-2n1 ZINC001164696277 719896530 /nfs/dbraw/zinc/89/65/30/719896530.db2.gz FNBSEVBVEYYULK-UHFFFAOYSA-N 1 1 426.542 3.282 20 0 IGADMO CCOC(=O)c1cnc(CC)nc1N1CCC2(CC1)C[N@H+](Cc1cccs1)CCO2 ZINC001164705345 719903996 /nfs/dbraw/zinc/90/39/96/719903996.db2.gz AMHNSLVFHWGAGK-UHFFFAOYSA-N 1 1 430.574 3.149 20 0 IGADMO CCOC(=O)c1cnc(CC)nc1N1CCC2(CC1)C[N@@H+](Cc1cccs1)CCO2 ZINC001164705345 719904009 /nfs/dbraw/zinc/90/40/09/719904009.db2.gz AMHNSLVFHWGAGK-UHFFFAOYSA-N 1 1 430.574 3.149 20 0 IGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2CCOC[C@]3(CC[C@@H](Cn4cccn4)O3)C2)nc1 ZINC001164804536 720051700 /nfs/dbraw/zinc/05/17/00/720051700.db2.gz LLXHHQOMDYWQAK-ZDXQCDESSA-N 1 1 425.577 3.280 20 0 IGADMO CCOC(=O)c1ccc(C)c(N2CCC3(C[C@H](COC)[N@@H+](Cc4ccccn4)C3)CC2)n1 ZINC001164710983 720092206 /nfs/dbraw/zinc/09/22/06/720092206.db2.gz MNDDBHKXKFYNLT-OAQYLSRUSA-N 1 1 438.572 3.469 20 0 IGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(C(F)(F)c1cnc(Cl)c(C(=O)OC)c1)C2 ZINC001164809255 720096969 /nfs/dbraw/zinc/09/69/69/720096969.db2.gz IZPBYZXUIAURQY-OXJNMPFZSA-N 1 1 443.922 3.251 20 0 IGADMO CCOC(=O)c1cc(F)cnc1N1CCC2(C[C@@H](COC)[N@@H+](Cc3ccccn3)C2)CC1 ZINC001164709941 720103037 /nfs/dbraw/zinc/10/30/37/720103037.db2.gz DBNRJXNYHKJIOH-FQEVSTJZSA-N 1 1 442.535 3.300 20 0 IGADMO COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1nc(Cl)nc(SC)n1)CC2 ZINC001164718557 720107689 /nfs/dbraw/zinc/10/76/89/720107689.db2.gz SETKMMZYSFTQKG-MRXNPFEDSA-N 1 1 434.997 3.149 20 0 IGADMO COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1[nH]c3cc(=O)[nH]c-3cc1Cl)CC2 ZINC001164718105 720119864 /nfs/dbraw/zinc/11/98/64/720119864.db2.gz RRVPFJHAZSKTBY-KRWDZBQOSA-N 1 1 441.963 3.132 20 0 IGADMO COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1cc3nc(C(=O)OC)cc-3c[nH]1)CC2 ZINC001164710392 720135180 /nfs/dbraw/zinc/13/51/80/720135180.db2.gz ATYRGUISFZFGCS-FQEVSTJZSA-N 1 1 449.555 3.252 20 0 IGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1ncccc1C(=O)N1CCc3ccccc31)C2 ZINC001164815555 720164952 /nfs/dbraw/zinc/16/49/52/720164952.db2.gz IDPCDQJFUNNDCT-CUNXSJBXSA-N 1 1 446.595 3.469 20 0 IGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1ccc(C(=O)N3CCC(C)CC3)cn1)C2 ZINC001164819551 720167386 /nfs/dbraw/zinc/16/73/86/720167386.db2.gz XSZBMYFEABWQPS-RDGATRHJSA-N 1 1 426.605 3.138 20 0 IGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1ccc(-c3ccc4c(c3)OCCO4)nn1)C2 ZINC001164814433 720172099 /nfs/dbraw/zinc/17/20/99/720172099.db2.gz GLEMDDXYFKSMGN-NBGIEHNGSA-N 1 1 436.556 3.100 20 0 IGADMO CC(C)[N@@H+](C)Cc1cc(=O)n2c(n1)CN(C(F)(F)c1ccc(F)c(Cl)n1)CCC2 ZINC001164813364 720214476 /nfs/dbraw/zinc/21/44/76/720214476.db2.gz OYSAWZRAABHGGS-UHFFFAOYSA-N 1 1 429.874 3.226 20 0 IGADMO CC(C)[N@@H+](C)Cc1cc(=O)n2c(n1)CN(c1nc(Cl)nc3c(Cl)nccc31)CCC2 ZINC001164814509 720234194 /nfs/dbraw/zinc/23/41/94/720234194.db2.gz WIMSMRYLEAFRMY-UHFFFAOYSA-N 1 1 448.358 3.139 20 0 IGADMO CCOC(=O)c1cc(N2CC[C@@H]3[C@H](C[C@@H](Cn4cccn4)[N@H+]3C(C)C)C2)ncc1Cl ZINC001164839049 720513049 /nfs/dbraw/zinc/51/30/49/720513049.db2.gz SEXIBUDJBJFKRG-FUHIMQAGSA-N 1 1 431.968 3.486 20 0 IGADMO CC(C)[N@@H+]1[C@@H]2CCN(c3ccc(NC(=O)C(C)(C)C)nn3)C[C@@H]2C[C@H]1Cn1cccn1 ZINC001164842967 720543510 /nfs/dbraw/zinc/54/35/10/720543510.db2.gz ZGWOBTSBYQMBSS-GBESFXJTSA-N 1 1 425.581 3.036 20 0 IGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@H]2CN(c3ccc(NC(=O)C(C)(C)C)nn3)CC[C@@H]21 ZINC001164842966 720543931 /nfs/dbraw/zinc/54/39/31/720543931.db2.gz ZGWOBTSBYQMBSS-FHWLQOOXSA-N 1 1 425.581 3.036 20 0 IGADMO CCOC(=O)c1ccc2ncnc(N3CC[C@@H]4[C@@H](C[C@H](Cn5cccn5)[N@H+]4C(C)C)C3)c2c1 ZINC001164834967 720545641 /nfs/dbraw/zinc/54/56/41/720545641.db2.gz GCYVRHCGWVUZEQ-MIZPHKNDSA-N 1 1 448.571 3.381 20 0 IGADMO COc1nc(Cl)ncc1C(F)(F)N1CC[C@@H]2[C@@H](C[C@H](Cn3cccn3)[N@H+]2C(C)C)C1 ZINC001164838770 720588513 /nfs/dbraw/zinc/58/85/13/720588513.db2.gz LPYXLLGAYVADFS-ZMSDIMECSA-N 1 1 440.926 3.258 20 0 IGADMO CC(C)[N@@H+]1[C@@H]2CCN(C(F)(F)c3cc[n+]([O-])c(Cl)c3)C[C@H]2C[C@H]1Cn1cccn1 ZINC001164837004 720647018 /nfs/dbraw/zinc/64/70/18/720647018.db2.gz AQTPAIXQZOERJO-BPQIPLTHSA-N 1 1 425.911 3.093 20 0 IGADMO FC(F)(c1nc2ccsc2c(Cl)n1)N1CC[N@@H+]2C[C@H](Oc3cncnc3)C[C@@H]2C1 ZINC001164743638 720649599 /nfs/dbraw/zinc/64/95/99/720649599.db2.gz PUOFHDAGMGZACF-VXGBXAGGSA-N 1 1 438.891 3.022 20 0 IGADMO FC(F)(c1nc2ccsc2c(Cl)n1)N1CC[N@H+]2C[C@H](Oc3cncnc3)C[C@@H]2C1 ZINC001164743638 720649609 /nfs/dbraw/zinc/64/96/09/720649609.db2.gz PUOFHDAGMGZACF-VXGBXAGGSA-N 1 1 438.891 3.022 20 0 IGADMO C[N@@H+](Cc1ccccc1)[C@H]1COC2(C1)CCN(c1[nH]c3cc(=O)[nH]c-3cc1Cl)CC2 ZINC001164843675 720692989 /nfs/dbraw/zinc/69/29/89/720692989.db2.gz QFDBYQMMMGRRKD-QGZVFWFLSA-N 1 1 426.948 3.490 20 0 IGADMO CNC(=O)c1nc(N2CCC3(C[C@@H]([N@@H+](C)Cc4ccccc4)CO3)CC2)ccc1Cl ZINC001164843831 720698846 /nfs/dbraw/zinc/69/88/46/720698846.db2.gz RHDHCIAFRRDDOA-GOSISDBHSA-N 1 1 428.964 3.355 20 0 IGADMO CCOC(=O)c1cnc(CC)nc1N1CCC2(C[C@@H]([N@@H+](C)Cc3ccccc3)CO2)CC1 ZINC001164838330 720723489 /nfs/dbraw/zinc/72/34/89/720723489.db2.gz HZUCAFHOESVKQW-HXUWFJFHSA-N 1 1 438.572 3.476 20 0 IGADMO CSc1ccc(Oc2cc(N3CC[N@H+]4C[C@@H](Oc5cncnc5)C[C@H]4C3)ncn2)cc1 ZINC001164739937 720744028 /nfs/dbraw/zinc/74/40/28/720744028.db2.gz JYSCNELEJSTIRX-WMZOPIPTSA-N 1 1 436.541 3.123 20 0 IGADMO C[NH+]1CCC(Oc2ccnc(N3CC[C@@H]4O[C@H](COCc5ccccn5)CC[C@@H]43)c2)CC1 ZINC001164846185 720779344 /nfs/dbraw/zinc/77/93/44/720779344.db2.gz IDZPUTQDVDKQQK-HJOGWXRNSA-N 1 1 438.572 3.293 20 0 IGADMO COc1cc2c(cc1F)cc(Cl)nc2N1CC[N@H+]2C[C@@H](Oc3cncnc3)C[C@H]2C1 ZINC001164748233 720807247 /nfs/dbraw/zinc/80/72/47/720807247.db2.gz QCFMPXVWWZCYEM-GJZGRUSLSA-N 1 1 429.883 3.168 20 0 IGADMO CSc1nc2sccc2c(N2CC[C@@H]3[C@H](C[C@@H](Cn4cncn4)[N@H+]3CC3CC3)C2)n1 ZINC001164751218 720814111 /nfs/dbraw/zinc/81/41/11/720814111.db2.gz XMAHVPVUDLCXFH-SOLBZPMBSA-N 1 1 441.630 3.384 20 0 IGADMO CSc1nc2c(c(N3CC[C@@H]4[C@@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)n1)CCCC2 ZINC001164739252 720826346 /nfs/dbraw/zinc/82/63/46/720826346.db2.gz HWEFMBUKKYVZGF-WAOWUJCRSA-N 1 1 439.633 3.048 20 0 IGADMO Fc1cnc(Cl)cc1C(F)(F)N1CC[C@@H]2[C@@H](C[C@@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164741205 720827936 /nfs/dbraw/zinc/82/79/36/720827936.db2.gz MHNHFJVQLXMZNU-RLFYNMQTSA-N 1 1 440.901 3.390 20 0 IGADMO CCc1c(Cl)nnc(N2CC[C@@H]3[C@@H](C[C@H](Cn4cncn4)[N@H+]3CC3CC3)C2)c1CC ZINC001164743293 720830326 /nfs/dbraw/zinc/83/03/26/720830326.db2.gz RYAOIVSEEREMPN-SQGPQFPESA-N 1 1 430.000 3.226 20 0 IGADMO c1ncn(C[C@H]2C[C@H]3CN(c4ncnc5[nH]c6ccccc6c54)CC[C@H]3[N@H+]2CC2CC2)n1 ZINC001164741169 720832817 /nfs/dbraw/zinc/83/28/17/720832817.db2.gz DNHFOFIFPXMXHS-WAOWUJCRSA-N 1 1 428.544 3.082 20 0 IGADMO c1ncn(C[C@H]2C[C@H]3CN(c4ncc5c(n4)-c4ccccc4CC5)CC[C@H]3[N@H+]2CC2CC2)n1 ZINC001164747431 720841795 /nfs/dbraw/zinc/84/17/95/720841795.db2.gz QMJZMEOCQYFPNN-WMTXJRDZSA-N 1 1 441.583 3.213 20 0 IGADMO CC(C)(C)c1nc2[nH]ccc2c(N2CC[C@@H]3[C@@H](C[C@H](Cn4cncn4)[N@H+]3CC3CC3)C2)n1 ZINC001164741721 720842179 /nfs/dbraw/zinc/84/21/79/720842179.db2.gz FODSEMPPCVREES-NLWGTHIKSA-N 1 1 434.592 3.226 20 0 IGADMO CC(C)(C)c1cc(Cl)nc(N2CC[C@@H]3[C@H](C[C@@H](Cn4cncn4)[N@H+]3CC3CC3)C2)n1 ZINC001164742542 720842409 /nfs/dbraw/zinc/84/24/09/720842409.db2.gz HLAOZXWGFLQYSR-FGTMMUONSA-N 1 1 430.000 3.398 20 0 IGADMO CCc1cc2c(nc(Cl)nc2N2CC[C@@H]3[C@@H](C[C@H](Cn4cncn4)[N@H+]3CC3CC3)C2)[nH]1 ZINC001164747539 720843037 /nfs/dbraw/zinc/84/30/37/720843037.db2.gz REFRBANKHGUSLX-KVSKMBFKSA-N 1 1 440.983 3.145 20 0 IGADMO Cc1nc(-c2ccccn2)nc(N2CC[C@@H]3[C@H](C[C@@H](Cn4cncn4)[N@H+]3CC3CC3)C2)c1C ZINC001164752678 720853039 /nfs/dbraw/zinc/85/30/39/720853039.db2.gz UGIGPAWMQOUFFJ-FUPPJEDESA-N 1 1 444.587 3.126 20 0 IGADMO FC(F)(Oc1ccnc(Cl)c1)N1CC[C@@H]2[C@@H](C[C@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164753898 720857587 /nfs/dbraw/zinc/85/75/87/720857587.db2.gz ZBDHCXBBKMZHEK-LZLYRXPVSA-N 1 1 438.910 3.131 20 0 IGADMO CSc1nccc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COCc2cccnc2)n1 ZINC001164749733 720871212 /nfs/dbraw/zinc/87/12/12/720871212.db2.gz HUZGHMBLHBNIIP-OFNKIYASSA-N 1 1 425.602 3.349 20 0 IGADMO C[NH+]1CCC(Oc2ccnc(N3CCC4(C3)CCN(C(=O)c3cccnc3)CC4)c2)CC1 ZINC001164855079 720894964 /nfs/dbraw/zinc/89/49/64/720894964.db2.gz AFTQMYMTONEFOJ-UHFFFAOYSA-N 1 1 435.572 3.082 20 0 IGADMO CC(C)[N@@H+](C)Cc1cnc2n1CCN(c1nc3ccccc3nc1N1CCOCC1)[C@H]2C ZINC001164862515 720958099 /nfs/dbraw/zinc/95/80/99/720958099.db2.gz VYDAOZWWYVCRSL-SFHVURJKSA-N 1 1 435.576 3.084 20 0 IGADMO COC(=O)c1cc2c(nc(Cl)nc2N2CCn3c(C[N@@H+](C)C(C)C)cnc3[C@H]2C)[nH]1 ZINC001164864149 720973931 /nfs/dbraw/zinc/97/39/31/720973931.db2.gz YDOYAIASGFAYOP-GFCCVEGCSA-N 1 1 431.928 3.016 20 0 IGADMO CC(C)[N@@H+](C)Cc1cnc2n1CCN(C(F)(F)c1cc(N(C)C)nc(Cl)n1)[C@@H]2C ZINC001164861219 721016996 /nfs/dbraw/zinc/01/69/96/721016996.db2.gz NUVAHKKNLYYPBK-CYBMUJFWSA-N 1 1 427.931 3.359 20 0 IGADMO CCOC(=O)c1c(Cl)cc(C)nc1N1CC[N@H+]2C[C@H](OCc3cccnc3)C[C@H]2C1 ZINC001164869915 721050052 /nfs/dbraw/zinc/05/00/52/721050052.db2.gz UICNZFCOLOSGFS-ZWKOTPCHSA-N 1 1 430.936 3.095 20 0 IGADMO COCc1cc(N2CC[N@H+]3C[C@H](OCc4cccnc4)C[C@@H]3C2)nc(-c2ccccc2)n1 ZINC001164865855 721052125 /nfs/dbraw/zinc/05/21/25/721052125.db2.gz APVCQYMHTWBYLB-DHIUTWEWSA-N 1 1 431.540 3.165 20 0 IGADMO CCOC(=O)c1c(C)cc(Cl)nc1N1CC[N@H+]2C[C@H](OCc3cccnc3)C[C@H]2C1 ZINC001164871477 721073118 /nfs/dbraw/zinc/07/31/18/721073118.db2.gz YYZSWKMLQMFWGW-ZWKOTPCHSA-N 1 1 430.936 3.095 20 0 IGADMO CCOC(=O)c1cc(Cl)nc(N2CC[N@H+]3C[C@@H](OCc4cccnc4)C[C@@H]3C2)c1C ZINC001164867711 721085560 /nfs/dbraw/zinc/08/55/60/721085560.db2.gz ZSQNPRNJSJNGCQ-MSOLQXFVSA-N 1 1 430.936 3.095 20 0 IGADMO CCOC(=O)c1cc(Cl)nc(N2CC[N@H+]3C[C@H](OCc4cccnc4)C[C@H]3C2)c1C ZINC001164867720 721085856 /nfs/dbraw/zinc/08/58/56/721085856.db2.gz ZSQNPRNJSJNGCQ-ZWKOTPCHSA-N 1 1 430.936 3.095 20 0 IGADMO COc1ccc2nc(Cl)cc(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@@H]4C3)c2n1 ZINC001164865181 721095903 /nfs/dbraw/zinc/09/59/03/721095903.db2.gz JKXSPCCIGPYUOI-SJORKVTESA-N 1 1 425.920 3.167 20 0 IGADMO CCN(CC)C(=O)c1cc(Cl)nc(N2CC[N@H+]3C[C@@H](OCc4cccnc4)C[C@H]3C2)c1 ZINC001164867219 721101587 /nfs/dbraw/zinc/10/15/87/721101587.db2.gz XAZYTGVYQRQDBJ-PMACEKPBSA-N 1 1 443.979 3.092 20 0 IGADMO CC(C)(C)OC(=O)Nc1ccc(N2CC[N@H+]3C[C@H](OCc4cccnc4)C[C@H]3C2)nc1 ZINC001164873611 721134598 /nfs/dbraw/zinc/13/45/98/721134598.db2.gz IYVINUVDWGGSQR-VQTJNVASSA-N 1 1 425.533 3.303 20 0 IGADMO CCOc1cc2ncnc(N3C[C@@H]4CC[N@@H+](Cc5cnn(C)c5)C[C@H]4C3)c2cc1OCC ZINC001164763390 721134901 /nfs/dbraw/zinc/13/49/01/721134901.db2.gz FLKCUZKMUOKLTO-OALUTQOASA-N 1 1 436.560 3.119 20 0 IGADMO c1ccc2nc(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@H]4C3)c(N3CCCCC3)nc2c1 ZINC001164874429 721135875 /nfs/dbraw/zinc/13/58/75/721135875.db2.gz JXOOMVYDEKKPLS-FCHUYYIVSA-N 1 1 444.583 3.495 20 0 IGADMO Cc1ccc(-c2nc3c(ncnc3N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@@H]4C3)o2)cc1 ZINC001164871091 721151456 /nfs/dbraw/zinc/15/14/56/721151456.db2.gz DMUKKINMCNSPOD-RTWAWAEBSA-N 1 1 442.523 3.468 20 0 IGADMO Cc1cc(OCc2ccccc2)nc(N2CC[N@H+]3C[C@H](OCc4cccnc4)C[C@H]3C2)n1 ZINC001164880429 721172731 /nfs/dbraw/zinc/17/27/31/721172731.db2.gz WNJQVRHKFATDBB-XZOQPEGZSA-N 1 1 431.540 3.239 20 0 IGADMO Cc1cc(OCc2ccccc2)nc(N2CC[N@H+]3C[C@H](OCc4cccnc4)C[C@@H]3C2)n1 ZINC001164880426 721173741 /nfs/dbraw/zinc/17/37/41/721173741.db2.gz WNJQVRHKFATDBB-DHIUTWEWSA-N 1 1 431.540 3.239 20 0 IGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4nc(-c5cccnc5)nc5ccccc54)C[C@H]3C2)cn1 ZINC001164772330 721195386 /nfs/dbraw/zinc/19/53/86/721195386.db2.gz SGOMHSSNJWNIGO-LEWJYISDSA-N 1 1 425.540 3.384 20 0 IGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4ncnc5c(-c6ccccc6)nsc54)C[C@@H]3C2)cn1 ZINC001164772383 721204136 /nfs/dbraw/zinc/20/41/36/721204136.db2.gz UKDSCWVFVFXUQR-OALUTQOASA-N 1 1 431.569 3.445 20 0 IGADMO Cc1ccc2c(c1)cc(Cl)nc2N1CCC2(CC1)COCC[N@H+](CC(=O)N(C)C)C2 ZINC001164875281 721281323 /nfs/dbraw/zinc/28/13/23/721281323.db2.gz UYNJBLLJLFMGOB-UHFFFAOYSA-N 1 1 430.980 3.204 20 0 IGADMO C[N@@H+](Cc1ccc(N2CC[C@@H]3CN(C(=O)c4ccsc4)CCO[C@H]3C2)nc1)C1CC1 ZINC001164876604 721299381 /nfs/dbraw/zinc/29/93/81/721299381.db2.gz JJAWOZJPZWEULU-NQIIRXRSSA-N 1 1 426.586 3.105 20 0 IGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@]2(CCCN(C(F)(F)c3cnc(Cl)nc3)C2)C1 ZINC001164777822 721339468 /nfs/dbraw/zinc/33/94/68/721339468.db2.gz IJOLORGRHQBFGJ-LJQANCHMSA-N 1 1 441.910 3.399 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@]2(CCCN(C(F)(F)c3cnc(Cl)nc3)C2)C1 ZINC001164777822 721339474 /nfs/dbraw/zinc/33/94/74/721339474.db2.gz IJOLORGRHQBFGJ-LJQANCHMSA-N 1 1 441.910 3.399 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@@]2(CCCN(c3nc(Cl)nc4cccnc43)C2)C1 ZINC001164778766 721341086 /nfs/dbraw/zinc/34/10/86/721341086.db2.gz OJXNOHUULYSNQN-QFIPXVFZSA-N 1 1 442.951 3.402 20 0 IGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@@]2(CCCN(c3nccc(OC(C)(C)C)n3)C2)C1 ZINC001164780108 721351745 /nfs/dbraw/zinc/35/17/45/721351745.db2.gz ZSWAXJZSWGCSJV-QHCPKHFHSA-N 1 1 429.565 3.378 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@@]2(CCCN(c3nccc(OC(C)(C)C)n3)C2)C1 ZINC001164780108 721351749 /nfs/dbraw/zinc/35/17/49/721351749.db2.gz ZSWAXJZSWGCSJV-QHCPKHFHSA-N 1 1 429.565 3.378 20 0 IGADMO CCN(CC)c1cc(N2CCC[C@@]3(C2)COCC[N@H+](Cc2c(C)noc2C)C3)ncn1 ZINC001164784085 721359084 /nfs/dbraw/zinc/35/90/84/721359084.db2.gz QIZNEWNVZWDYIS-HSZRJFAPSA-N 1 1 428.581 3.047 20 0 IGADMO CCN(CC)c1cc(N2CCC[C@@]3(C2)COCC[N@@H+](Cc2c(C)noc2C)C3)ncn1 ZINC001164784085 721359087 /nfs/dbraw/zinc/35/90/87/721359087.db2.gz QIZNEWNVZWDYIS-HSZRJFAPSA-N 1 1 428.581 3.047 20 0 IGADMO COC(OC)c1cc(C)cnc1N1CCC[C@]2(C1)COCC[N@H+](Cc1c(C)noc1C)C2 ZINC001164779976 721361685 /nfs/dbraw/zinc/36/16/85/721361685.db2.gz BSXSUCRIDMNJGN-DEOSSOPVSA-N 1 1 444.576 3.405 20 0 IGADMO COC(OC)c1cc(C)cnc1N1CCC[C@]2(C1)COCC[N@@H+](Cc1c(C)noc1C)C2 ZINC001164779976 721361692 /nfs/dbraw/zinc/36/16/92/721361692.db2.gz BSXSUCRIDMNJGN-DEOSSOPVSA-N 1 1 444.576 3.405 20 0 IGADMO Cc1noc(-c2cccnc2N2CCC[C@@]3(C2)COCC[N@@H+](Cc2c(C)noc2C)C3)n1 ZINC001164781380 721366856 /nfs/dbraw/zinc/36/68/56/721366856.db2.gz IURCXGATXIBEMF-HSZRJFAPSA-N 1 1 438.532 3.164 20 0 IGADMO Cn1cc(N2C[C@]3(CCN(c4ccc5c(n4)CC[N@H+](Cc4ccccc4)C5)C3)CC2=O)cn1 ZINC001164887408 721370675 /nfs/dbraw/zinc/37/06/75/721370675.db2.gz QXMVZQLVTJIOIV-AREMUKBSSA-N 1 1 442.567 3.007 20 0 IGADMO COc1cc(C(F)(F)N2CC[C@]3(C2)CCC[C@H](CN2CC[NH+](C)CC2)O3)cc(Cl)n1 ZINC001164890470 721387690 /nfs/dbraw/zinc/38/76/90/721387690.db2.gz NMAFYGLASYLOQX-XLIONFOSSA-N 1 1 444.954 3.054 20 0 IGADMO C[NH+]1CCN(C[C@@H]2CCC[C@@]3(CCN(c4nccnc4C4SCCCS4)C3)O2)CC1 ZINC001164889360 721399161 /nfs/dbraw/zinc/39/91/61/721399161.db2.gz LUIOJXRFPGPVSK-AVRDEDQJSA-N 1 1 449.690 3.111 20 0 IGADMO Cc1cc2c(nc(Cl)nc2N2CC[C@@]3(C2)CCC[C@@H](CN2CC[NH+](C)CC2)O3)s1 ZINC001164886099 721399951 /nfs/dbraw/zinc/39/99/51/721399951.db2.gz HUPLYWYCJBNIDY-HRAATJIYSA-N 1 1 436.025 3.419 20 0 IGADMO Clc1nc(Cl)c2nc(Cl)nc(N3C[C@@H]4C[NH+](Cc5nccs5)C[C@H]4C3)c2n1 ZINC001164782850 721400379 /nfs/dbraw/zinc/40/03/79/721400379.db2.gz GBCZMKUZNPGUPW-IUCAKERBSA-N 1 1 442.763 3.405 20 0 IGADMO CSc1nc2ccsc2c(N2CC[C@]3(C2)CCC[C@@H](CN2CC[NH+](C)CC2)O3)n1 ZINC001164891955 721407109 /nfs/dbraw/zinc/40/71/09/721407109.db2.gz WYHKHUKNHXAFKV-KKSFZXQISA-N 1 1 433.647 3.179 20 0 IGADMO Clc1nc2c(ncn2[C@H]2CCCCO2)c(N2C[C@@H]3C[NH+](Cc4nccs4)C[C@H]3C2)n1 ZINC001164786258 721409213 /nfs/dbraw/zinc/40/92/13/721409213.db2.gz OQHBSMJIVNGSIF-OFQRWUPVSA-N 1 1 445.980 3.204 20 0 IGADMO CCOC(=O)c1cc2c(N3C[C@@H]4C[N@H+](Cc5nccs5)C[C@@H]4C3)[nH]c(C)c(C)c-2n1 ZINC001164781724 721416099 /nfs/dbraw/zinc/41/60/99/721416099.db2.gz DERPGEHYPSLUET-IYBDPMFKSA-N 1 1 425.558 3.381 20 0 IGADMO CC(C)n1ccc2c1nc(Cl)nc2N1CC[C@@]2(C1)CCC[C@@H](CN1CC[NH+](C)CC1)O2 ZINC001164891503 721430052 /nfs/dbraw/zinc/43/00/52/721430052.db2.gz GTPINMJMFKOFDK-FDDCHVKYSA-N 1 1 447.027 3.431 20 0 IGADMO CC(C)n1ccc2c1nc(Cl)nc2N1CC[C@]2(C1)CCC[C@H](CN1CC[NH+](C)CC1)O2 ZINC001164891504 721430101 /nfs/dbraw/zinc/43/01/01/721430101.db2.gz GTPINMJMFKOFDK-JPYJTQIMSA-N 1 1 447.027 3.431 20 0 IGADMO CCc1ccc(-c2ccc(N3CC[C@]4(C3)CCC[C@@H](CN3CC[NH+](C)CC3)O4)nn2)cc1 ZINC001164894430 721440662 /nfs/dbraw/zinc/44/06/62/721440662.db2.gz MOLMXXAQOFTUHX-OZXSUGGESA-N 1 1 435.616 3.471 20 0 IGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1ncc(C)c(N3CCCC3)n1)CC2 ZINC001164790555 721448660 /nfs/dbraw/zinc/44/86/60/721448660.db2.gz ZCWHELSFXDETAZ-QFIPXVFZSA-N 1 1 443.636 3.119 20 0 IGADMO CCOC(=O)c1ccc(N2CCC3(C[C@H](COCC4CC4)[N@@H+](CCOC)C3)CC2)nc1C ZINC001164784986 721450248 /nfs/dbraw/zinc/45/02/48/721450248.db2.gz GADAZOKFOOQPOF-OAQYLSRUSA-N 1 1 445.604 3.301 20 0 IGADMO C[NH+]1CCN(C[C@H]2CCC[C@]3(CCN(c4c(Cl)nc(Cl)nc4C4CC4)C3)O2)CC1 ZINC001164886474 721450851 /nfs/dbraw/zinc/45/08/51/721450851.db2.gz GSCGXCHICQIDGV-IIBYNOLFSA-N 1 1 440.419 3.426 20 0 IGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1nc(Cl)nc3c1CCC3)CC2 ZINC001164787899 721452845 /nfs/dbraw/zinc/45/28/45/721452845.db2.gz RFIVISZPMBXRKT-SFHVURJKSA-N 1 1 435.012 3.353 20 0 IGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1cc3c(nn1)CC[C@@H](C)C3)CC2 ZINC001164789558 721470553 /nfs/dbraw/zinc/47/05/53/721470553.db2.gz OEAXWEYXGFJMGJ-DENIHFKCSA-N 1 1 428.621 3.335 20 0 IGADMO CN1Cc2ccccc2CC2(CCN(c3cc(OC4CC[NH+](C)CC4)ccn3)CC2)C1=O ZINC001164891638 721474097 /nfs/dbraw/zinc/47/40/97/721474097.db2.gz DJSRTHQLTHCKDS-UHFFFAOYSA-N 1 1 434.584 3.356 20 0 IGADMO CCC[N@H+]1CCCC[C@@H]1c1ccc(N2C[C@H]3COC[C@@]3(CC(=O)NCC3CC3)C2)nc1 ZINC001164893904 721484504 /nfs/dbraw/zinc/48/45/04/721484504.db2.gz FSNOIGKSPCOGNF-SGIRGMQISA-N 1 1 426.605 3.388 20 0 IGADMO C[N@@H+](Cc1ccncc1)C1CC2(C1)CCN(c1nc(Cl)c(F)c3c1C(=O)NC3)CC2 ZINC001164792518 721496672 /nfs/dbraw/zinc/49/66/72/721496672.db2.gz QAKYADWYMORYHE-UHFFFAOYSA-N 1 1 429.927 3.394 20 0 IGADMO CCOC(=O)c1cnc(C2CC2)nc1N1CC[N@H+]2C[C@@H](Oc3cccc(F)c3)C[C@H]2C1 ZINC001164908256 721534147 /nfs/dbraw/zinc/53/41/47/721534147.db2.gz PPABFFFXUPWEFZ-HKUYNNGSSA-N 1 1 426.492 3.012 20 0 IGADMO CCOC(=O)c1cc2ncnc(N3CC[N@H+]4C[C@H](Oc5cccc(F)c5)C[C@H]4C3)c2s1 ZINC001164907290 721544798 /nfs/dbraw/zinc/54/47/98/721544798.db2.gz MVARGZDGCPPVAJ-DOTOQJQBSA-N 1 1 442.516 3.349 20 0 IGADMO CC(C)(C)C(=O)Nc1ccc(CO)nc1N1CC[N@H+]2C[C@H](Oc3cccc(F)c3)C[C@H]2C1 ZINC001164906369 721547043 /nfs/dbraw/zinc/54/70/43/721547043.db2.gz KFMIFALPYXHFNJ-AZUAARDMSA-N 1 1 442.535 3.040 20 0 IGADMO Fc1cccc(O[C@H]2C[C@@H]3CN(C(F)(F)c4cc(Cl)nc(=S)[nH]4)CC[N@H+]3C2)c1 ZINC001164904742 721548756 /nfs/dbraw/zinc/54/87/56/721548756.db2.gz GGJHHNVMVFHGRB-OCCSQVGLSA-N 1 1 430.883 3.445 20 0 IGADMO CC1CCN(C(=O)c2cccnc2N2CC[N@H+]3C[C@H](Oc4cccc(F)c4)C[C@H]3C2)CC1 ZINC001164907253 721553126 /nfs/dbraw/zinc/55/31/26/721553126.db2.gz NLFZXEDTHDBYEZ-RBBKRZOGSA-N 1 1 438.547 3.435 20 0 IGADMO CC1CCN(C(=O)c2cccnc2N2CC[N@H+]3C[C@@H](Oc4cccc(F)c4)C[C@@H]3C2)CC1 ZINC001164907252 721553645 /nfs/dbraw/zinc/55/36/45/721553645.db2.gz NLFZXEDTHDBYEZ-IRLDBZIGSA-N 1 1 438.547 3.435 20 0 IGADMO COC(=O)c1nc(Cl)c(N2CC[N@@H+]3C[C@@H](Oc4cccc(F)c4)C[C@@H]3C2)c(Cl)n1 ZINC001164906106 721566063 /nfs/dbraw/zinc/56/60/63/721566063.db2.gz ITWUUAUFPWXDOA-OCCSQVGLSA-N 1 1 441.290 3.051 20 0 IGADMO COC(=O)c1nc(Cl)c(N2CC[N@H+]3C[C@@H](Oc4cccc(F)c4)C[C@@H]3C2)c(Cl)n1 ZINC001164906106 721566066 /nfs/dbraw/zinc/56/60/66/721566066.db2.gz ITWUUAUFPWXDOA-OCCSQVGLSA-N 1 1 441.290 3.051 20 0 IGADMO COc1cc(C(F)(F)N2CC[N@H+]3C[C@H](Oc4cccc(F)c4)C[C@@H]3C2)nc(Cl)n1 ZINC001164908040 721567153 /nfs/dbraw/zinc/56/71/53/721567153.db2.gz PKKGLZFGBHZUMN-UKRRQHHQSA-N 1 1 428.842 3.165 20 0 IGADMO CSc1nc2ncnc(N3C[C@H]([N@H+](C)Cc4cccnc4)[C@@H]4OCCC[C@@H]43)c2s1 ZINC001164807277 721568291 /nfs/dbraw/zinc/56/82/91/721568291.db2.gz SGXJGCXLQSXHKR-HRCADAONSA-N 1 1 428.587 3.071 20 0 IGADMO CSc1nc2ncnc(N3C[C@H]([N@@H+](C)Cc4cccnc4)[C@@H]4OCCC[C@@H]43)c2s1 ZINC001164807277 721568292 /nfs/dbraw/zinc/56/82/92/721568292.db2.gz SGXJGCXLQSXHKR-HRCADAONSA-N 1 1 428.587 3.071 20 0 IGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(C(F)(F)c2cc(Cl)nc(=S)[nH]2)[C@@H]2CCCO[C@@H]12 ZINC001164803945 721571823 /nfs/dbraw/zinc/57/18/23/721571823.db2.gz JXNJGLHNZAZVFD-CKEIUWERSA-N 1 1 441.935 3.227 20 0 IGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(C(F)(F)c2cc(Cl)nc(=S)[nH]2)[C@@H]2CCCO[C@@H]12 ZINC001164803945 721571828 /nfs/dbraw/zinc/57/18/28/721571828.db2.gz JXNJGLHNZAZVFD-CKEIUWERSA-N 1 1 441.935 3.227 20 0 IGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2nc3ccccc3nc2N2CCCC2)[C@H]2CCCO[C@@H]12 ZINC001164805791 721575103 /nfs/dbraw/zinc/57/51/03/721575103.db2.gz OVZPGUMDTXECIJ-RBZQAINGSA-N 1 1 444.583 3.493 20 0 IGADMO CC1CCN(C(=O)c2ccc(N3C[C@H]([N@@H+](C)Cc4cccnc4)[C@H]4OCCC[C@@H]43)nc2)CC1 ZINC001164800222 721576791 /nfs/dbraw/zinc/57/67/91/721576791.db2.gz DJYACUULDWLNFO-LSQMVHIFSA-N 1 1 449.599 3.217 20 0 IGADMO COc1cccc(-c2ccc(N3C[C@H]([N@H+](C)Cc4cccnc4)[C@@H]4OCCC[C@H]43)nn2)c1 ZINC001164808328 721578806 /nfs/dbraw/zinc/57/88/06/721578806.db2.gz QQEJSAOCLGRSEB-GIFXNVAJSA-N 1 1 431.540 3.415 20 0 IGADMO COc1cccc(-c2ccc(N3C[C@H]([N@@H+](C)Cc4cccnc4)[C@@H]4OCCC[C@H]43)nn2)c1 ZINC001164808328 721578813 /nfs/dbraw/zinc/57/88/13/721578813.db2.gz QQEJSAOCLGRSEB-GIFXNVAJSA-N 1 1 431.540 3.415 20 0 IGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2nc(-c3ccncc3)nc3c2CCC3)[C@@H]2CCCO[C@H]12 ZINC001164807560 721585845 /nfs/dbraw/zinc/58/58/45/721585845.db2.gz OMMANKKTDPHFHW-SMIHKQSGSA-N 1 1 442.567 3.291 20 0 IGADMO CCCSc1ncnc(N2C[C@H]([N@H+](C)Cc3cccnc3)[C@H]3OCCC[C@@H]32)c1OC ZINC001164810813 721590268 /nfs/dbraw/zinc/59/02/68/721590268.db2.gz WGKVDRDBXXESOX-FHWLQOOXSA-N 1 1 429.590 3.251 20 0 IGADMO CCCSc1ncnc(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@H]3OCCC[C@@H]32)c1OC ZINC001164810813 721590270 /nfs/dbraw/zinc/59/02/70/721590270.db2.gz WGKVDRDBXXESOX-FHWLQOOXSA-N 1 1 429.590 3.251 20 0 IGADMO COC(=O)c1cc(OC)cnc1N1CCC(F)(F)[C@]2(CC[N@@H+](Cc3ccccn3)C2)C1 ZINC001164907477 721696817 /nfs/dbraw/zinc/69/68/17/721696817.db2.gz UDXLFQFVLWGSQI-NRFANRHFSA-N 1 1 432.471 3.010 20 0 IGADMO COCc1cc(N2CCC(F)(F)[C@]3(CC[N@@H+](Cc4ccccn4)C3)C2)nc(SC)n1 ZINC001164904249 721702713 /nfs/dbraw/zinc/70/27/13/721702713.db2.gz DYPZVVDBLANKBJ-FQEVSTJZSA-N 1 1 435.544 3.478 20 0 IGADMO NC(=O)c1cc2ccccc2c(N2CCC(F)(F)[C@@]3(CC[N@@H+](Cc4ccccn4)C3)C2)n1 ZINC001164909875 721728905 /nfs/dbraw/zinc/72/89/05/721728905.db2.gz FGSJQUFZRVKTTC-HSZRJFAPSA-N 1 1 437.494 3.466 20 0 IGADMO FC1(F)CCN(c2cc(N3CCSCC3)ncn2)C[C@@]12CC[N@@H+](Cc1ccccn1)C2 ZINC001164913102 721732101 /nfs/dbraw/zinc/73/21/01/721732101.db2.gz SSROITUTCQPGJH-NRFANRHFSA-N 1 1 446.571 3.163 20 0 IGADMO CN(C)C(=O)C[NH+]1CCC2(CCCN2C(F)(F)c2ccc3ncnc(Cl)c3c2)CC1 ZINC001165010616 721734762 /nfs/dbraw/zinc/73/47/62/721734762.db2.gz HBIFIDLWMOLRRZ-UHFFFAOYSA-N 1 1 437.922 3.351 20 0 IGADMO COCCOC(=O)c1ccnc(N2CCC(F)(F)[C@]3(CC[N@@H+](Cc4ccccn4)C3)C2)c1 ZINC001164909773 721735135 /nfs/dbraw/zinc/73/51/35/721735135.db2.gz DPRGDBVLOPBPGO-QFIPXVFZSA-N 1 1 446.498 3.018 20 0 IGADMO F[C@H](Oc1ccc(Cl)nn1)N1CCC(F)(F)[C@]2(CC[N@@H+](Cc3ccccn3)C2)C1 ZINC001164910511 721738329 /nfs/dbraw/zinc/73/83/29/721738329.db2.gz FPPFHZZBKICEPP-ROUUACIJSA-N 1 1 427.858 3.390 20 0 IGADMO C[N@H+](Cc1ccco1)Cc1cncc2c1CCN(c1ccc(Cn3ccccc3=O)cn1)C2 ZINC001164911606 721762018 /nfs/dbraw/zinc/76/20/18/721762018.db2.gz PTLFQACZQTWRHN-UHFFFAOYSA-N 1 1 441.535 3.474 20 0 IGADMO C[N@@H+](Cc1ccco1)Cc1cncc2c1CCN(c1ccc(Cn3ccccc3=O)cn1)C2 ZINC001164911606 721762024 /nfs/dbraw/zinc/76/20/24/721762024.db2.gz PTLFQACZQTWRHN-UHFFFAOYSA-N 1 1 441.535 3.474 20 0 IGADMO Cc1cccc2nc(Cl)nc(N3CCO[C@@]4(C3)COCC[N@H+](Cc3cccnc3)C4)c12 ZINC001164914091 721790019 /nfs/dbraw/zinc/79/00/19/721790019.db2.gz BJBZSYQVLFVCDI-QHCPKHFHSA-N 1 1 439.947 3.094 20 0 IGADMO Cc1cccc2nc(Cl)nc(N3CCO[C@@]4(C3)COCC[N@@H+](Cc3cccnc3)C4)c12 ZINC001164914091 721790023 /nfs/dbraw/zinc/79/00/23/721790023.db2.gz BJBZSYQVLFVCDI-QHCPKHFHSA-N 1 1 439.947 3.094 20 0 IGADMO CCOC(=O)Cc1nc(Cl)cc(N2C[C@@H]3CCC[C@@H]([N@@H+](C)Cc4ccccn4)[C@H]3C2)n1 ZINC001165026515 721810067 /nfs/dbraw/zinc/81/00/67/721810067.db2.gz QXKJDEBNWDUNOH-YTQUADARSA-N 1 1 443.979 3.368 20 0 IGADMO CN(c1ncccn1)[C@@H]1CO[C@@]2(C1)CCCN(c1nc(Cl)ccc1C[NH+]1CCCC1)C2 ZINC001164925285 721835977 /nfs/dbraw/zinc/83/59/77/721835977.db2.gz ODZNCFRIFBIUAV-WMZHIEFXSA-N 1 1 442.995 3.385 20 0 IGADMO COc1cccc(OC)c1CN1CCC(N(C)c2cc(Cl)nc3c2CC[NH2+]C3)CC1 ZINC001165020242 721843139 /nfs/dbraw/zinc/84/31/39/721843139.db2.gz ARSWNEATVMRBLJ-UHFFFAOYSA-N 1 1 430.980 3.499 20 0 IGADMO CN(C)CC[N@@H+]1CC[C@H]2[C@@H]1CCN2c1cc(C(=O)Nc2ccc(Cl)nc2)ccc1F ZINC001164923096 721863654 /nfs/dbraw/zinc/86/36/54/721863654.db2.gz IBMQJKFCXNSYFF-OALUTQOASA-N 1 1 431.943 3.341 20 0 IGADMO CN(C)CC[N@H+]1CC[C@H]2[C@@H]1CCN2c1cc(C(=O)Nc2ccc(Cl)nc2)ccc1F ZINC001164923096 721863655 /nfs/dbraw/zinc/86/36/55/721863655.db2.gz IBMQJKFCXNSYFF-OALUTQOASA-N 1 1 431.943 3.341 20 0 IGADMO O=C(NCc1cccs1)c1cc(F)c(Cl)nc1N1CC[NH+](C[C@H]2CCCO2)CC1 ZINC001165039866 721913554 /nfs/dbraw/zinc/91/35/54/721913554.db2.gz WBCYNXQKOKWUCZ-CQSZACIVSA-N 1 1 438.956 3.167 20 0 IGADMO Cc1ccc(C[N@H+]2CCOC3(CCN(c4nc(Cl)nc5c4ncn5C)CC3)C2)cc1 ZINC001164939331 721924324 /nfs/dbraw/zinc/92/43/24/721924324.db2.gz IWHYVPFSICILQW-UHFFFAOYSA-N 1 1 426.952 3.197 20 0 IGADMO CON(C)C(=O)c1cc(C)cnc1N1CCC2(CC1)C[N@@H+](Cc1ccc(C)cc1)CCO2 ZINC001164939662 721929677 /nfs/dbraw/zinc/92/96/77/721929677.db2.gz NQJYIGNJWGTSGH-UHFFFAOYSA-N 1 1 438.572 3.203 20 0 IGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2C[C@H](NC(=O)c3cscn3)[C@H]3OCCC[C@H]32)nc1 ZINC001164950324 722001852 /nfs/dbraw/zinc/00/18/52/722001852.db2.gz HQVHTVQJTWCNMI-RJJVWVDVSA-N 1 1 441.601 3.251 20 0 IGADMO CN(C)C(=O)N[C@H]1CCO[C@@]2(CCN(c3ccc4c(n3)CC[N@H+](Cc3ccccc3)C4)C2)C1 ZINC001164954359 722008667 /nfs/dbraw/zinc/00/86/67/722008667.db2.gz LTDIALUJQJWGOP-NVQXNPDNSA-N 1 1 449.599 3.039 20 0 IGADMO COC(=O)c1nc(Cl)c(N2CCC3(CC[N@@H+](Cc4cccnc4)C3)CC2)c(Cl)n1 ZINC001164963989 722024742 /nfs/dbraw/zinc/02/47/42/722024742.db2.gz UXIPDONCLFKWKM-UHFFFAOYSA-N 1 1 436.343 3.458 20 0 IGADMO Cc1noc(C[C@@H]2C[C@@H]3CN(c4ccc5c(n4)CC[N@H+](Cc4ccccc4)C5)C[C@H]3O2)n1 ZINC001164961830 722040925 /nfs/dbraw/zinc/04/09/25/722040925.db2.gz NJDOTSSNYSKFAS-FUPPJEDESA-N 1 1 431.540 3.168 20 0 IGADMO Fc1c[nH]c2nc(Cl)nc(N3CCC4(CC3)COCC[N@@H+](Cc3ccncc3)C4)c12 ZINC001164958835 722051646 /nfs/dbraw/zinc/05/16/46/722051646.db2.gz GXXXSTXJFYWGRK-UHFFFAOYSA-N 1 1 430.915 3.264 20 0 IGADMO COC(=O)c1ccc(Cl)c(N2CCC3(CC2)COCC[N@@H+](Cc2ccncc2)C3)n1 ZINC001164964204 722056661 /nfs/dbraw/zinc/05/66/61/722056661.db2.gz TTZYQLHEAKSRMP-UHFFFAOYSA-N 1 1 430.936 3.036 20 0 IGADMO Cc1cc(N2CCC3(CC2)COCC[N@@H+](Cc2ccncc2)C3)nc(-c2ccncc2)n1 ZINC001164960666 722059376 /nfs/dbraw/zinc/05/93/76/722059376.db2.gz GOHVUXQRXJYDJU-UHFFFAOYSA-N 1 1 430.556 3.361 20 0 IGADMO C[N@@H+](Cc1ccc(N2CC[C@H]3C(=O)N(Cc4cccc(F)c4)CCO[C@H]3C2)nc1)C1CC1 ZINC001164968582 722082453 /nfs/dbraw/zinc/08/24/53/722082453.db2.gz DUPJVUGVRZHIOX-PKTZIBPZSA-N 1 1 438.547 3.069 20 0 IGADMO CCOC(=O)c1c(Cl)cc(C)nc1N1CC[C@@H]2C[N@@H+](Cc3cccnc3)CCO[C@@H]2C1 ZINC001164985193 722102242 /nfs/dbraw/zinc/10/22/42/722102242.db2.gz VGSNFBJVUNWGMV-UYAOXDASSA-N 1 1 444.963 3.342 20 0 IGADMO CCOC(=O)c1c(C)cc(Cl)nc1N1CC[C@H]2C[N@@H+](Cc3cccnc3)CCO[C@@H]2C1 ZINC001164971388 722109830 /nfs/dbraw/zinc/10/98/30/722109830.db2.gz BVJNXPHAVUOVEJ-RBUKOAKNSA-N 1 1 444.963 3.342 20 0 IGADMO FC(F)(COc1ccnc(Cl)c1)N1CC[C@@H]2C[N@@H+](Cc3cccnc3)CCO[C@H]2C1 ZINC001164972561 722114396 /nfs/dbraw/zinc/11/43/96/722114396.db2.gz GBBRFJDECNXUFN-MJGOQNOKSA-N 1 1 438.906 3.325 20 0 IGADMO COc1cc2c(cc1Cl)ncnc2N1CC[C@@H]2C[N@@H+](Cc3cccnc3)CCO[C@@H]2C1 ZINC001164981999 722120037 /nfs/dbraw/zinc/12/00/37/722120037.db2.gz VPYILDWYERGWRF-VGOFRKELSA-N 1 1 439.947 3.414 20 0 IGADMO O=C(Nc1ccccc1)c1ccnc(N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)c1 ZINC001164979783 722120818 /nfs/dbraw/zinc/12/08/18/722120818.db2.gz PYAGGKIQONQCRN-VWNXMTODSA-N 1 1 443.551 3.456 20 0 IGADMO c1ccc(COc2cnnc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)c2)cc1 ZINC001164982677 722125742 /nfs/dbraw/zinc/12/57/42/722125742.db2.gz XREBYSKMEQQDAP-VWNXMTODSA-N 1 1 431.540 3.178 20 0 IGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(-n2c([C@@H]3COCCN3)nccc2=NCc2ccco2)nc1 ZINC001164987851 722173226 /nfs/dbraw/zinc/17/32/26/722173226.db2.gz OZRSTGCGYAMDNT-FCHUYYIVSA-N 1 1 448.571 3.169 20 0 IGADMO O=S(=O)(c1ccnc(N2CCC[C@]3(CC[N@@H+]3Cc3cccc(F)c3)C2)c1)N1CCCC1 ZINC001164994778 722210530 /nfs/dbraw/zinc/21/05/30/722210530.db2.gz DGURGTGHSSOKME-QHCPKHFHSA-N 1 1 444.576 3.250 20 0 IGADMO COc1cccc2c(N3CCc4ncnc(N5CC[NH+](C)CC5)c4CC3)cc(Cl)nc12 ZINC001164998132 722229250 /nfs/dbraw/zinc/22/92/50/722229250.db2.gz YDMUWIFENYBZJU-UHFFFAOYSA-N 1 1 438.963 3.044 20 0 IGADMO O=C1NCCc2[nH]c(-c3ccnc(N4CCC[C@@H]5C[N@@H+](Cc6ccccc6)C[C@H]54)c3)cc21 ZINC001164619924 719075574 /nfs/dbraw/zinc/07/55/74/719075574.db2.gz DCVZYTYUPBXMLZ-HYBUGGRVSA-N 1 1 427.552 3.463 20 0 IGADMO O=C1CCCN1[C@@H]1CN(c2ccc3c(n2)CC[N@H+](Cc2ccccc2)C3)C[C@H]2CCCO[C@H]21 ZINC001164656904 719303250 /nfs/dbraw/zinc/30/32/50/719303250.db2.gz ZFCISXRNSWURBE-LSCGWGKXSA-N 1 1 446.595 3.246 20 0 IGADMO CCn1nnc2c1[C@H](COC)CN(c1nc(C[NH+]3CCCC3)nc3sc(C)c(C)c31)C2 ZINC001164665929 719361638 /nfs/dbraw/zinc/36/16/38/719361638.db2.gz ZOBSVKJCICLGEC-INIZCTEOSA-N 1 1 441.605 3.266 20 0 IGADMO COCCn1ccc2c1nc[nH+]c2N1CCC2(CC1)COCCN2Cc1ccc(F)cc1 ZINC001164670257 719511463 /nfs/dbraw/zinc/51/14/63/719511463.db2.gz CPIGNRHYBHIMJA-UHFFFAOYSA-N 1 1 439.535 3.088 20 0 IGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2CCc3nnc(COc4ccccn4)n3CC2)nc1 ZINC001164688249 719687139 /nfs/dbraw/zinc/68/71/39/719687139.db2.gz YUDXIOJKJXZWSY-HXUWFJFHSA-N 1 1 433.560 3.257 20 0 IGADMO CNC(=O)C[N@H+]1CCCC12CCN(c1ccc(-c3ccc(N4CCCCC4)cc3)nn1)CC2 ZINC001164689609 719749941 /nfs/dbraw/zinc/74/99/41/719749941.db2.gz JDMGDQIHUZNMQT-UHFFFAOYSA-N 1 1 448.615 3.315 20 0 IGADMO CNC(=O)C[N@H+]1CCCC12CCN(C(F)(F)c1ccc(Cl)nc1C(F)(F)F)CC2 ZINC001164689839 719750059 /nfs/dbraw/zinc/75/00/59/719750059.db2.gz LHVWQBNAVNJXHR-UHFFFAOYSA-N 1 1 440.844 3.480 20 0 IGADMO O=C1C[C@H]2[C@@H](CCN2c2ccc3c(n2)CC[N@H+](Cc2ccccc2)C3)N1Cc1cccnc1 ZINC001164691061 719764786 /nfs/dbraw/zinc/76/47/86/719764786.db2.gz KQOGXBLAKPNRRY-RPBOFIJWSA-N 1 1 439.563 3.415 20 0 IGADMO CC(C)Oc1ncnc2c1CCN(c1ncnc3c1CC[N@H+](Cc1ccccc1)C3)CC2 ZINC001164695638 719790404 /nfs/dbraw/zinc/79/04/04/719790404.db2.gz NZRZBZMNGIIGBI-UHFFFAOYSA-N 1 1 430.556 3.217 20 0 IGADMO CC(C)Oc1ncnc2c1CCN(c1ncnc3c1CC[N@@H+](Cc1ccccc1)C3)CC2 ZINC001164695638 719790425 /nfs/dbraw/zinc/79/04/25/719790425.db2.gz NZRZBZMNGIIGBI-UHFFFAOYSA-N 1 1 430.556 3.217 20 0 IGADMO COC(=O)c1cc2c([n-]1)nc[nH+]c2N1CCC2(CCC[N@H+]2Cc2csc(C)n2)CC1 ZINC001164690860 719805504 /nfs/dbraw/zinc/80/55/04/719805504.db2.gz BFWMKEOLAHPCSQ-UHFFFAOYSA-N 1 1 426.546 3.096 20 0 IGADMO COCCOC(=O)c1ccnc(N2CCC3(CCC[N@H+]3Cc3csc(C)n3)CC2)c1 ZINC001164699604 719815654 /nfs/dbraw/zinc/81/56/54/719815654.db2.gz HOOUDUBQMGGCRS-UHFFFAOYSA-N 1 1 430.574 3.285 20 0 IGADMO COC(=O)c1ccc2nc(N3CCC4(CC3)C[N@H+](Cc3cccs3)CCO4)ncc2c1 ZINC001164695315 719888481 /nfs/dbraw/zinc/88/84/81/719888481.db2.gz NCORCGVNXQBCSB-UHFFFAOYSA-N 1 1 438.553 3.349 20 0 IGADMO COC(=O)c1ccc2nc(N3CCC4(CC3)C[N@@H+](Cc3cccs3)CCO4)ncc2c1 ZINC001164695315 719888485 /nfs/dbraw/zinc/88/84/85/719888485.db2.gz NCORCGVNXQBCSB-UHFFFAOYSA-N 1 1 438.553 3.349 20 0 IGADMO Cc1nc2c(nc(Cl)nc2N2CCC3(CC2)C[N@@H+](Cc2cccs2)CCO3)n1C ZINC001164697680 719897473 /nfs/dbraw/zinc/89/74/73/719897473.db2.gz NOLRHRXSNZGSAX-UHFFFAOYSA-N 1 1 432.981 3.258 20 0 IGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(C(F)(F)c1ccc(C(=O)OC)c(Cl)n1)C2 ZINC001164813076 720091299 /nfs/dbraw/zinc/09/12/99/720091299.db2.gz SDKYRFXAKYIHJY-YWZLYKJASA-N 1 1 443.922 3.251 20 0 IGADMO COC[C@H]1CC2(C[N@@H+]1Cc1ccccn1)CCN(c1nc(C)cc(N3CCCC3)n1)CC2 ZINC001164712718 720092427 /nfs/dbraw/zinc/09/24/27/720092427.db2.gz YMXYFSJTJVLDKN-JOCHJYFZSA-N 1 1 436.604 3.288 20 0 IGADMO COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1nc(C)cc(N3CCCC3)n1)CC2 ZINC001164712718 720092435 /nfs/dbraw/zinc/09/24/35/720092435.db2.gz YMXYFSJTJVLDKN-JOCHJYFZSA-N 1 1 436.604 3.288 20 0 IGADMO COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1nc(Cl)ccc1C(=O)OC)CC2 ZINC001164711142 720093712 /nfs/dbraw/zinc/09/37/12/720093712.db2.gz OSCZTTSIMQCATF-SFHVURJKSA-N 1 1 444.963 3.424 20 0 IGADMO COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1nc(Cl)ccc1C(=O)OC)CC2 ZINC001164711139 720094392 /nfs/dbraw/zinc/09/43/92/720094392.db2.gz OSCZTTSIMQCATF-GOSISDBHSA-N 1 1 444.963 3.424 20 0 IGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1nc(Cl)ccc1C(=O)NC(C)(C)C)C2 ZINC001164814440 720127493 /nfs/dbraw/zinc/12/74/93/720127493.db2.gz SOALMGHIBGVTDO-UZUQRXQVSA-N 1 1 435.012 3.448 20 0 IGADMO CCOC(=O)c1nc(Cl)nc(Cl)c1N1CC[C@]2(C1)C[N@@H+](CC1CC1)C[C@H]2COC ZINC001164808682 720128428 /nfs/dbraw/zinc/12/84/28/720128428.db2.gz GBLRPQWGWKEDNE-VBKZILBWSA-N 1 1 443.375 3.145 20 0 IGADMO COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1cc(N3CCCCC3)ncn1)CC2 ZINC001164713600 720140821 /nfs/dbraw/zinc/14/08/21/720140821.db2.gz SNJFJWQQZAOIHS-QFIPXVFZSA-N 1 1 436.604 3.369 20 0 IGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1ccc(-c3ccc4c(c3)OCCO4)nn1)C2 ZINC001164814431 720171507 /nfs/dbraw/zinc/17/15/07/720171507.db2.gz GLEMDDXYFKSMGN-CPJSRVTESA-N 1 1 436.556 3.100 20 0 IGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(C(F)(F)c1c3c(nnc1Cl)CCC3)C2 ZINC001164817148 720172992 /nfs/dbraw/zinc/17/29/92/720172992.db2.gz OGILFIGBAYVNKP-FOIQADDNSA-N 1 1 426.939 3.348 20 0 IGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1ccc(-c3ccc(OC)cc3OC)nn1)C2 ZINC001164817380 720182651 /nfs/dbraw/zinc/18/26/51/720182651.db2.gz PDWRPKORYSMPPU-KBMIEXCESA-N 1 1 438.572 3.346 20 0 IGADMO CC(C)[N@@H+](C)Cc1cc(=O)n2c(n1)CN(c1nccc(-c3c[nH]c4ccccc43)n1)CCC2 ZINC001164812606 720222421 /nfs/dbraw/zinc/22/24/21/720222421.db2.gz HCHWHDMJUJELBI-UHFFFAOYSA-N 1 1 443.555 3.432 20 0 IGADMO Cc1nc(C(F)(F)N2CCCn3c(=O)cc(C[N@H+](C)C(C)C)nc3C2)nc(Cl)c1C ZINC001164813848 720228376 /nfs/dbraw/zinc/22/83/76/720228376.db2.gz QBAPBKLYCJWDNQ-UHFFFAOYSA-N 1 1 440.926 3.099 20 0 IGADMO CC(C)[N@@H+](C)Cc1cc(=O)n2c(n1)CN(c1c(F)ccc3c(Cl)ncnc31)CCC2 ZINC001164817079 720247845 /nfs/dbraw/zinc/24/78/45/720247845.db2.gz OQYGKKVCPGHTLN-UHFFFAOYSA-N 1 1 430.915 3.230 20 0 IGADMO Cc1nc(CN2C(=O)CC[C@@H]3[C@H]2CCN3c2cc(OC3CC[NH+](C)CC3)ccn2)cs1 ZINC001164815137 720259715 /nfs/dbraw/zinc/25/97/15/720259715.db2.gz BBIVACZEUAHEJV-NHCUHLMSSA-N 1 1 441.601 3.089 20 0 IGADMO CNC(=O)C[N@@H+]1CCOC[C@]2(CCCN(c3ccc4c(Cl)ccc(Cl)c4n3)C2)C1 ZINC001164720831 720304307 /nfs/dbraw/zinc/30/43/07/720304307.db2.gz ATCNRVGCVBRLQU-OAQYLSRUSA-N 1 1 437.371 3.206 20 0 IGADMO CNC(=O)C[N@H+]1CCOC[C@]2(CCCN(c3ccc4c(Cl)ccc(Cl)c4n3)C2)C1 ZINC001164720831 720304309 /nfs/dbraw/zinc/30/43/09/720304309.db2.gz ATCNRVGCVBRLQU-OAQYLSRUSA-N 1 1 437.371 3.206 20 0 IGADMO COc1cc2ccnc(N3CC[C@@H]4[C@H]3CCC(=O)N4CC3CC[NH+](C)CC3)c2cc1OC ZINC001164831924 720321430 /nfs/dbraw/zinc/32/14/30/720321430.db2.gz SEBZQSXAPXPRRI-NHCUHLMSSA-N 1 1 438.572 3.164 20 0 IGADMO CCOC(=O)c1c2ccccn2c2ncnc(N3CC[C@H]4[C@@H]3CC[N@H+]4Cc3cccnc3)c12 ZINC001164721743 720331156 /nfs/dbraw/zinc/33/11/56/720331156.db2.gz DGRDENDXLMIEGJ-OALUTQOASA-N 1 1 442.523 3.307 20 0 IGADMO CCOC(=O)c1cnc(C(F)(F)N2CC[C@H]3[C@H]2CC[N@@H+]3Cc2cccnc2)nc1Cl ZINC001164724937 720336334 /nfs/dbraw/zinc/33/63/34/720336334.db2.gz LVFHTXSDGUFFIE-JKSUJKDBSA-N 1 1 437.878 3.100 20 0 IGADMO CCOC(=O)c1cnc(C(F)(F)N2CC[C@H]3[C@H]2CC[N@H+]3Cc2cccnc2)nc1Cl ZINC001164724937 720336342 /nfs/dbraw/zinc/33/63/42/720336342.db2.gz LVFHTXSDGUFFIE-JKSUJKDBSA-N 1 1 437.878 3.100 20 0 IGADMO Cc1nc(CO[C@@H]2CN(c3cc(OC4CC[NH+](C)CC4)ccn3)[C@@H]3CCCO[C@H]23)cs1 ZINC001164821779 720392624 /nfs/dbraw/zinc/39/26/24/720392624.db2.gz IMKQLUQPAIDVJQ-XPNTWCBSSA-N 1 1 444.601 3.273 20 0 IGADMO Fc1ccccc1Cn1cnc2c1ncnc2N1CC[C@H]2[C@@H]1CC[N@H+]2Cc1cccnc1 ZINC001164731014 720401871 /nfs/dbraw/zinc/40/18/71/720401871.db2.gz XZVDWJWULUJWRW-SFTDATJTSA-N 1 1 429.503 3.262 20 0 IGADMO O=C(Nc1nncs1)c1cnc(N2CC[C@@H]3[C@@H]2CC[N@@H+]3Cc2cccnc2)c(Cl)c1 ZINC001164735922 720452210 /nfs/dbraw/zinc/45/22/10/720452210.db2.gz ZNFCUBTUXHUZRG-SJORKVTESA-N 1 1 441.948 3.087 20 0 IGADMO O=C(Nc1nncs1)c1cnc(N2CC[C@@H]3[C@@H]2CC[N@H+]3Cc2cccnc2)c(Cl)c1 ZINC001164735922 720452217 /nfs/dbraw/zinc/45/22/17/720452217.db2.gz ZNFCUBTUXHUZRG-SJORKVTESA-N 1 1 441.948 3.087 20 0 IGADMO CCOC(=O)c1cnc(Cl)cc1N1CC[C@@H]2[C@H](C[C@@H](Cn3cccn3)[N@H+]2C(C)C)C1 ZINC001164832401 720507629 /nfs/dbraw/zinc/50/76/29/720507629.db2.gz ANVCVBOONWODQO-ZIFCJYIRSA-N 1 1 431.968 3.486 20 0 IGADMO CCOC(=O)c1cnc(C2CC2)nc1N1CC[C@@H]2[C@H](C[C@H](Cn3cccn3)[N@H+]2C(C)C)C1 ZINC001164835025 720543285 /nfs/dbraw/zinc/54/32/85/720543285.db2.gz GTJGMRKEALXJJU-SFHLNBCPSA-N 1 1 438.576 3.105 20 0 IGADMO c1nc2n(c1C[NH+]1CCCC1)CCN(c1ccc3c(n1)CCN(Cc1ccccc1)C3)CC2 ZINC001164732630 720557953 /nfs/dbraw/zinc/55/79/53/720557953.db2.gz AWBHAQOKZKULRX-UHFFFAOYSA-N 1 1 442.611 3.495 20 0 IGADMO CCOC(=O)c1cc2ccc(N3CC[C@@H]4[C@H](C[C@@H](Cn5cccn5)[N@H+]4C(C)C)C3)[nH]c-2n1 ZINC001164840145 720572190 /nfs/dbraw/zinc/57/21/90/720572190.db2.gz RTSPFWZUXJTEIE-SVFBPWRDSA-N 1 1 436.560 3.314 20 0 IGADMO CCOC(=O)c1cc2ccc(N3CC[C@@H]4[C@H](C[C@@H](Cn5cccn5)[N@@H+]4C(C)C)C3)nc2[nH]1 ZINC001164840145 720572198 /nfs/dbraw/zinc/57/21/98/720572198.db2.gz RTSPFWZUXJTEIE-SVFBPWRDSA-N 1 1 436.560 3.314 20 0 IGADMO CCOC(=O)c1cc2ccc(N3CC[C@@H]4[C@H](C[C@@H](Cn5cccn5)[N@H+]4C(C)C)C3)nc2[nH]1 ZINC001164840145 720572211 /nfs/dbraw/zinc/57/22/11/720572211.db2.gz RTSPFWZUXJTEIE-SVFBPWRDSA-N 1 1 436.560 3.314 20 0 IGADMO COc1cc(C(F)(F)N2CC[C@@H]3[C@@H](C[C@@H](Cn4cccn4)[N@H+]3C(C)C)C2)nc(Cl)n1 ZINC001164843773 720648427 /nfs/dbraw/zinc/64/84/27/720648427.db2.gz YEQTVMCMWCRGGD-HRCADAONSA-N 1 1 440.926 3.258 20 0 IGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@@H]2CN(C(F)(F)Oc3cnc(Cl)cn3)CC[C@@H]21 ZINC001164842448 720648582 /nfs/dbraw/zinc/64/85/82/720648582.db2.gz RQBMZLWPDSKNMD-PMPSAXMXSA-N 1 1 426.899 3.129 20 0 IGADMO c1sc2ncnc(N3CC[N@@H+]4C[C@H](Oc5cncnc5)C[C@@H]4C3)c2c1-c1ccccc1 ZINC001164744401 720657700 /nfs/dbraw/zinc/65/77/00/720657700.db2.gz ZTPVKGDOOIEJDO-QZTJIDSGSA-N 1 1 430.537 3.490 20 0 IGADMO COC(=O)Cc1c(Cl)ncnc1N1CCC2(C[C@H]([N@@H+](C)Cc3ccccc3)CO2)CC1 ZINC001164843816 720681090 /nfs/dbraw/zinc/68/10/90/720681090.db2.gz RBZRHRMZBYWPRJ-SFHVURJKSA-N 1 1 444.963 3.105 20 0 IGADMO C[N@@H+](Cc1ccccc1)[C@@H]1COC2(C1)CCN(c1[nH]c3cc(=O)[nH]c-3cc1Cl)CC2 ZINC001164843672 720693087 /nfs/dbraw/zinc/69/30/87/720693087.db2.gz QFDBYQMMMGRRKD-KRWDZBQOSA-N 1 1 426.948 3.490 20 0 IGADMO CON(C)C(=O)c1cc(C)cnc1N1CCC2(C[C@H]([N@@H+](C)Cc3ccccc3)CO2)CC1 ZINC001164841595 720705123 /nfs/dbraw/zinc/70/51/23/720705123.db2.gz UXURWXWVEQVDRW-NRFANRHFSA-N 1 1 438.572 3.283 20 0 IGADMO C[N@@H+](Cc1ccccc1)[C@H]1COC2(C1)CCN(c1cc(N3CCSCC3)ncn1)CC2 ZINC001164836438 720721004 /nfs/dbraw/zinc/72/10/04/720721004.db2.gz AKAWSSLYEWEWCY-OAQYLSRUSA-N 1 1 439.629 3.290 20 0 IGADMO Fc1ccc(Oc2nc(Cl)ncc2N2CC[N@H+]3C[C@H](Oc4cncnc4)C[C@H]3C2)cc1 ZINC001164739926 720767871 /nfs/dbraw/zinc/76/78/71/720767871.db2.gz JUYRRRQUQSVPDB-DOTOQJQBSA-N 1 1 442.882 3.193 20 0 IGADMO C[NH+]1CCC(Oc2ccnc(N3CC[C@@H]4O[C@H](COCc5ccccn5)CC[C@H]43)c2)CC1 ZINC001164846191 720779592 /nfs/dbraw/zinc/77/95/92/720779592.db2.gz IDZPUTQDVDKQQK-VXNXHJTFSA-N 1 1 438.572 3.293 20 0 IGADMO Cc1cccc(Oc2nc(Cl)ncc2N2CC[N@H+]3C[C@@H](Oc4cncnc4)C[C@@H]3C2)c1 ZINC001164741416 720803076 /nfs/dbraw/zinc/80/30/76/720803076.db2.gz BHMANDRMPBQRKJ-AEFFLSMTSA-N 1 1 438.919 3.363 20 0 IGADMO CSc1nc2sccc2c(N2CC[C@@H]3[C@H](C[C@H](Cn4cncn4)[N@H+]3CC3CC3)C2)n1 ZINC001164751214 720813847 /nfs/dbraw/zinc/81/38/47/720813847.db2.gz XMAHVPVUDLCXFH-JFIYKMOQSA-N 1 1 441.630 3.384 20 0 IGADMO Fc1cnc(Cl)cc1C(F)(F)N1CC[C@@H]2[C@@H](C[C@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164741203 720827646 /nfs/dbraw/zinc/82/76/46/720827646.db2.gz MHNHFJVQLXMZNU-HDMKZQKVSA-N 1 1 440.901 3.390 20 0 IGADMO COc1cc2ccc(N3CC[C@@H]4[C@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)nc2cc1OC ZINC001164751118 720835531 /nfs/dbraw/zinc/83/55/31/720835531.db2.gz YNKDVOKXZQXUPQ-KCZVDYSFSA-N 1 1 448.571 3.223 20 0 IGADMO CCCN(CCC)c1cc(N2CC[C@@H]3[C@H](C[C@H](Cn4cncn4)[N@H+]3CC3CC3)C2)ncn1 ZINC001164745149 720839113 /nfs/dbraw/zinc/83/91/13/720839113.db2.gz LPZCGPISDCCOBH-YPAWHYETSA-N 1 1 438.624 3.074 20 0 IGADMO COCC[N@H+]1CCO[C@@H]2CN(C(F)(F)c3nc4ccsc4c(Cl)n3)CC[C@H]2C1 ZINC001164853339 720842878 /nfs/dbraw/zinc/84/28/78/720842878.db2.gz OJFOAWNWFFNEQT-GXTWGEPZSA-N 1 1 432.924 3.063 20 0 IGADMO Cc1c[nH]c2nc(Cl)cc(N3CC[C@@H]4[C@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)c12 ZINC001164740011 720844273 /nfs/dbraw/zinc/84/42/73/720844273.db2.gz BMWQZTRJGFOWKP-KZNAEPCWSA-N 1 1 425.968 3.496 20 0 IGADMO COCC[N@H+]1CCO[C@@H]2CN(C(F)(F)c3ccc4ncnc(Cl)c4c3)CC[C@@H]2C1 ZINC001164853717 720848771 /nfs/dbraw/zinc/84/87/71/720848771.db2.gz OROWGZXWSANHIO-RDTXWAMCSA-N 1 1 426.895 3.002 20 0 IGADMO COCC[N@H+]1CCO[C@H]2CN(C(F)(F)c3nc(Cl)c4cc(F)ccc4n3)CC[C@H]2C1 ZINC001164854848 720852542 /nfs/dbraw/zinc/85/25/42/720852542.db2.gz LERXIRNZFRRYKW-GUYCJALGSA-N 1 1 444.885 3.141 20 0 IGADMO Fc1ccc2c(Cl)nnc(N3CC[C@@H]4[C@@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)c2c1 ZINC001164747609 720853916 /nfs/dbraw/zinc/85/39/16/720853916.db2.gz IGENLSRETUPOKP-XAUMDUMWSA-N 1 1 441.942 3.393 20 0 IGADMO Fc1ccc(-c2cncc(N3CC[C@@H]4[C@@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)n2)cc1 ZINC001164750288 720857311 /nfs/dbraw/zinc/85/73/11/720857311.db2.gz PHFLSYJLDODYAB-XKCSPQBFSA-N 1 1 433.535 3.254 20 0 IGADMO COc1cc2ccnc(N3CC[C@@H]4[C@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)c2cc1F ZINC001164744696 720858567 /nfs/dbraw/zinc/85/85/67/720858567.db2.gz CFGHZSZCAPEJGJ-WOIUINJBSA-N 1 1 436.535 3.353 20 0 IGADMO c1cncc(COC[C@H]2C[N@@H+](CC3CC3)C[C@@]23CCN(c2nccc(N4CCCC4)n2)C3)c1 ZINC001164747180 720867249 /nfs/dbraw/zinc/86/72/49/720867249.db2.gz AIBYVNLISMTSTQ-ZEQKJWHPSA-N 1 1 448.615 3.227 20 0 IGADMO c1cncc(COC[C@H]2C[N@@H+](CC3CC3)C[C@]23CCN(c2nccc(NC4CC4)n2)C3)c1 ZINC001164754410 720868559 /nfs/dbraw/zinc/86/85/59/720868559.db2.gz RRPBCNTZEZCEJJ-BWKNWUBXSA-N 1 1 434.588 3.201 20 0 IGADMO COC(=O)c1ccnc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COCc2cccnc2)c1 ZINC001164749662 720871220 /nfs/dbraw/zinc/87/12/20/720871220.db2.gz HQAYJUPRLHEFNU-RCZVLFRGSA-N 1 1 436.556 3.018 20 0 IGADMO COCC[N@H+]1CCO[C@@H]2CN(C(F)(F)c3cc(-c4ccco4)nnc3Cl)CC[C@@H]2C1 ZINC001164860791 720877977 /nfs/dbraw/zinc/87/79/77/720877977.db2.gz PCPQHEOLAYVLCX-RDTXWAMCSA-N 1 1 442.894 3.108 20 0 IGADMO COCC[N@H+]1CCO[C@@H]2CN(c3cc(-c4nc(-c5cccs5)no4)ccn3)CC[C@@H]2C1 ZINC001164859109 720883360 /nfs/dbraw/zinc/88/33/60/720883360.db2.gz LPZHQPVJBFPTND-QZTJIDSGSA-N 1 1 441.557 3.034 20 0 IGADMO COCC[N@H+]1CCO[C@@H]2CN(c3cnc(Cl)nc3Oc3cccc(OC)c3)CC[C@H]2C1 ZINC001164862156 720889299 /nfs/dbraw/zinc/88/92/99/720889299.db2.gz QWPMXOHCXMFUOI-OXJNMPFZSA-N 1 1 448.951 3.104 20 0 IGADMO Fc1cc(Cl)nnc1N1CC[C@@]2(C1)C[N@@H+](CC1CC1)C[C@H]2COCc1cccnc1 ZINC001164749979 720890457 /nfs/dbraw/zinc/89/04/57/720890457.db2.gz BGPFFUGNMVIFBQ-AVRDEDQJSA-N 1 1 431.943 3.419 20 0 IGADMO c1cncc(COC[C@@H]2C[N@@H+](CC3CC3)C[C@]23CCN(c2ncc4cccnc4n2)C3)c1 ZINC001164755967 720892740 /nfs/dbraw/zinc/89/27/40/720892740.db2.gz NVADXEXWOBEBHG-DHLKQENFSA-N 1 1 430.556 3.175 20 0 IGADMO CSc1ccc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COCc2cccnc2)nn1 ZINC001164747252 720911288 /nfs/dbraw/zinc/91/12/88/720911288.db2.gz CJAAAACJEXWTPI-REWPJTCUSA-N 1 1 425.602 3.349 20 0 IGADMO COc1nc(C)nc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COCc2cccnc2)c1C ZINC001164750153 720930383 /nfs/dbraw/zinc/93/03/83/720930383.db2.gz JJTSCNMWIJHWQB-WIOPSUGQSA-N 1 1 437.588 3.252 20 0 IGADMO CC(C)[N@@H+](C)Cc1cnc2n1CCN(c1nc3ccsc3c(N3CCOCC3)n1)[C@H]2C ZINC001164861724 720935007 /nfs/dbraw/zinc/93/50/07/720935007.db2.gz TYKYJAHTPOPNPW-INIZCTEOSA-N 1 1 441.605 3.146 20 0 IGADMO CCC(CC)NS(=O)(=O)c1ccc(N2CCn3c(C[N@@H+](C)C(C)C)cnc3[C@H]2C)nc1 ZINC001164860474 721007496 /nfs/dbraw/zinc/00/74/96/721007496.db2.gz OKODOUVIJZHSJL-QGZVFWFLSA-N 1 1 448.637 3.166 20 0 IGADMO Fc1cccc2c(Cl)nc(C(F)(F)N3CCc4[nH+]cc(Cn5cccn5)n4CC3)nc12 ZINC001164863280 721031835 /nfs/dbraw/zinc/03/18/35/721031835.db2.gz QAGKJWBDFLNUQM-UHFFFAOYSA-N 1 1 447.852 3.471 20 0 IGADMO FC(F)(c1ccc2cnc(Cl)nc2c1)N1CCc2[nH+]cc(Cn3cccn3)n2CC1 ZINC001164861134 721032778 /nfs/dbraw/zinc/03/27/78/721032778.db2.gz CWXGSSOIDRYLIH-UHFFFAOYSA-N 1 1 429.862 3.332 20 0 IGADMO Cc1ccc(C[NH+]2CCC3(CCN(c4ncccc4C(=O)N4CCNCC4)CC3)CC2)cc1 ZINC001164759457 721044907 /nfs/dbraw/zinc/04/49/07/721044907.db2.gz MOTCPWIISRZOFI-UHFFFAOYSA-N 1 1 447.627 3.318 20 0 IGADMO FC(F)(c1cnc(Cl)nc1Cl)N1CC[N@H+]2C[C@H](OCc3cccnc3)C[C@@H]2C1 ZINC001164868450 721047500 /nfs/dbraw/zinc/04/75/00/721047500.db2.gz OMARNPIHUYWKGG-ZIAGYGMSSA-N 1 1 430.286 3.203 20 0 IGADMO FC(F)(c1cnc(Cl)nc1Cl)N1CC[N@H+]2C[C@@H](OCc3cccnc3)C[C@H]2C1 ZINC001164868444 721047635 /nfs/dbraw/zinc/04/76/35/721047635.db2.gz OMARNPIHUYWKGG-KBPBESRZSA-N 1 1 430.286 3.203 20 0 IGADMO O=C(NC1CCCCC1)c1cccnc1N1CC[N@H+]2C[C@H](OCc3cccnc3)C[C@H]2C1 ZINC001164866217 721053691 /nfs/dbraw/zinc/05/36/91/721053691.db2.gz CVTOXZKWBMMVCV-FCHUYYIVSA-N 1 1 435.572 3.019 20 0 IGADMO Fc1cc2nc(Cl)c(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@@H]4C3)nc2cc1F ZINC001164863777 721078017 /nfs/dbraw/zinc/07/80/17/721078017.db2.gz DEOVVUWGGFVFNR-HUUCEWRRSA-N 1 1 431.874 3.436 20 0 IGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4ncnc5c4ccn5Cc4ccccc4)C[C@@H]3C2)cn1 ZINC001164765008 721146322 /nfs/dbraw/zinc/14/63/22/721146322.db2.gz IRDOFSJKPGTMOC-YADHBBJMSA-N 1 1 427.556 3.171 20 0 IGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4ncnc5c4ccn5Cc4ccccc4)C[C@@H]3C2)cn1 ZINC001164765001 721146877 /nfs/dbraw/zinc/14/68/77/721146877.db2.gz IRDOFSJKPGTMOC-VXKWHMMOSA-N 1 1 427.556 3.171 20 0 IGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4ncc(C(=O)NC5CCCC5)cc4Cl)C[C@@H]3C2)cn1 ZINC001164773386 721205360 /nfs/dbraw/zinc/20/53/60/721205360.db2.gz WWTXXQBCDJCXOP-HKUYNNGSSA-N 1 1 442.995 3.099 20 0 IGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4nc(-c5ccccn5)nc5sccc54)C[C@H]3C2)cn1 ZINC001164766165 721228337 /nfs/dbraw/zinc/22/83/37/721228337.db2.gz SIBGRTNTVPUKPI-QZTJIDSGSA-N 1 1 431.569 3.445 20 0 IGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4ncc(C(=O)OC(C)(C)C)cc4Cl)C[C@H]3C2)cn1 ZINC001164769736 721232261 /nfs/dbraw/zinc/23/22/61/721232261.db2.gz ZLJYLFKDZIJWNC-SJLPKXTDSA-N 1 1 431.968 3.382 20 0 IGADMO Cc1csc2c1nc(Cl)cc2N1CCC2(CC1)COCC[N@H+](CC(=O)N(C)C)C2 ZINC001164874426 721281438 /nfs/dbraw/zinc/28/14/38/721281438.db2.gz ROEVKWLXXYCEOU-UHFFFAOYSA-N 1 1 437.009 3.265 20 0 IGADMO O=C(OCC1CC1)c1cnc(Cl)nc1C(F)(F)N1CC2(C1)CC[N@@H+](CC1CC1)C2 ZINC001164771941 721285690 /nfs/dbraw/zinc/28/56/90/721285690.db2.gz AJXAGYUEVSQBJT-UHFFFAOYSA-N 1 1 426.895 3.164 20 0 IGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@@]2(CCCN(C(F)(F)c3cc(Cl)ncn3)C2)C1 ZINC001164777660 721330968 /nfs/dbraw/zinc/33/09/68/721330968.db2.gz PBOBBOQIJXXAHN-IBGZPJMESA-N 1 1 441.910 3.399 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@@]2(CCCN(C(F)(F)c3cc(Cl)ncn3)C2)C1 ZINC001164777660 721330972 /nfs/dbraw/zinc/33/09/72/721330972.db2.gz PBOBBOQIJXXAHN-IBGZPJMESA-N 1 1 441.910 3.399 20 0 IGADMO COC(=O)c1ccc(Cl)nc1N1CCC[C@]2(C1)COCC[N@H+](Cc1c(C)noc1C)C2 ZINC001164775845 721331902 /nfs/dbraw/zinc/33/19/02/721331902.db2.gz AIYIVPLUNYWKIC-QFIPXVFZSA-N 1 1 448.951 3.245 20 0 IGADMO COC(=O)c1ccc(Cl)nc1N1CCC[C@]2(C1)COCC[N@@H+](Cc1c(C)noc1C)C2 ZINC001164775845 721331905 /nfs/dbraw/zinc/33/19/05/721331905.db2.gz AIYIVPLUNYWKIC-QFIPXVFZSA-N 1 1 448.951 3.245 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@]2(CCCN(c3ncnc4ccc(F)cc43)C2)C1 ZINC001164778787 721336585 /nfs/dbraw/zinc/33/65/85/721336585.db2.gz YJRQAVXZXBZGBF-HSZRJFAPSA-N 1 1 425.508 3.493 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@]2(CCCN(c3nc(Cl)nc4cccnc43)C2)C1 ZINC001164778764 721340186 /nfs/dbraw/zinc/34/01/86/721340186.db2.gz OJXNOHUULYSNQN-JOCHJYFZSA-N 1 1 442.951 3.402 20 0 IGADMO CCOC(=O)c1cnc(N2CCC[C@]3(C2)COCC[N@H+](Cc2c(C)noc2C)C3)c(C)c1 ZINC001164778311 721342604 /nfs/dbraw/zinc/34/26/04/721342604.db2.gz MHWHJXDWBNTUNZ-DEOSSOPVSA-N 1 1 442.560 3.291 20 0 IGADMO CCOC(=O)c1cnc(N2CCC[C@]3(C2)COCC[N@@H+](Cc2c(C)noc2C)C3)c(C)c1 ZINC001164778311 721342610 /nfs/dbraw/zinc/34/26/10/721342610.db2.gz MHWHJXDWBNTUNZ-DEOSSOPVSA-N 1 1 442.560 3.291 20 0 IGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@]2(CCCN(c3nc4ncccc4nc3Cl)C2)C1 ZINC001164776140 721349740 /nfs/dbraw/zinc/34/97/40/721349740.db2.gz AHGZUQXSEAZHTE-JOCHJYFZSA-N 1 1 442.951 3.402 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@]2(CCCN(c3nc4ncccc4nc3Cl)C2)C1 ZINC001164776140 721349741 /nfs/dbraw/zinc/34/97/41/721349741.db2.gz AHGZUQXSEAZHTE-JOCHJYFZSA-N 1 1 442.951 3.402 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@@]2(CCCN(c3nnc(Cl)c4cccnc43)C2)C1 ZINC001164777296 721351773 /nfs/dbraw/zinc/35/17/73/721351773.db2.gz FRZJFHPHAYERRL-QFIPXVFZSA-N 1 1 442.951 3.402 20 0 IGADMO COC(=O)c1ccc(Cl)c(N2CCC[C@]3(C2)COCC[N@H+](Cc2c(C)noc2C)C3)n1 ZINC001164777802 721353302 /nfs/dbraw/zinc/35/33/02/721353302.db2.gz ICDLTVLDHSNFIV-QFIPXVFZSA-N 1 1 448.951 3.245 20 0 IGADMO COC(=O)c1ccc(Cl)c(N2CCC[C@]3(C2)COCC[N@@H+](Cc2c(C)noc2C)C3)n1 ZINC001164777802 721353308 /nfs/dbraw/zinc/35/33/08/721353308.db2.gz ICDLTVLDHSNFIV-QFIPXVFZSA-N 1 1 448.951 3.245 20 0 IGADMO COc1nnc(N2CCC[C@@]3(C2)COCC[N@@H+](Cc2c(C)noc2C)C3)c2ccccc21 ZINC001164785146 721365776 /nfs/dbraw/zinc/36/57/76/721365776.db2.gz SCDNSNBBQIHLDQ-XMMPIXPASA-N 1 1 437.544 3.362 20 0 IGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@@]2(CCCN(c3cc(-c4ccccn4)ncn3)C2)C1 ZINC001164786037 721367630 /nfs/dbraw/zinc/36/76/30/721367630.db2.gz UXZKDMDXRPAUSJ-DEOSSOPVSA-N 1 1 434.544 3.262 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@@]2(CCCN(c3cc(-c4ccccn4)ncn3)C2)C1 ZINC001164786037 721367634 /nfs/dbraw/zinc/36/76/34/721367634.db2.gz UXZKDMDXRPAUSJ-DEOSSOPVSA-N 1 1 434.544 3.262 20 0 IGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@@]2(CCCN(c3ccc(-c4ccccn4)nn3)C2)C1 ZINC001164780231 721370097 /nfs/dbraw/zinc/37/00/97/721370097.db2.gz DJJCQLWITRBPBC-DEOSSOPVSA-N 1 1 434.544 3.262 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@@]2(CCCN(c3ccc(-c4ccccn4)nn3)C2)C1 ZINC001164780231 721370101 /nfs/dbraw/zinc/37/01/01/721370101.db2.gz DJJCQLWITRBPBC-DEOSSOPVSA-N 1 1 434.544 3.262 20 0 IGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2C[C@@H](NC(=O)c3cccnc3)[C@H]3OCCC[C@H]3C2)nc1 ZINC001164788539 721381763 /nfs/dbraw/zinc/38/17/63/721381763.db2.gz ZPFJMPHDJSXXSX-KBOSCXGNSA-N 1 1 449.599 3.437 20 0 IGADMO C[NH+]1CCN(C[C@@H]2CCC[C@]3(CCN(C(F)(F)c4ccc(F)c(Cl)n4)C3)O2)CC1 ZINC001164886756 721389970 /nfs/dbraw/zinc/38/99/70/721389970.db2.gz GDTMQFCWYAGNSQ-HNAYVOBHSA-N 1 1 432.918 3.184 20 0 IGADMO C[NH+]1CCN(C[C@H]2CCC[C@@]3(CCN(c4nccc(-c5ccc(F)cc5)n4)C3)O2)CC1 ZINC001164888330 721407689 /nfs/dbraw/zinc/40/76/89/721407689.db2.gz OGGBPZBWCIMFAI-QPPBQGQZSA-N 1 1 425.552 3.048 20 0 IGADMO COC(=O)c1ccc2c(c1)nc(Cl)nc2N1C[C@H]2C[NH+](Cc3nccs3)C[C@@H]2C1 ZINC001164781830 721411583 /nfs/dbraw/zinc/41/15/83/721411583.db2.gz FIXDTGBRPHKEIT-ZIAGYGMSSA-N 1 1 429.933 3.095 20 0 IGADMO CC(C)CNC(=O)c1ccc2c(c1)ncnc2N1C[C@H]2C[NH+](Cc3nccs3)C[C@@H]2C1 ZINC001164786356 721420071 /nfs/dbraw/zinc/42/00/71/721420071.db2.gz OVKOFKMSLLCOJY-QZTJIDSGSA-N 1 1 436.585 3.040 20 0 IGADMO Cc1nc2c3ccccc3oc2c(N2CC[C@@]3(C2)CCC[C@@H](CN2CC[NH+](C)CC2)O3)n1 ZINC001164884020 721422113 /nfs/dbraw/zinc/42/21/13/721422113.db2.gz CXOZDJWSYGGZTG-UQBPGWFLSA-N 1 1 435.572 3.450 20 0 IGADMO C[NH+]1CCN(C[C@@H]2CCC[C@@]3(CCN(c4nccc(Oc5cccc(F)c5)n4)C3)O2)CC1 ZINC001164890245 721427671 /nfs/dbraw/zinc/42/76/71/721427671.db2.gz CQVGCZNONBOMQD-URXFXBBRSA-N 1 1 441.551 3.173 20 0 IGADMO O=C(Nc1ccc(Cl)nc1)OCC(F)(F)N1C[C@@H]2C[N@@H+](Cc3nccs3)C[C@@H]2C1 ZINC001164790301 721437949 /nfs/dbraw/zinc/43/79/49/721437949.db2.gz XMSZZKUKRWAPIH-BETUJISGSA-N 1 1 443.907 3.397 20 0 IGADMO O=C(Nc1ccc(Cl)nc1)OCC(F)(F)N1C[C@@H]2C[N@H+](Cc3nccs3)C[C@@H]2C1 ZINC001164790301 721437951 /nfs/dbraw/zinc/43/79/51/721437951.db2.gz XMSZZKUKRWAPIH-BETUJISGSA-N 1 1 443.907 3.397 20 0 IGADMO C[NH+]1CCN(C[C@@H]2CCC[C@]3(CCN(c4ccc(-c5c(F)cccc5F)nn4)C3)O2)CC1 ZINC001164893659 721441553 /nfs/dbraw/zinc/44/15/53/721441553.db2.gz JVPKPPYTZNVGRD-MHECFPHRSA-N 1 1 443.542 3.187 20 0 IGADMO CC(C)c1noc(-c2ccnc(N3CC[C@@]4(C3)CCC[C@H](CN3CC[NH+](C)CC3)O4)c2)n1 ZINC001164898387 721442494 /nfs/dbraw/zinc/44/24/94/721442494.db2.gz VXCPYZFENWBXSC-HYBUGGRVSA-N 1 1 440.592 3.020 20 0 IGADMO C[NH+]1CCN(C[C@H]2CCC[C@@]3(CCN(c4nc(C(F)F)nc5ccc(F)cc54)C3)O2)CC1 ZINC001164894332 721445827 /nfs/dbraw/zinc/44/58/27/721445827.db2.gz LSUKNKVQLYYNDO-HXOBKFHXSA-N 1 1 449.521 3.472 20 0 IGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(C(F)(F)c1ccnc(Cl)n1)CC2 ZINC001164789249 721447893 /nfs/dbraw/zinc/44/78/93/721447893.db2.gz UFCMLVZHTIDITJ-KRWDZBQOSA-N 1 1 444.954 3.409 20 0 IGADMO Cc1cnc(N2CC[C@]3(C2)CCC[C@H](CN2CC[NH+](C)CC2)O3)nc1-c1ccccc1F ZINC001164887156 721448219 /nfs/dbraw/zinc/44/82/19/721448219.db2.gz IXZAXXADMONGFJ-NLFFAJNJSA-N 1 1 439.579 3.357 20 0 IGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(C(F)(F)c1cnc(Cl)cn1)CC2 ZINC001164783235 721452134 /nfs/dbraw/zinc/45/21/34/721452134.db2.gz AOAAAGGJGUVKED-QGZVFWFLSA-N 1 1 444.954 3.409 20 0 IGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(C(F)(F)c1nccc(Cl)n1)CC2 ZINC001164783238 721452764 /nfs/dbraw/zinc/45/27/64/721452764.db2.gz AQNIVTMKQGLETF-KRWDZBQOSA-N 1 1 444.954 3.409 20 0 IGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1nccc(C)c1NC(C)=O)CC2 ZINC001164789904 721464750 /nfs/dbraw/zinc/46/47/50/721464750.db2.gz YKFFMXVIRZGLQB-NRFANRHFSA-N 1 1 430.593 3.082 20 0 IGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1ccc(-c3ccccn3)nn1)CC2 ZINC001164790609 721469282 /nfs/dbraw/zinc/46/92/82/721469282.db2.gz SFMMUIRXHSIUEZ-NRFANRHFSA-N 1 1 437.588 3.273 20 0 IGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1cc3c(nn1)CC[C@H](C)C3)CC2 ZINC001164789564 721470676 /nfs/dbraw/zinc/47/06/76/721470676.db2.gz OEAXWEYXGFJMGJ-SIKLNZKXSA-N 1 1 428.621 3.335 20 0 IGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1ccnc(-c3nccs3)n1)CC2 ZINC001164789937 721473148 /nfs/dbraw/zinc/47/31/48/721473148.db2.gz PEYHMSYEVFZHAW-IBGZPJMESA-N 1 1 443.617 3.334 20 0 IGADMO C[N@@H+](Cc1ccncc1)C1CC2(C1)CCN(c1ccc(CN3C(=O)CCC3=O)cn1)CC2 ZINC001164795991 721498045 /nfs/dbraw/zinc/49/80/45/721498045.db2.gz OOIHRIHOTXPVFY-UHFFFAOYSA-N 1 1 433.556 3.007 20 0 IGADMO CC(C)(C)OC(=O)Nc1nccc(N2CC[N@H+]3C[C@@H](Oc4cccc(F)c4)C[C@@H]3C2)n1 ZINC001164902090 721525322 /nfs/dbraw/zinc/52/53/22/721525322.db2.gz ZDDWXKMPKORBCQ-AEFFLSMTSA-N 1 1 429.496 3.305 20 0 IGADMO CCOC(=O)c1ccc2ncnc(N3CC[N@H+]4C[C@@H](Oc5cccc(F)c5)C[C@@H]4C3)c2c1 ZINC001164912059 721534068 /nfs/dbraw/zinc/53/40/68/721534068.db2.gz YMJHTHDGYPJDGZ-QUCCMNQESA-N 1 1 436.487 3.288 20 0 IGADMO CCOC(=O)c1cc(Cl)nc(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@H]32)c1C ZINC001164804562 721552660 /nfs/dbraw/zinc/55/26/60/721552660.db2.gz KHFAYSKFIAGRPE-SVFBPWRDSA-N 1 1 444.963 3.483 20 0 IGADMO CN(C)c1cc(C(F)(F)N2CC[N@H+]3C[C@H](Oc4cccc(F)c4)C[C@H]3C2)nc(Cl)n1 ZINC001164904241 721564039 /nfs/dbraw/zinc/56/40/39/721564039.db2.gz DOCVIWQNWDUYHD-GOEBONIOSA-N 1 1 441.885 3.222 20 0 IGADMO COC(=O)c1cc2ccccc2nc1N1C[C@H]([N@H+](C)Cc2cccnc2)[C@H]2OCCC[C@H]21 ZINC001164799623 721566619 /nfs/dbraw/zinc/56/66/19/721566619.db2.gz CZCDELOUOUIJJK-VJBWXMMDSA-N 1 1 432.524 3.285 20 0 IGADMO COC(=O)c1cc2ccccc2nc1N1C[C@H]([N@@H+](C)Cc2cccnc2)[C@H]2OCCC[C@H]21 ZINC001164799623 721566623 /nfs/dbraw/zinc/56/66/23/721566623.db2.gz CZCDELOUOUIJJK-VJBWXMMDSA-N 1 1 432.524 3.285 20 0 IGADMO CCOC(=O)c1nc(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@@H]32)ccc1Cl ZINC001164800249 721570432 /nfs/dbraw/zinc/57/04/32/721570432.db2.gz DLHHBEPJUWUWEV-BBTUJRGHSA-N 1 1 430.936 3.175 20 0 IGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(C(F)(F)c2cc(Cl)nc(=S)[nH]2)[C@H]2CCCO[C@@H]12 ZINC001164803950 721571410 /nfs/dbraw/zinc/57/14/10/721571410.db2.gz JXNJGLHNZAZVFD-JJRVBVJISA-N 1 1 441.935 3.227 20 0 IGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(C(F)(F)c2cc(Cl)nc(=S)[nH]2)[C@H]2CCCO[C@@H]12 ZINC001164803950 721571414 /nfs/dbraw/zinc/57/14/14/721571414.db2.gz JXNJGLHNZAZVFD-JJRVBVJISA-N 1 1 441.935 3.227 20 0 IGADMO COC(=O)c1cc2ccccc2c(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@H]3OCCC[C@H]32)n1 ZINC001164806986 721581698 /nfs/dbraw/zinc/58/16/98/721581698.db2.gz OHRKNZYOKKDKMB-VJBWXMMDSA-N 1 1 432.524 3.285 20 0 IGADMO Cc1nc(-c2ccncc2)nc(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@H]32)c1C ZINC001164811990 721585273 /nfs/dbraw/zinc/58/52/73/721585273.db2.gz ZGNLKRQFFIHOPY-XPWALMASSA-N 1 1 430.556 3.419 20 0 IGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2nc(-c3ccncc3)nc3c2CCC3)[C@@H]2CCCO[C@@H]12 ZINC001164807568 721585896 /nfs/dbraw/zinc/58/58/96/721585896.db2.gz OMMANKKTDPHFHW-WXFUMESZSA-N 1 1 442.567 3.291 20 0 IGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2ncnc3c2ncn3-c2ccccc2)[C@@H]2CCCO[C@H]12 ZINC001164799371 721587371 /nfs/dbraw/zinc/58/73/71/721587371.db2.gz AZNKUYQHPUAKAQ-XPNTWCBSSA-N 1 1 441.539 3.079 20 0 IGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2ncnc3c2ncn3-c2ccccc2)[C@@H]2CCCO[C@H]12 ZINC001164799371 721587375 /nfs/dbraw/zinc/58/73/75/721587375.db2.gz AZNKUYQHPUAKAQ-XPNTWCBSSA-N 1 1 441.539 3.079 20 0 IGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2ncc(C(N)=S)c3ccsc32)[C@@H]2CCCO[C@H]12 ZINC001164805100 721591722 /nfs/dbraw/zinc/59/17/22/721591722.db2.gz KQJMYIKZBJFQSI-QRVBRYPASA-N 1 1 439.610 3.194 20 0 IGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2ncc(C(N)=S)c3ccsc32)[C@@H]2CCCO[C@H]12 ZINC001164805100 721591724 /nfs/dbraw/zinc/59/17/24/721591724.db2.gz KQJMYIKZBJFQSI-QRVBRYPASA-N 1 1 439.610 3.194 20 0 IGADMO CC(C)N(C)Cc1nnc2n1CCCN(c1ccc3c(n1)CC[N@H+](Cc1ccccc1)C3)C2 ZINC001165011766 721699940 /nfs/dbraw/zinc/69/99/40/721699940.db2.gz YGBJYBPHNRLGGS-UHFFFAOYSA-N 1 1 445.615 3.482 20 0 IGADMO CCOC(=O)Cc1ccc(N2CCC(F)(F)[C@@]3(CC[N@@H+](Cc4ccccn4)C3)C2)nc1 ZINC001164904976 721704950 /nfs/dbraw/zinc/70/49/50/721704950.db2.gz GEBWWVILFMZYMN-JOCHJYFZSA-N 1 1 430.499 3.320 20 0 IGADMO O=c1cc2[nH]c(N3CCC(F)(F)[C@]4(CC[N@@H+](Cc5ccccn5)C4)C3)c(Cl)cc-2[nH]1 ZINC001164907676 721706259 /nfs/dbraw/zinc/70/62/59/721706259.db2.gz SMICHDZRVJKEOF-FQEVSTJZSA-N 1 1 433.890 3.362 20 0 IGADMO O=c1cc2[nH]c(N3CCC(F)(F)[C@@]4(CC[N@@H+](Cc5ccccn5)C4)C3)c(Cl)cc-2[nH]1 ZINC001164907679 721707376 /nfs/dbraw/zinc/70/73/76/721707376.db2.gz SMICHDZRVJKEOF-HXUWFJFHSA-N 1 1 433.890 3.362 20 0 IGADMO FC1(F)CCN(c2ncnc3c2ncn3C2CC2)C[C@]12CC[N@@H+](Cc1ccccn1)C2 ZINC001164912184 721725452 /nfs/dbraw/zinc/72/54/52/721725452.db2.gz MLMBUHAQHBFCHQ-OAQYLSRUSA-N 1 1 425.487 3.294 20 0 IGADMO CN1CCc2nc(Cl)nc(N3CCC(F)(F)[C@@]4(CC[N@@H+](Cc5ccccn5)C4)C3)c2C1 ZINC001164912572 721735948 /nfs/dbraw/zinc/73/59/48/721735948.db2.gz NUXDTZDTYWOSER-OAQYLSRUSA-N 1 1 448.949 3.251 20 0 IGADMO C[N@H+](Cc1ccco1)Cc1cncc2c1CCN(c1ccc(CN3CCOCC3)cn1)C2 ZINC001164908875 721745718 /nfs/dbraw/zinc/74/57/18/721745718.db2.gz NCYBLZQMYLKCBS-UHFFFAOYSA-N 1 1 433.556 3.097 20 0 IGADMO C[N@@H+](Cc1ccco1)Cc1cncc2c1CCN(c1ccc(CN3CCOCC3)cn1)C2 ZINC001164908875 721745721 /nfs/dbraw/zinc/74/57/21/721745721.db2.gz NCYBLZQMYLKCBS-UHFFFAOYSA-N 1 1 433.556 3.097 20 0 IGADMO COC(OC)c1c(CO)ccnc1N1CCc2c(C[N@H+](C)Cc3ccco3)cncc2C1 ZINC001164909039 721759161 /nfs/dbraw/zinc/75/91/61/721759161.db2.gz DGQUZPPTQLWTLN-UHFFFAOYSA-N 1 1 438.528 3.048 20 0 IGADMO COC(OC)c1c(CO)ccnc1N1CCc2c(C[N@@H+](C)Cc3ccco3)cncc2C1 ZINC001164909039 721759162 /nfs/dbraw/zinc/75/91/62/721759162.db2.gz DGQUZPPTQLWTLN-UHFFFAOYSA-N 1 1 438.528 3.048 20 0 IGADMO COCCOC(=O)c1ccnc(N2CCc3c(C[N@H+](C)Cc4ccco4)cncc3C2)c1 ZINC001164912518 721764744 /nfs/dbraw/zinc/76/47/44/721764744.db2.gz YMDCYGWKDFJLKI-UHFFFAOYSA-N 1 1 436.512 3.068 20 0 IGADMO COCCOC(=O)c1ccnc(N2CCc3c(C[N@@H+](C)Cc4ccco4)cncc3C2)c1 ZINC001164912518 721764746 /nfs/dbraw/zinc/76/47/46/721764746.db2.gz YMDCYGWKDFJLKI-UHFFFAOYSA-N 1 1 436.512 3.068 20 0 IGADMO CCC[N@H+]1CCCC[C@H]1c1ccc(N2CCOC[C@@]3(CN(C(=O)C(C)C)CCO3)C2)nc1 ZINC001165025670 721788398 /nfs/dbraw/zinc/78/83/98/721788398.db2.gz WGSSCQZWAVIDCV-DHLKQENFSA-N 1 1 444.620 3.109 20 0 IGADMO CCOC(=O)c1cc(Cl)nnc1N1C[C@@H]2CCC[C@H]([N@@H+](C)Cc3ccccn3)[C@H]2C1 ZINC001165027333 721806193 /nfs/dbraw/zinc/80/61/93/721806193.db2.gz VNJMPTJNILSLKR-SNRMKQJTSA-N 1 1 429.952 3.439 20 0 IGADMO C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@H]2CN(c3nc(Cl)ccc3S(C)(=O)=O)C[C@@H]21 ZINC001165021443 721822008 /nfs/dbraw/zinc/82/20/08/721822008.db2.gz FPVJBFFPRCVBNW-RYQLBKOJSA-N 1 1 434.993 3.270 20 0 IGADMO CN(C)CC[N@@H+]1CC[C@@H]2[C@@H]1CCN2c1cc(C(=O)Nc2ccc(Cl)nc2)ccc1F ZINC001164923097 721863824 /nfs/dbraw/zinc/86/38/24/721863824.db2.gz IBMQJKFCXNSYFF-RBUKOAKNSA-N 1 1 431.943 3.341 20 0 IGADMO CN(C)CC[N@H+]1CC[C@@H]2[C@@H]1CCN2c1cc(C(=O)Nc2ccc(Cl)nc2)ccc1F ZINC001164923097 721863825 /nfs/dbraw/zinc/86/38/25/721863825.db2.gz IBMQJKFCXNSYFF-RBUKOAKNSA-N 1 1 431.943 3.341 20 0 IGADMO CN(C)CC[N@H+]1CC[C@H]2[C@H]1CCN2c1nc(-c2cnccn2)nc2sc3c(c21)CCCC3 ZINC001164931512 721884992 /nfs/dbraw/zinc/88/49/92/721884992.db2.gz GGTKRRFLYOSJFW-MOPGFXCFSA-N 1 1 449.628 3.242 20 0 IGADMO C[NH+](C)CCN1CC[C@H]2[C@H]1CCN2c1nc(-c2cnccn2)nc2sc3c(c21)CCCC3 ZINC001164931512 721884993 /nfs/dbraw/zinc/88/49/93/721884993.db2.gz GGTKRRFLYOSJFW-MOPGFXCFSA-N 1 1 449.628 3.242 20 0 IGADMO CN1C(=O)CC[C@H]2[C@H]1CCN2c1nc(C[NH+]2CCCC2)nc2sc3c(c21)CCCC3 ZINC001164933699 721893230 /nfs/dbraw/zinc/89/32/30/721893230.db2.gz NBRGVNFRURYSMJ-SJORKVTESA-N 1 1 425.602 3.365 20 0 IGADMO O=C1NCC[N@@H+](Cc2ccccc2)C12CCN(c1nnc(Cl)cc1-c1ccncc1)CC2 ZINC001164944484 721970670 /nfs/dbraw/zinc/97/06/70/721970670.db2.gz JEUXKGXOBPBWMU-UHFFFAOYSA-N 1 1 448.958 3.163 20 0 IGADMO O=C1NCC[N@H+](Cc2ccccc2)C12CCN(c1nnc(Cl)cc1-c1ccncc1)CC2 ZINC001164944484 721970674 /nfs/dbraw/zinc/97/06/74/721970674.db2.gz JEUXKGXOBPBWMU-UHFFFAOYSA-N 1 1 448.958 3.163 20 0 IGADMO O=C1NCC[N@@H+](Cc2ccccc2)C12CCN(c1nnc(Cl)c3ccc(F)cc31)CC2 ZINC001164945572 721980252 /nfs/dbraw/zinc/98/02/52/721980252.db2.gz ALYSUJYFEYFSMN-UHFFFAOYSA-N 1 1 439.922 3.393 20 0 IGADMO O=C1NCC[N@H+](Cc2ccccc2)C12CCN(c1nnc(Cl)c3ccc(F)cc31)CC2 ZINC001164945572 721980254 /nfs/dbraw/zinc/98/02/54/721980254.db2.gz ALYSUJYFEYFSMN-UHFFFAOYSA-N 1 1 439.922 3.393 20 0 IGADMO C[N@@H+](Cc1ccc(N2CC[C@@H]3C(=O)N(Cc4cccc(F)c4)CCO[C@H]3C2)nc1)C1CC1 ZINC001164968580 722082506 /nfs/dbraw/zinc/08/25/06/722082506.db2.gz DUPJVUGVRZHIOX-GOTSBHOMSA-N 1 1 438.547 3.069 20 0 IGADMO C[N@@H+](Cc1ccc(N2CC[C@H]3C(=O)N(Cc4cccc(F)c4)CCO[C@@H]3C2)nc1)C1CC1 ZINC001164968579 722082528 /nfs/dbraw/zinc/08/25/28/722082528.db2.gz DUPJVUGVRZHIOX-DHIUTWEWSA-N 1 1 438.547 3.069 20 0 IGADMO Clc1c[nH]c2nc(Cl)nc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)c12 ZINC001164986292 722100185 /nfs/dbraw/zinc/10/01/85/722100185.db2.gz YQBHIBLIDZPMEH-GOEBONIOSA-N 1 1 433.343 3.387 20 0 IGADMO CC1(C)OCc2c1nc(Cl)nc2N1CC[C@@H]2C[N@@H+](Cc3cccnc3)CCO[C@@H]2C1 ZINC001164983217 722108753 /nfs/dbraw/zinc/10/87/53/722108753.db2.gz YNDYVIPFEPJWCZ-SJLPKXTDSA-N 1 1 429.952 3.018 20 0 IGADMO COc1cc2ccnc(N3CC[C@@H]4C[N@H+](Cc5cccnc5)CCO[C@@H]4C3)c2cc1OC ZINC001164980561 722121981 /nfs/dbraw/zinc/12/19/81/722121981.db2.gz RVMYKNUHCLZGSO-HYBUGGRVSA-N 1 1 434.540 3.374 20 0 IGADMO COc1cc2ccnc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)c2cc1OC ZINC001164980561 722121982 /nfs/dbraw/zinc/12/19/82/722121982.db2.gz RVMYKNUHCLZGSO-HYBUGGRVSA-N 1 1 434.540 3.374 20 0 IGADMO COc1cc2ccc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)nc2cc1OC ZINC001164974048 722127376 /nfs/dbraw/zinc/12/73/76/722127376.db2.gz IHKCNGJZYURZGF-RDPSFJRHSA-N 1 1 434.540 3.374 20 0 IGADMO c1ccc2nc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)c(N3CCCC3)nc2c1 ZINC001164980882 722138235 /nfs/dbraw/zinc/13/82/35/722138235.db2.gz NHJLCAGAAIOKED-ZJSXRUAMSA-N 1 1 444.583 3.352 20 0 IGADMO c1cncc(C[N@H+]2CCO[C@@H]3CN(c4cc(-c5nc(C6CC6)no5)ccn4)CC[C@H]3C2)c1 ZINC001164973922 722151673 /nfs/dbraw/zinc/15/16/73/722151673.db2.gz NNMXDPSPYZTHAQ-LEWJYISDSA-N 1 1 432.528 3.131 20 0 IGADMO Cc1nc(CN2CCO[C@H]3CCN(c4cc(N5CCCC5)nc(C)[nH+]4)CC[C@H]32)cs1 ZINC001164987084 722175933 /nfs/dbraw/zinc/17/59/33/722175933.db2.gz MJJNLRKOLJBHOS-UXHICEINSA-N 1 1 428.606 3.020 20 0 IGADMO Cc1nc(CN2CCO[C@H]3CCN(c4cc[nH+]c(N5CCCCC5)n4)CC[C@@H]32)cs1 ZINC001164987012 722184932 /nfs/dbraw/zinc/18/49/32/722184932.db2.gz IESCFFHUIXTAIG-PMACEKPBSA-N 1 1 428.606 3.102 20 0 IGADMO Cc1nc(CN2CCO[C@H]3CCN(c4ccc(C[N@H+](C)C5CC5)cn4)CC[C@@H]32)cs1 ZINC001164992991 722185682 /nfs/dbraw/zinc/18/56/82/722185682.db2.gz YMUIUHIXOQGNQH-VXKWHMMOSA-N 1 1 427.618 3.311 20 0 IGADMO O=S(=O)(c1cccnc1N1CCC[C@]2(CC[N@H+]2Cc2cccc(F)c2)C1)N1CCCC1 ZINC001164995620 722204460 /nfs/dbraw/zinc/20/44/60/722204460.db2.gz OQMAZQXANRRXBN-QHCPKHFHSA-N 1 1 444.576 3.250 20 0 IGADMO O=S(=O)(c1cccnc1N1CCC[C@]2(CC[N@@H+]2Cc2cccc(F)c2)C1)N1CCCC1 ZINC001164995620 722204465 /nfs/dbraw/zinc/20/44/65/722204465.db2.gz OQMAZQXANRRXBN-QHCPKHFHSA-N 1 1 444.576 3.250 20 0 IGADMO COC(=O)c1c[nH]c2nc(Cl)nc(N3CCC[C@H]4C[N@@H+](Cc5ccccc5)C[C@H]43)c12 ZINC001164631423 719095656 /nfs/dbraw/zinc/09/56/56/719095656.db2.gz YBPGWEWYMUXGOE-DOTOQJQBSA-N 1 1 425.920 3.499 20 0 IGADMO CCN(CC)S(=O)(=O)c1ccc(N2CCC[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)nc1 ZINC001164626842 719097581 /nfs/dbraw/zinc/09/75/81/719097581.db2.gz JEKMLIAVYZUVHR-RBBKRZOGSA-N 1 1 428.602 3.213 20 0 IGADMO COCCN1CC[N@H+](C)C2(CCN(c3nc(Cl)ccc3-c3ccccc3)CC2)C1=O ZINC001164632622 719274176 /nfs/dbraw/zinc/27/41/76/719274176.db2.gz AFHTWGFVNQZBNI-UHFFFAOYSA-N 1 1 428.964 3.161 20 0 IGADMO COCCN1CC[N@@H+](C)C2(CCN(c3nc(Cl)ccc3-c3ccccc3)CC2)C1=O ZINC001164632622 719274178 /nfs/dbraw/zinc/27/41/78/719274178.db2.gz AFHTWGFVNQZBNI-UHFFFAOYSA-N 1 1 428.964 3.161 20 0 IGADMO O=C(CC1CC1)N[C@@H]1CN(c2nc(Cl)ccc2C[NH+]2CCCC2)C[C@H]2CCCO[C@H]21 ZINC001164656618 719325142 /nfs/dbraw/zinc/32/51/42/719325142.db2.gz YRBVJLFPPVNLHD-SFGWALBWSA-N 1 1 432.996 3.231 20 0 IGADMO c1cn(Cc2noc3c2CN(c2ccc4c(n2)CC[N@H+](Cc2ccccc2)C4)CC3)cn1 ZINC001164678404 719563378 /nfs/dbraw/zinc/56/33/78/719563378.db2.gz YDTHPHSXPMAHOE-UHFFFAOYSA-N 1 1 426.524 3.435 20 0 IGADMO CNC(=O)C[N@H+]1CCCC12CCN(c1ccc(C(=O)Nc3cccc(Cl)c3)cn1)CC2 ZINC001164690281 719743227 /nfs/dbraw/zinc/74/32/27/719743227.db2.gz YEEQGESPMDFBEZ-UHFFFAOYSA-N 1 1 441.963 3.168 20 0 IGADMO CNC(=O)C[N@H+]1CCCC12CCN(c1cnc(Cl)nc1Oc1cccc(OC)c1)CC2 ZINC001164689593 719756781 /nfs/dbraw/zinc/75/67/81/719756781.db2.gz IRNOFXVSWLQJBA-UHFFFAOYSA-N 1 1 445.951 3.112 20 0 IGADMO CON(C)C(=O)c1cc(C)cnc1N1CCC2(CCC[N@H+]2Cc2csc(C)n2)CC1 ZINC001164693010 719811684 /nfs/dbraw/zinc/81/16/84/719811684.db2.gz STLHODJHYAIKAV-UHFFFAOYSA-N 1 1 429.590 3.423 20 0 IGADMO COC(=O)[C@@]1(C)C[C@@H]([NH+]2CCOCC2)CCN1c1cc(Cl)nc2cc(OC)ccc21 ZINC001164702004 719853535 /nfs/dbraw/zinc/85/35/35/719853535.db2.gz MJJXWSCDKGDLOY-OYHNWAKOSA-N 1 1 433.936 3.130 20 0 IGADMO CC(C)(C)C(=O)Nc1ccc(N2CCC3(CC2)C[N@@H+](Cc2cccs2)CCO3)nn1 ZINC001164694722 719892256 /nfs/dbraw/zinc/89/22/56/719892256.db2.gz DBKMJIJQGUKWSD-UHFFFAOYSA-N 1 1 429.590 3.394 20 0 IGADMO CCC[N@H+]1CCCC[C@@H]1c1ccc(N2C[C@@H]3COC[C@H](C(=O)N4CCCCO4)[C@@H]3C2)nc1 ZINC001164704183 719922544 /nfs/dbraw/zinc/92/25/44/719922544.db2.gz OPJVANAPMRASRS-BXXSPATCSA-N 1 1 442.604 3.271 20 0 IGADMO COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1ncc(Cl)cc1C(=O)OC)CC2 ZINC001164712614 720098363 /nfs/dbraw/zinc/09/83/63/720098363.db2.gz XITHFKJCWSPUAQ-IBGZPJMESA-N 1 1 444.963 3.424 20 0 IGADMO CCOC(=O)c1cc(F)cnc1N1CCC2(C[C@H](COC)[N@@H+](Cc3ccccn3)C2)CC1 ZINC001164709943 720103108 /nfs/dbraw/zinc/10/31/08/720103108.db2.gz DBNRJXNYHKJIOH-HXUWFJFHSA-N 1 1 442.535 3.300 20 0 IGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1nc3cc(OC)c(OC)cc3nc1Cl)C2 ZINC001164813868 720120519 /nfs/dbraw/zinc/12/05/19/720120519.db2.gz RJANTIGZXCVRJH-QMHKHESXSA-N 1 1 446.979 3.485 20 0 IGADMO COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1ccnc(-c3cccnc3)n1)CC2 ZINC001164718076 720125197 /nfs/dbraw/zinc/12/51/97/720125197.db2.gz RKMUDKBXMWONRG-QFIPXVFZSA-N 1 1 430.556 3.441 20 0 IGADMO COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1nc(C(N)=O)cc3ccccc31)CC2 ZINC001164712530 720146542 /nfs/dbraw/zinc/14/65/42/720146542.db2.gz NFAKADHIHYRVBT-NRFANRHFSA-N 1 1 445.567 3.236 20 0 IGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1ccc(C(=O)N3CCC[C@@H](C)C3)cn1)C2 ZINC001164816380 720164547 /nfs/dbraw/zinc/16/45/47/720164547.db2.gz LDMPYAJUYVHOND-RZTXVSJASA-N 1 1 426.605 3.138 20 0 IGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(C(F)(F)c1nc3ccc(Cl)nc3[nH]1)C2 ZINC001164820151 720178351 /nfs/dbraw/zinc/17/83/51/720178351.db2.gz ZSDOTNPMOGHTNK-AUUYWEPGSA-N 1 1 425.911 3.341 20 0 IGADMO COc1ccc(C(F)(F)N2CCCn3c(=O)cc(C[N@@H+](C)C(C)C)nc3C2)nc1Cl ZINC001164814915 720227197 /nfs/dbraw/zinc/22/71/97/720227197.db2.gz ZXOFCXCOZUJNKY-UHFFFAOYSA-N 1 1 441.910 3.096 20 0 IGADMO Cc1nc2sc3c(c2c(N2CCCn4c(=O)cc(C[N@H+](C)C(C)C)nc4C2)n1)CCC3 ZINC001164812069 720235689 /nfs/dbraw/zinc/23/56/89/720235689.db2.gz AXAUFSVCTNXVEN-UHFFFAOYSA-N 1 1 438.601 3.296 20 0 IGADMO Cc1nc(C)c(-c2ccc(N3CCCn4c(=O)cc(C[N@H+](C)C(C)C)nc4C3)nn2)s1 ZINC001164815225 720241768 /nfs/dbraw/zinc/24/17/68/720241768.db2.gz BVAAHDRRKDGPKH-UHFFFAOYSA-N 1 1 439.589 3.024 20 0 IGADMO Clc1nc2c(ncn2[C@H]2CCCCO2)c(N2CC[C@@H]3[C@H]2CC[N@H+]3Cc2cccnc2)n1 ZINC001164721660 720380235 /nfs/dbraw/zinc/38/02/35/720380235.db2.gz AIGLEGLJFDEPIA-KZNAEPCWSA-N 1 1 439.951 3.427 20 0 IGADMO Cc1noc([C@@H]2CC[C@H]3[C@@H](CCN3c3ncnc4c3CC[N@H+](Cc3ccccc3)C4)O2)n1 ZINC001164826680 720403962 /nfs/dbraw/zinc/40/39/62/720403962.db2.gz CREOTLRZVXVMSW-BDTNDASRSA-N 1 1 432.528 3.225 20 0 IGADMO Cc1noc([C@@H]2CC[C@H]3[C@@H](CCN3c3ncnc4c3CC[N@@H+](Cc3ccccc3)C4)O2)n1 ZINC001164826680 720403964 /nfs/dbraw/zinc/40/39/64/720403964.db2.gz CREOTLRZVXVMSW-BDTNDASRSA-N 1 1 432.528 3.225 20 0 IGADMO c1cncc(C[N@H+]2CC[C@@H]3[C@H]2CCN3c2ccc(-c3ccc(N4CCOCC4)cc3)nn2)c1 ZINC001164723069 720465986 /nfs/dbraw/zinc/46/59/86/720465986.db2.gz BTWCYJWQWVPZAL-JWQCQUIFSA-N 1 1 442.567 3.228 20 0 IGADMO COc1ccc(CN(C)c2ccnc(N3CC[C@@H]4[C@@H]3CC[N@H+]4Cc3cccnc3)n2)cc1 ZINC001164728956 720470731 /nfs/dbraw/zinc/47/07/31/720470731.db2.gz QAHMQCXJLFPVDM-PKTZIBPZSA-N 1 1 430.556 3.370 20 0 IGADMO CCOC(=O)c1cc2cccnc2nc1N1CC[C@@H]2[C@@H](C[C@H](Cn3cccn3)[N@H+]2C(C)C)C1 ZINC001164835057 720541811 /nfs/dbraw/zinc/54/18/11/720541811.db2.gz GVEYJVJLZVWRDJ-TUNNFDKTSA-N 1 1 448.571 3.381 20 0 IGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@H]2CN(c3nc(-c4ccccc4)nc(N(C)C)n3)CC[C@@H]21 ZINC001164842105 720562609 /nfs/dbraw/zinc/56/26/09/720562609.db2.gz WNIPCLNFBRVENL-FKBYEOEOSA-N 1 1 446.603 3.179 20 0 IGADMO CCOC(=O)c1nc(N2CC[C@@H]3[C@@H](C[C@@H](Cn4cccn4)[N@H+]3C(C)C)C2)ccc1Cl ZINC001164837747 720584129 /nfs/dbraw/zinc/58/41/29/720584129.db2.gz JCQSMUAWKFWPAO-JENIJYKNSA-N 1 1 431.968 3.486 20 0 IGADMO CC(C)[N@@H+]1[C@@H]2CCN(C(F)(F)COc3ccc(Cl)nn3)C[C@H]2C[C@H]1Cn1cccn1 ZINC001164836638 720602577 /nfs/dbraw/zinc/60/25/77/720602577.db2.gz GAPJYQGVTRLKES-IXDOHACOSA-N 1 1 440.926 3.172 20 0 IGADMO C[N@H+](Cc1ccccc1)[C@H]1COC2(C1)CCN(c1nc(Cl)nc3c1CCNC3)CC2 ZINC001164840964 720669753 /nfs/dbraw/zinc/66/97/53/720669753.db2.gz OJGMGNZGFSSPQX-GOSISDBHSA-N 1 1 427.980 3.036 20 0 IGADMO C[N@@H+](Cc1ccccc1)[C@H]1COC2(C1)CCN(c1nc(Cl)nc3c1CCNC3)CC2 ZINC001164840964 720669765 /nfs/dbraw/zinc/66/97/65/720669765.db2.gz OJGMGNZGFSSPQX-GOSISDBHSA-N 1 1 427.980 3.036 20 0 IGADMO C[N@@H+](Cc1ccccc1)[C@H]1COC2(C1)CCN(c1nc(Cl)cc3c1CNC3=O)CC2 ZINC001164845375 720699968 /nfs/dbraw/zinc/69/99/68/720699968.db2.gz YYLXBBKOFQNXSH-QGZVFWFLSA-N 1 1 426.948 3.238 20 0 IGADMO C[N@@H+](Cc1ccccc1)[C@@H]1COC2(C1)CCN(c1cc(N3CCSCC3)ncn1)CC2 ZINC001164836437 720720408 /nfs/dbraw/zinc/72/04/08/720720408.db2.gz AKAWSSLYEWEWCY-NRFANRHFSA-N 1 1 439.629 3.290 20 0 IGADMO Fc1cccc(Oc2nc(Cl)ncc2N2CC[N@H+]3C[C@@H](Oc4cncnc4)C[C@@H]3C2)c1 ZINC001164751277 720803068 /nfs/dbraw/zinc/80/30/68/720803068.db2.gz XTTDHZUIKHDWCP-WBVHZDCISA-N 1 1 442.882 3.193 20 0 IGADMO FC(F)(Oc1ccc(Cl)nc1)N1CC[C@@H]2[C@@H](C[C@@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164745994 720820650 /nfs/dbraw/zinc/82/06/50/720820650.db2.gz XRFYIZRUUVCRGZ-XYJFISCASA-N 1 1 438.910 3.131 20 0 IGADMO Cc1nc2sc3c(c2c(N2CC[C@@H]4[C@@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C2)n1)CCC3 ZINC001164745770 720846383 /nfs/dbraw/zinc/84/63/83/720846383.db2.gz NHLXHSHYPCPQSO-CMKODMSKSA-N 1 1 449.628 3.459 20 0 IGADMO COc1cc2cnc(N3CC[C@@H]4[C@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)cc2cc1OC ZINC001164745844 720850511 /nfs/dbraw/zinc/85/05/11/720850511.db2.gz NRNAEIZNCDGWHK-BHIFYINESA-N 1 1 448.571 3.223 20 0 IGADMO COCC[N@H+]1CCO[C@H]2CN(c3nc(-c4ccccc4)nc(-c4ccccc4)n3)CC[C@@H]2C1 ZINC001164850158 720852319 /nfs/dbraw/zinc/85/23/19/720852319.db2.gz DPIVGAHUOFTCEX-PKTZIBPZSA-N 1 1 445.567 3.379 20 0 IGADMO CCN(C)c1ccnc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COCc2cccnc2)n1 ZINC001164747422 720868234 /nfs/dbraw/zinc/86/82/34/720868234.db2.gz BQKFUOIDCAFZGS-RDGATRHJSA-N 1 1 436.604 3.083 20 0 IGADMO COc1cnc(Cl)nc1N1CC[C@@]2(C1)C[N@@H+](CC1CC1)C[C@H]2COCc1cccnc1 ZINC001164752402 720870926 /nfs/dbraw/zinc/87/09/26/720870926.db2.gz MWQBXGQZIFJRSJ-CVDCTZTESA-N 1 1 443.979 3.289 20 0 IGADMO COCC[N@H+]1CCO[C@H]2CN(c3cc(F)ccc3Oc3ccc(Cl)nn3)CC[C@@H]2C1 ZINC001164854452 720875072 /nfs/dbraw/zinc/87/50/72/720875072.db2.gz FGLRLPCMSJULCS-BEFAXECRSA-N 1 1 436.915 3.235 20 0 IGADMO Fc1cc2c(cn1)ncnc2N1CC[C@]2(C1)C[N@@H+](CC1CC1)C[C@H]2COCc1cccnc1 ZINC001164752185 720881347 /nfs/dbraw/zinc/88/13/47/720881347.db2.gz LYZAMSAJIYDMHK-NBGIEHNGSA-N 1 1 448.546 3.314 20 0 IGADMO Nc1cc(Cl)cnc1N1CC[C@]2(C1)C[N@@H+](CC1CC1)C[C@@H]2COCc1cccnc1 ZINC001164754199 720906240 /nfs/dbraw/zinc/90/62/40/720906240.db2.gz UGVZJLKPBHIVTA-AUSIDOKSSA-N 1 1 427.980 3.467 20 0 IGADMO COC(=O)c1cc2c(nc(Cl)nc2N2CCn3c(C[N@@H+](C)C(C)C)cnc3[C@H]2C)n1C ZINC001164861948 720995378 /nfs/dbraw/zinc/99/53/78/720995378.db2.gz ROTLKYABEQYYIN-CYBMUJFWSA-N 1 1 445.955 3.026 20 0 IGADMO CCC[C@H](C)NS(=O)(=O)c1ccc(N2CCn3c(C[N@@H+](C)C(C)C)cnc3[C@@H]2C)nc1 ZINC001164863545 721007185 /nfs/dbraw/zinc/00/71/85/721007185.db2.gz WBVXGOVNPCDAGV-ROUUACIJSA-N 1 1 448.637 3.166 20 0 IGADMO FC(F)(Oc1ccc2c(Cl)ncnc2c1)N1CCc2[nH+]cc(Cn3cccn3)n2CC1 ZINC001164864088 721032810 /nfs/dbraw/zinc/03/28/10/721032810.db2.gz XDQWKORCMKMWEH-UHFFFAOYSA-N 1 1 445.861 3.212 20 0 IGADMO c1cncc(CO[C@@H]2C[C@H]3CN(c4nccnc4C4SCCCS4)CC[N@H+]3C2)c1 ZINC001164868220 721070842 /nfs/dbraw/zinc/07/08/42/721070842.db2.gz NQSXLJHQJUYLRQ-ZWKOTPCHSA-N 1 1 429.615 3.220 20 0 IGADMO Fc1cc2nc(Cl)c(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@@H]4C3)nc2cc1F ZINC001164863755 721078260 /nfs/dbraw/zinc/07/82/60/721078260.db2.gz DEOVVUWGGFVFNR-CABCVRRESA-N 1 1 431.874 3.436 20 0 IGADMO COc1cc2c(cc1Cl)ncnc2N1CC[N@H+]2C[C@@H](OCc3cccnc3)C[C@@H]2C1 ZINC001164865917 721091100 /nfs/dbraw/zinc/09/11/00/721091100.db2.gz PRSZMDVZSPOPSN-SJORKVTESA-N 1 1 425.920 3.167 20 0 IGADMO COc1cccc2nc(Cl)nc(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@@H]4C3)c21 ZINC001164866191 721097029 /nfs/dbraw/zinc/09/70/29/721097029.db2.gz RUEYRKTWXARRMP-IAGOWNOFSA-N 1 1 425.920 3.167 20 0 IGADMO FC(F)(c1ccc2ncnc(Cl)c2n1)N1CC[N@H+]2C[C@H](OCc3cccnc3)C[C@@H]2C1 ZINC001164864572 721106830 /nfs/dbraw/zinc/10/68/30/721106830.db2.gz GLWNMVOGAOKLET-HZPDHXFCSA-N 1 1 446.889 3.098 20 0 IGADMO COc1cccc(Oc2cncc(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@H]4C3)n2)c1 ZINC001164865440 721117440 /nfs/dbraw/zinc/11/74/40/721117440.db2.gz LIVCORMLIBVJBK-SIKLNZKXSA-N 1 1 433.512 3.152 20 0 IGADMO c1ccc2nc(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@@H]4C3)c(N3CCCCC3)nc2c1 ZINC001164874430 721135890 /nfs/dbraw/zinc/13/58/90/721135890.db2.gz JXOOMVYDEKKPLS-FGZHOGPDSA-N 1 1 444.583 3.495 20 0 IGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4cc(Cl)ncc4C(=O)OC(C)(C)C)C[C@@H]3C2)cn1 ZINC001164768347 721156964 /nfs/dbraw/zinc/15/69/64/721156964.db2.gz OHUVAKNEAJHPHV-SJORKVTESA-N 1 1 431.968 3.382 20 0 IGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4nc(-c5ccccn5)nc5sccc54)C[C@H]3C2)cn1 ZINC001164766167 721229928 /nfs/dbraw/zinc/22/99/28/721229928.db2.gz SIBGRTNTVPUKPI-ZWKOTPCHSA-N 1 1 431.569 3.445 20 0 IGADMO Cc1ccc2cc(Cl)nc(N3CCC4(CC3)COCC[N@H+](CC(=O)N(C)C)C4)c2c1 ZINC001164874441 721279695 /nfs/dbraw/zinc/27/96/95/721279695.db2.gz RRNJPNMSEVNAJC-UHFFFAOYSA-N 1 1 430.980 3.204 20 0 IGADMO C[NH+]1CCC(Oc2ccnc(N3CCC4(CCN(C(=O)c5cscn5)C4)CC3)c2)CC1 ZINC001164873954 721329803 /nfs/dbraw/zinc/32/98/03/721329803.db2.gz DXYWTHKAHVXZHY-UHFFFAOYSA-N 1 1 441.601 3.144 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@]2(CCCN(c3nc(Cl)nc4[nH]cc(F)c43)C2)C1 ZINC001164777034 721332194 /nfs/dbraw/zinc/33/21/94/721332194.db2.gz KNRXCMDKPKFNMX-OAQYLSRUSA-N 1 1 448.930 3.474 20 0 IGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@@]2(CCCN(C(F)(F)c3cncc(Cl)n3)C2)C1 ZINC001164784212 721362216 /nfs/dbraw/zinc/36/22/16/721362216.db2.gz QXMIZFUKMSTMLT-IBGZPJMESA-N 1 1 441.910 3.399 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@@]2(CCCN(C(F)(F)c3cncc(Cl)n3)C2)C1 ZINC001164784212 721362217 /nfs/dbraw/zinc/36/22/17/721362217.db2.gz QXMIZFUKMSTMLT-IBGZPJMESA-N 1 1 441.910 3.399 20 0 IGADMO Cc1noc(C)c1CN1CCOC[C@]2(CCCN(c3ncccc3C[NH+]3CCCC3)C2)C1 ZINC001164784600 721374472 /nfs/dbraw/zinc/37/44/72/721374472.db2.gz QRWVDBGLQJSIAN-RUZDIDTESA-N 1 1 439.604 3.401 20 0 IGADMO COc1ccc2nc(Cl)nc(N3CC[C@]4(C3)CCC[C@@H](CN3CC[NH+](C)CC3)O4)c2c1 ZINC001164886726 721380290 /nfs/dbraw/zinc/38/02/90/721380290.db2.gz FYMXULOJAPPOCB-MBSDFSHPSA-N 1 1 445.995 3.057 20 0 IGADMO COc1cc(C(F)(F)N2CC[C@@]3(C2)CCC[C@@H](CN2CC[NH+](C)CC2)O3)cc(Cl)n1 ZINC001164890464 721387733 /nfs/dbraw/zinc/38/77/33/721387733.db2.gz NMAFYGLASYLOQX-FXAWDEMLSA-N 1 1 444.954 3.054 20 0 IGADMO COc1cc(C(F)(F)N2CC[C@]3(C2)CCC[C@@H](CN2CC[NH+](C)CC2)O3)cc(Cl)n1 ZINC001164890466 721387818 /nfs/dbraw/zinc/38/78/18/721387818.db2.gz NMAFYGLASYLOQX-PXNSSMCTSA-N 1 1 444.954 3.054 20 0 IGADMO COc1cc2nc(Cl)nc(N3C[C@H]4C[NH+](Cc5nccs5)C[C@@H]4C3)c2cc1OC ZINC001164789892 721403853 /nfs/dbraw/zinc/40/38/53/721403853.db2.gz VBLMODRAPVUDES-CHWSQXEVSA-N 1 1 431.949 3.325 20 0 IGADMO c1csc(C[NH+]2C[C@H]3CN(c4ncnc5c4CCN(Cc4ccccc4)C5)C[C@@H]3C2)n1 ZINC001164790756 721406373 /nfs/dbraw/zinc/40/63/73/721406373.db2.gz XXKGSOCSHZSLIY-PMACEKPBSA-N 1 1 432.597 3.060 20 0 IGADMO Cc1nc2cc(Cl)ccc2c(N2CC[C@@]3(C2)CCC[C@@H](CN2CC[NH+](C)CC2)O3)n1 ZINC001164890513 721412623 /nfs/dbraw/zinc/41/26/23/721412623.db2.gz SWLLTMZZFOVORN-WMZHIEFXSA-N 1 1 429.996 3.357 20 0 IGADMO Fc1ccccc1Cn1cnc2c1ncnc2N1C[C@@H]2C[NH+](Cc3nccs3)C[C@H]2C1 ZINC001164780604 721416479 /nfs/dbraw/zinc/41/64/79/721416479.db2.gz BNOOGCAMLYJCIE-IRXDYDNUSA-N 1 1 435.532 3.038 20 0 IGADMO C[NH+]1CCN(C[C@H]2CCC[C@]3(CCN(c4cc5nc(Cl)cnc5cc4F)C3)O2)CC1 ZINC001164891779 721439897 /nfs/dbraw/zinc/43/98/97/721439897.db2.gz HKMTWFFJKPGFEH-OPAMFIHVSA-N 1 1 433.959 3.188 20 0 IGADMO Cc1c(Cl)nc(CC(C)C)nc1N1CC[C@@]2(C1)CCC[C@@H](CN1CC[NH+](C)CC1)O2 ZINC001164896180 721446731 /nfs/dbraw/zinc/44/67/31/721446731.db2.gz QTXBWZYEIQAMNG-WMZHIEFXSA-N 1 1 436.044 3.402 20 0 IGADMO Cc1cnc(N2CC[C@@]3(C2)CCC[C@@H](CN2CC[NH+](C)CC2)O3)nc1-c1ccccc1F ZINC001164887153 721448608 /nfs/dbraw/zinc/44/86/08/721448608.db2.gz IXZAXXADMONGFJ-NBGIEHNGSA-N 1 1 439.579 3.357 20 0 IGADMO C[NH+]1CCN(C[C@@H]2CCC[C@@]3(CCN(c4c(Cl)nc(Cl)nc4C4CC4)C3)O2)CC1 ZINC001164886475 721451102 /nfs/dbraw/zinc/45/11/02/721451102.db2.gz GSCGXCHICQIDGV-KKSFZXQISA-N 1 1 440.419 3.426 20 0 IGADMO C[NH+]1CCN(C[C@H]2CCC[C@@]3(CCN(c4c(F)ccc5c(Cl)ncnc54)C3)O2)CC1 ZINC001164891647 721452038 /nfs/dbraw/zinc/45/20/38/721452038.db2.gz VDEUEHNTJAXGBK-ZHRRBRCNSA-N 1 1 433.959 3.188 20 0 IGADMO C[NH+]1CCN(C[C@@H]2CCC[C@]3(CCN(c4ncnc5[nH]c6cc(F)ccc6c54)C3)O2)CC1 ZINC001164887132 721452978 /nfs/dbraw/zinc/45/29/78/721452978.db2.gz IVOFKRXSAXCCJV-MHECFPHRSA-N 1 1 438.551 3.016 20 0 IGADMO Cc1nc(CN2CC[C@@]3(CCCN(c4ccc(C[N@H+](C)C5CC5)cn4)C3)C2=O)cs1 ZINC001164891165 721461946 /nfs/dbraw/zinc/46/19/46/721461946.db2.gz UHSJYJVHJJDQPI-HSZRJFAPSA-N 1 1 425.602 3.460 20 0 IGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1nc3ccc(Cl)nc3[nH]1)CC2 ZINC001164782723 721463989 /nfs/dbraw/zinc/46/39/89/721463989.db2.gz BDQGELDTYFOGPY-QGZVFWFLSA-N 1 1 433.984 3.345 20 0 IGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1cc(-c3nc(C)no3)ccn1)CC2 ZINC001164789538 721467908 /nfs/dbraw/zinc/46/79/08/721467908.db2.gz NZFUIUVBVAEZHB-NRFANRHFSA-N 1 1 441.576 3.174 20 0 IGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1cncc(OCC(C)C)n1)CC2 ZINC001164786826 721467918 /nfs/dbraw/zinc/46/79/18/721467918.db2.gz CIPCHTALIFIVMH-NRFANRHFSA-N 1 1 432.609 3.245 20 0 IGADMO CN(C)c1cc(C(F)(F)N2CC[N@H+]3C[C@@H](Oc4cccc(F)c4)C[C@@H]3C2)nc(Cl)n1 ZINC001164904245 721564400 /nfs/dbraw/zinc/56/44/00/721564400.db2.gz DOCVIWQNWDUYHD-ZBFHGGJFSA-N 1 1 441.885 3.222 20 0 IGADMO CC(C)n1cnc2c1nc(Cl)nc2N1C[C@H]([N@H+](C)Cc2cccnc2)[C@H]2OCCC[C@@H]21 ZINC001164805351 721568765 /nfs/dbraw/zinc/56/87/65/721568765.db2.gz MSTHEPQOEIVTAY-LNLFQRSKSA-N 1 1 441.967 3.324 20 0 IGADMO CC(C)n1cnc2c1nc(Cl)nc2N1C[C@H]([N@@H+](C)Cc2cccnc2)[C@H]2OCCC[C@@H]21 ZINC001164805351 721568766 /nfs/dbraw/zinc/56/87/66/721568766.db2.gz MSTHEPQOEIVTAY-LNLFQRSKSA-N 1 1 441.967 3.324 20 0 IGADMO CC1CCN(C(=O)c2ccc(N3C[C@H]([N@@H+](C)Cc4cccnc4)[C@@H]4OCCC[C@H]43)nc2)CC1 ZINC001164800219 721576595 /nfs/dbraw/zinc/57/65/95/721576595.db2.gz DJYACUULDWLNFO-GIFXNVAJSA-N 1 1 449.599 3.217 20 0 IGADMO COc1cnc(N2CCC(F)(F)[C@]3(CC[N@@H+](Cc4ccccn4)C3)C2)nc1NC(C)C ZINC001164902868 721582843 /nfs/dbraw/zinc/58/28/43/721582843.db2.gz JWKZNCJOBBAVIQ-NRFANRHFSA-N 1 1 432.519 3.438 20 0 IGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2nc(-c3cccnc3)nc3c2CCC3)[C@@H]2CCCO[C@H]12 ZINC001164807530 721586077 /nfs/dbraw/zinc/58/60/77/721586077.db2.gz OIZMJHGXGTWZLW-SMIHKQSGSA-N 1 1 442.567 3.291 20 0 IGADMO CC[N@H+]1CCCC[C@H]1c1ccc(N2CC[C@]3(C2)COCc2c(C)nc(N(C)C)nc23)nc1 ZINC001164799758 721606696 /nfs/dbraw/zinc/60/66/96/721606696.db2.gz BPEANRDCCBIODG-OFVILXPXSA-N 1 1 436.604 3.471 20 0 IGADMO CC(C)N(C)Cc1nnc2n1CCCN(c1[nH+]cnc3c1ccn3Cc1cccc(F)c1)C2 ZINC001165011804 721705973 /nfs/dbraw/zinc/70/59/73/721705973.db2.gz ZEJBEWOKUYQSOL-UHFFFAOYSA-N 1 1 448.550 3.461 20 0 IGADMO COC(=O)c1nc(Cl)cnc1N1CCC(F)(F)[C@@]2(CC[N@@H+](Cc3ccccn3)C2)C1 ZINC001164907859 721707072 /nfs/dbraw/zinc/70/70/72/721707072.db2.gz UVTHUYYTWSNIPB-LJQANCHMSA-N 1 1 437.878 3.049 20 0 IGADMO CCOC(=O)c1cnc(N2CCC(F)(F)[C@@]3(CC[N@@H+](Cc4ccccn4)C3)C2)c(OC)c1 ZINC001164906456 721712646 /nfs/dbraw/zinc/71/26/46/721712646.db2.gz MAQAWCJMFSZUKZ-JOCHJYFZSA-N 1 1 446.498 3.400 20 0 IGADMO O=C(c1ccnc(N2CCC(F)(F)[C@@]3(CC[N@@H+](Cc4ccccn4)C3)C2)c1)N1CCCC1 ZINC001164906778 721715904 /nfs/dbraw/zinc/71/59/04/721715904.db2.gz ODQNKYQTKAYPFF-HSZRJFAPSA-N 1 1 441.526 3.450 20 0 IGADMO F[C@H](Oc1cncc(Cl)n1)N1CCC(F)(F)[C@]2(CC[N@@H+](Cc3ccccn3)C2)C1 ZINC001164911241 721732818 /nfs/dbraw/zinc/73/28/18/721732818.db2.gz JFONKRGRPRILSH-ROUUACIJSA-N 1 1 427.858 3.390 20 0 IGADMO CCOC(=O)c1cc(Cl)nnc1N1CCc2c(C[N@H+](C)Cc3ccco3)cncc2C1 ZINC001164907980 721749472 /nfs/dbraw/zinc/74/94/72/721749472.db2.gz FPCRELCZWJPKPM-UHFFFAOYSA-N 1 1 441.919 3.489 20 0 IGADMO CCOC(=O)c1cc(Cl)nnc1N1CCc2c(C[N@@H+](C)Cc3ccco3)cncc2C1 ZINC001164907980 721749481 /nfs/dbraw/zinc/74/94/81/721749481.db2.gz FPCRELCZWJPKPM-UHFFFAOYSA-N 1 1 441.919 3.489 20 0 IGADMO CCOC(=O)c1cnc(N2CCc3c(C[N@H+](C)Cc4ccco4)cncc3C2)c(OC)c1 ZINC001164911577 721757083 /nfs/dbraw/zinc/75/70/83/721757083.db2.gz WSLVRYSTYCRKCQ-UHFFFAOYSA-N 1 1 436.512 3.450 20 0 IGADMO CCOC(=O)c1cnc(N2CCc3c(C[N@@H+](C)Cc4ccco4)cncc3C2)c(OC)c1 ZINC001164911577 721757088 /nfs/dbraw/zinc/75/70/88/721757088.db2.gz WSLVRYSTYCRKCQ-UHFFFAOYSA-N 1 1 436.512 3.450 20 0 IGADMO Cc1sc2nc(C[NH+]3CCCC3)nc(N3C[C@H]4CN(c5cccnc5)C(=O)[C@@H]4C3)c2c1C ZINC001165022752 721791889 /nfs/dbraw/zinc/79/18/89/721791889.db2.gz OBVSJRMQBLCTBW-PKOBYXMFSA-N 1 1 448.596 3.398 20 0 IGADMO CCOC(=O)c1nc2ccn(C)c2c(N2C[C@@H]3CCC[C@H]([N@@H+](C)Cc4ccccn4)[C@@H]3C2)n1 ZINC001165025479 721820832 /nfs/dbraw/zinc/82/08/32/721820832.db2.gz MXIQZGJZRXZBQU-DSKINZAPSA-N 1 1 448.571 3.277 20 0 IGADMO CCNC(=O)c1cc(Cl)nc(N2C[C@@H]3CCC[C@H]([N@@H+](C)Cc4ccccn4)[C@H]3C2)n1 ZINC001165029028 721832314 /nfs/dbraw/zinc/83/23/14/721832314.db2.gz WLMFRNZXXYMFIS-IEZWGBDMSA-N 1 1 428.968 3.012 20 0 IGADMO CN(c1ncccn1)[C@@H]1CO[C@]2(C1)CCCN(c1nc(Cl)ccc1C[NH+]1CCCC1)C2 ZINC001164925283 721836098 /nfs/dbraw/zinc/83/60/98/721836098.db2.gz ODZNCFRIFBIUAV-CVDCTZTESA-N 1 1 442.995 3.385 20 0 IGADMO COC(=O)Cc1c(Cl)ncnc1N1CCC2(CC1)C[N@@H+](Cc1ccc(C)cc1)CCO2 ZINC001164939909 721924261 /nfs/dbraw/zinc/92/42/61/721924261.db2.gz PLFAETSHJNWYNQ-UHFFFAOYSA-N 1 1 444.963 3.025 20 0 IGADMO Cc1noc(C)c1CN1CCO[C@@H]2CN(c3nc(Cl)ccc3C[NH+]3CCCC3)C[C@H]21 ZINC001164940283 721948606 /nfs/dbraw/zinc/94/86/06/721948606.db2.gz AVQQKFOMEAORBH-WOJBJXKFSA-N 1 1 431.968 3.025 20 0 IGADMO O=C(c1cccnc1N1CC[NH+](CCOc2ccccc2)CC1)N1CCc2ccccc21 ZINC000505770972 721959515 /nfs/dbraw/zinc/95/95/15/721959515.db2.gz FBOXHPHYAIACPF-UHFFFAOYSA-N 1 1 428.536 3.486 20 0 IGADMO CC(=O)N1CC[C@@]2(c3ccccc3)CCN(c3cc(OC4CC[NH+](C)CC4)ccn3)C[C@H]12 ZINC001164947132 721967948 /nfs/dbraw/zinc/96/79/48/721967948.db2.gz PQFUPJKKANZAGI-AZGAKELHSA-N 1 1 434.584 3.324 20 0 IGADMO CN(C)c1nc(-c2ccccc2)nc(N2CCC3(CC[N@@H+](Cc4cccnc4)C3)CC2)n1 ZINC001164956217 722019341 /nfs/dbraw/zinc/01/93/41/722019341.db2.gz YTPOGORLEZEPAE-UHFFFAOYSA-N 1 1 429.572 3.492 20 0 IGADMO CCOC(=O)c1cc(Cl)nc(N2CCC3(CC2)COCC[N@@H+](Cc2ccncc2)C3)c1 ZINC001164959731 722051822 /nfs/dbraw/zinc/05/18/22/722051822.db2.gz NLEKJPCUMLKLJQ-UHFFFAOYSA-N 1 1 444.963 3.426 20 0 IGADMO CCOCc1cnc(Cl)nc1N1CCC2(CC1)COCC[N@@H+](Cc1ccncc1)C2 ZINC001164962221 722058972 /nfs/dbraw/zinc/05/89/72/722058972.db2.gz QKGJQEGHRQCYRE-UHFFFAOYSA-N 1 1 431.968 3.181 20 0 IGADMO c1cc(C[N@H+]2CCOCC3(CCN(c4cncc(N5CCCCCC5)n4)CC3)C2)ccn1 ZINC001164959980 722060910 /nfs/dbraw/zinc/06/09/10/722060910.db2.gz BJGHPRWCNFRNBB-UHFFFAOYSA-N 1 1 436.604 3.371 20 0 IGADMO CCOC(=O)c1c(C)cc(Cl)nc1N1CC[C@@H]2C[N@@H+](Cc3cccnc3)CCO[C@H]2C1 ZINC001164971386 722109728 /nfs/dbraw/zinc/10/97/28/722109728.db2.gz BVJNXPHAVUOVEJ-MOPGFXCFSA-N 1 1 444.963 3.342 20 0 IGADMO COc1cccc2c1nc(Cl)nc2N1CC[C@H]2C[N@@H+](Cc3cccnc3)CCO[C@@H]2C1 ZINC001164972530 722116568 /nfs/dbraw/zinc/11/65/68/722116568.db2.gz FYCXZNWDCOWFQO-FXAWDEMLSA-N 1 1 439.947 3.414 20 0 IGADMO FC(F)(c1cc(Cl)nc(=S)[nH]1)N1CC[C@@H]2C[N@@H+](Cc3cccnc3)CCO[C@H]2C1 ZINC001164982015 722135013 /nfs/dbraw/zinc/13/50/13/722135013.db2.gz QROAWYYNYMTUFP-CABCVRRESA-N 1 1 441.935 3.086 20 0 IGADMO COc1cc2cnc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)cc2cc1OC ZINC001164983277 722146077 /nfs/dbraw/zinc/14/60/77/722146077.db2.gz SXSGLYYWXCSRGD-CYFREDJKSA-N 1 1 434.540 3.374 20 0 IGADMO Cc1nc(-c2ccccn2)nc(N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)c1C ZINC001164978051 722148863 /nfs/dbraw/zinc/14/88/63/722148863.db2.gz JKDPXASXFDJEQS-JTHBVZDNSA-N 1 1 430.556 3.278 20 0 IGADMO C[NH+]1CCN(c2ncnc3c2CCN(C(F)(F)c2cc(Cl)nc(Cl)c2)CC3)CC1 ZINC001164996509 722229676 /nfs/dbraw/zinc/22/96/76/722229676.db2.gz IQSSHPVTPXFEKO-UHFFFAOYSA-N 1 1 443.329 3.080 20 0 IGADMO CCCCOc1cnc(N2CCc3ncnc(N4CC[NH+](C)CC4)c3CC2)c(Cl)c1 ZINC001165001480 722236415 /nfs/dbraw/zinc/23/64/15/722236415.db2.gz GMWUZQAFKZSDHS-UHFFFAOYSA-N 1 1 430.984 3.061 20 0 IGADMO c1nc2c(nc(N3CCC[C@@H]4C[N@H+](Cc5ccccc5)C[C@@H]43)nc2N2CCOCC2)s1 ZINC001164627946 719069136 /nfs/dbraw/zinc/06/91/36/719069136.db2.gz RMUIDPVIJCJYEF-MOPGFXCFSA-N 1 1 436.585 3.024 20 0 IGADMO c1ccc(C[N@H+]2C[C@H]3CCCN(c4nc(N5CCCC5)nc(N5CCCC5)n4)[C@@H]3C2)cc1 ZINC001164621867 719096453 /nfs/dbraw/zinc/09/64/53/719096453.db2.gz BIWYZKFHAUSSSX-FGZHOGPDSA-N 1 1 433.604 3.173 20 0 IGADMO O=C(c1cnc(N2CCC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)c(Cl)c1)N1CCOCC1 ZINC001164629588 719099338 /nfs/dbraw/zinc/09/93/38/719099338.db2.gz STZUSANDUXOYBE-DENIHFKCSA-N 1 1 440.975 3.308 20 0 IGADMO O=S(=O)(c1cccnc1N1CCC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]21)N1CCCCC1 ZINC001164628113 719103204 /nfs/dbraw/zinc/10/32/04/719103204.db2.gz MCFWMJVSEIZAET-FGZHOGPDSA-N 1 1 440.613 3.357 20 0 IGADMO Cc1noc([C@@H]2C[C@@H]3CCN(c4ncnc5c4CC[N@H+](Cc4ccccc4)C5)C[C@@H]3O2)n1 ZINC001164647133 719298889 /nfs/dbraw/zinc/29/88/89/719298889.db2.gz CLLPDZCRQJULJO-NYVOZVTQSA-N 1 1 432.528 3.083 20 0 IGADMO Cc1noc([C@@H]2C[C@@H]3CCN(c4ncnc5c4CC[N@@H+](Cc4ccccc4)C5)C[C@@H]3O2)n1 ZINC001164647133 719298893 /nfs/dbraw/zinc/29/88/93/719298893.db2.gz CLLPDZCRQJULJO-NYVOZVTQSA-N 1 1 432.528 3.083 20 0 IGADMO CC(C)C[NH+]1CCN(c2cc(NS(=O)(=O)c3ccc(Cl)nc3)ccc2F)CC1 ZINC001164657425 719338633 /nfs/dbraw/zinc/33/86/33/719338633.db2.gz LICAJZNNWSWRNU-UHFFFAOYSA-N 1 1 426.945 3.453 20 0 IGADMO Cc1nc(N2CCCC2)cc(N2CCC3(CC2)COCCN3Cc2ccc(F)cc2)[nH+]1 ZINC001164673018 719496727 /nfs/dbraw/zinc/49/67/27/719496727.db2.gz MJVOMRYHGCULMC-UHFFFAOYSA-N 1 1 425.552 3.396 20 0 IGADMO COC(=O)[C@@]1(C)C[C@@H]([NH+]2CCOCC2)CCN1c1ncc(OC)c2ccc(Cl)cc21 ZINC001164701367 719854445 /nfs/dbraw/zinc/85/44/45/719854445.db2.gz KIKWUCJFCMQGQG-KSFYIVLOSA-N 1 1 433.936 3.130 20 0 IGADMO COC(=O)[C@@]1(C)C[C@H]([NH+]2CCOCC2)CCN1c1nc(Cl)ncc1-c1ccccc1 ZINC001164705615 719855631 /nfs/dbraw/zinc/85/56/31/719855631.db2.gz UUQGDXBOUDXTCZ-VGOFRKELSA-N 1 1 430.936 3.030 20 0 IGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(C(F)(F)c1cnc(Cl)cc1C(=O)OC)C2 ZINC001164810075 720103010 /nfs/dbraw/zinc/10/30/10/720103010.db2.gz JPHKCOHQMKMWAC-MGPUTAFESA-N 1 1 443.922 3.251 20 0 IGADMO COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1nc(Cl)nc3nc(C)[nH]c31)CC2 ZINC001164719464 720109679 /nfs/dbraw/zinc/10/96/79/720109679.db2.gz XJTVXGFCJANAEC-KRWDZBQOSA-N 1 1 441.967 3.217 20 0 IGADMO COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1ccc(Cl)c(C(=O)OC)n1)CC2 ZINC001164719675 720116375 /nfs/dbraw/zinc/11/63/75/720116375.db2.gz ZWXIXUKCQVNWRA-GOSISDBHSA-N 1 1 444.963 3.424 20 0 IGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1nc(Cl)ccc1C(=O)NC(C)(C)C)C2 ZINC001164814439 720127393 /nfs/dbraw/zinc/12/73/93/720127393.db2.gz SOALMGHIBGVTDO-SBUREZEXSA-N 1 1 435.012 3.448 20 0 IGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(C(F)(F)c1cc(C(=O)OC)cc(Cl)n1)C2 ZINC001164810450 720127794 /nfs/dbraw/zinc/12/77/94/720127794.db2.gz JWIBJRCKIAUNIR-JXFKEZNVSA-N 1 1 443.922 3.251 20 0 IGADMO CCCNC(=O)c1cccnc1N1CCC2(C[C@@H](COC)[N@@H+](Cc3ccccn3)C2)CC1 ZINC001164713079 720141205 /nfs/dbraw/zinc/14/12/05/720141205.db2.gz QFOWNAQYRFEGCZ-NRFANRHFSA-N 1 1 437.588 3.124 20 0 IGADMO CCOC(=O)c1cc2ncnc(N3CC[C@@]4(C3)C[N@@H+](CC3CC3)C[C@@H]4COC)c2s1 ZINC001164810487 720143936 /nfs/dbraw/zinc/14/39/36/720143936.db2.gz JXEMKJYXBULKEY-ZHRRBRCNSA-N 1 1 430.574 3.053 20 0 IGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1ccc(C(=O)N3CCC(C)CC3)cn1)C2 ZINC001164819553 720166363 /nfs/dbraw/zinc/16/63/63/720166363.db2.gz XSZBMYFEABWQPS-WIOPSUGQSA-N 1 1 426.605 3.138 20 0 IGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1ccc(-c3ccc(OC)cc3OC)nn1)C2 ZINC001164817378 720181882 /nfs/dbraw/zinc/18/18/82/720181882.db2.gz PDWRPKORYSMPPU-DFBJGRDBSA-N 1 1 438.572 3.346 20 0 IGADMO Cc1nc2cc(Cl)ccc2c(N2CCCn3c(=O)cc(C[N@H+](C)C(C)C)nc3C2)n1 ZINC001164814738 720224004 /nfs/dbraw/zinc/22/40/04/720224004.db2.gz XKFZYEIRKXCDRN-UHFFFAOYSA-N 1 1 426.952 3.399 20 0 IGADMO CNC(=O)C[N@@H+]1CCOC[C@]2(CCCN(c3cc(-c4ccccc4)cc(Cl)n3)C2)C1 ZINC001164720642 720245772 /nfs/dbraw/zinc/24/57/72/720245772.db2.gz ZJEPKKQWEPKMMI-HSZRJFAPSA-N 1 1 428.964 3.067 20 0 IGADMO CNC(=O)C[N@H+]1CCOC[C@]2(CCCN(c3cc(-c4ccccc4)cc(Cl)n3)C2)C1 ZINC001164720642 720245779 /nfs/dbraw/zinc/24/57/79/720245779.db2.gz ZJEPKKQWEPKMMI-HSZRJFAPSA-N 1 1 428.964 3.067 20 0 IGADMO CC(C)[N@@H+](C)Cc1cc(=O)n2c(n1)CN(c1ncnc3[nH]c4cc(F)ccc4c31)CCC2 ZINC001164816905 720247370 /nfs/dbraw/zinc/24/73/70/720247370.db2.gz NWSIISFJIALAQF-UHFFFAOYSA-N 1 1 435.507 3.057 20 0 IGADMO O=C1N(CC2CC2)CC[C@@]12CCCN(c1ncnc3c1CC[N@H+](Cc1ccccc1)C3)C2 ZINC001164818805 720278987 /nfs/dbraw/zinc/27/89/87/720278987.db2.gz NEQXAWLIMPXCCU-AREMUKBSSA-N 1 1 431.584 3.264 20 0 IGADMO O=C1N(CC2CC2)CC[C@@]12CCCN(c1ncnc3c1CC[N@@H+](Cc1ccccc1)C3)C2 ZINC001164818805 720278994 /nfs/dbraw/zinc/27/89/94/720278994.db2.gz NEQXAWLIMPXCCU-AREMUKBSSA-N 1 1 431.584 3.264 20 0 IGADMO Clc1nc2c(ncn2[C@@H]2CCCCO2)c(N2CC[C@@H]3[C@H]2CC[N@H+]3Cc2cccnc2)n1 ZINC001164721658 720380201 /nfs/dbraw/zinc/38/02/01/720380201.db2.gz AIGLEGLJFDEPIA-KURKYZTESA-N 1 1 439.951 3.427 20 0 IGADMO CCOC(=O)c1c(Cl)nc(SC)nc1N1CC[C@H]2[C@@H]1CC[N@H+]2Cc1cccnc1 ZINC001164723077 720382072 /nfs/dbraw/zinc/38/20/72/720382072.db2.gz GADLNRDQOYGAFF-GJZGRUSLSA-N 1 1 433.965 3.277 20 0 IGADMO c1cncc(C[N@H+]2CC[C@H]3[C@H]2CCN3c2ccc(-c3ccc(N4CCOCC4)cc3)nn2)c1 ZINC001164723075 720466571 /nfs/dbraw/zinc/46/65/71/720466571.db2.gz BTWCYJWQWVPZAL-RPBOFIJWSA-N 1 1 442.567 3.228 20 0 IGADMO CCOC(=O)c1ccc2ncnc(N3CC[C@@H]4[C@H](C[C@@H](Cn5cccn5)[N@H+]4C(C)C)C3)c2c1 ZINC001164834970 720545194 /nfs/dbraw/zinc/54/51/94/720545194.db2.gz GCYVRHCGWVUZEQ-ZRCGQRJVSA-N 1 1 448.571 3.381 20 0 IGADMO COc1nc(-c2ccccc2)nc(N2CC[C@@H]3[C@H](C[C@@H](Cn4cccn4)[N@H+]3C(C)C)C2)n1 ZINC001164838607 720561516 /nfs/dbraw/zinc/56/15/16/720561516.db2.gz OSXLIQNHOISZCZ-QHAWAJNXSA-N 1 1 433.560 3.122 20 0 IGADMO COc1nc(-c2ccccc2)nc(N2CC[C@@H]3[C@@H](C[C@H](Cn4cccn4)[N@H+]3C(C)C)C2)n1 ZINC001164838606 720562486 /nfs/dbraw/zinc/56/24/86/720562486.db2.gz OSXLIQNHOISZCZ-PWRODBHTSA-N 1 1 433.560 3.122 20 0 IGADMO Cc1cc(NC(=O)c2cccnc2N2CC[C@@H]3[C@H](C[C@@H](Cn4cccn4)[N@@H+]3C(C)C)C2)no1 ZINC001164842741 720598345 /nfs/dbraw/zinc/59/83/45/720598345.db2.gz VIGRQBIJBIOLOP-SVFBPWRDSA-N 1 1 449.559 3.205 20 0 IGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@@H]2CN(C(F)(F)COc3cncc(Cl)n3)CC[C@@H]21 ZINC001164844164 720612676 /nfs/dbraw/zinc/61/26/76/720612676.db2.gz ZNSYKAIUXXPPHV-IKGGRYGDSA-N 1 1 440.926 3.172 20 0 IGADMO c1sc2ncnc(N3CC[N@@H+]4C[C@@H](Oc5cncnc5)C[C@@H]4C3)c2c1-c1ccccc1 ZINC001164744399 720657364 /nfs/dbraw/zinc/65/73/64/720657364.db2.gz ZTPVKGDOOIEJDO-MSOLQXFVSA-N 1 1 430.537 3.490 20 0 IGADMO COC(=O)c1ccc(N2CCC3(C[C@@H]([N@@H+](C)Cc4ccccc4)CO3)CC2)nc1OC ZINC001164842625 720668899 /nfs/dbraw/zinc/66/88/99/720668899.db2.gz SRLFOYXCASTQRL-LJQANCHMSA-N 1 1 425.529 3.137 20 0 IGADMO COC(=O)c1ccc(N2CCC3(C[C@H]([N@@H+](C)Cc4ccccc4)CO3)CC2)nc1OC ZINC001164842622 720669220 /nfs/dbraw/zinc/66/92/20/720669220.db2.gz SRLFOYXCASTQRL-IBGZPJMESA-N 1 1 425.529 3.137 20 0 IGADMO COC(=O)c1cc(OC)cnc1N1CCC2(C[C@H]([N@@H+](C)Cc3ccccc3)CO2)CC1 ZINC001164844843 720678982 /nfs/dbraw/zinc/67/89/82/720678982.db2.gz VMWHAPBJPJVCGG-IBGZPJMESA-N 1 1 425.529 3.137 20 0 IGADMO COC(=O)c1nc(Cl)cnc1N1CCC2(C[C@@H]([N@@H+](C)Cc3ccccc3)CO2)CC1 ZINC001164843800 720693045 /nfs/dbraw/zinc/69/30/45/720693045.db2.gz QYGSOJXLCNAPEA-QGZVFWFLSA-N 1 1 430.936 3.177 20 0 IGADMO COCCn1ccc2c1ncnc2N1CCC2(C[C@H]([N@@H+](C)Cc3ccccc3)CO2)CC1 ZINC001164841061 720694277 /nfs/dbraw/zinc/69/42/77/720694277.db2.gz HIZKVBIAYVJQCC-NRFANRHFSA-N 1 1 435.572 3.338 20 0 IGADMO CN1CCc2nc(Cl)nc(N3CCC4(C[C@H]([N@@H+](C)Cc5ccccc5)CO4)CC3)c2C1 ZINC001164836487 720726233 /nfs/dbraw/zinc/72/62/33/720726233.db2.gz BJTPTQJKNSMPEN-IBGZPJMESA-N 1 1 442.007 3.378 20 0 IGADMO CSc1ccc(Oc2cc(N3CC[N@H+]4C[C@H](Oc5cncnc5)C[C@@H]4C3)ncn2)cc1 ZINC001164739936 720743282 /nfs/dbraw/zinc/74/32/82/720743282.db2.gz JYSCNELEJSTIRX-SJLPKXTDSA-N 1 1 436.541 3.123 20 0 IGADMO c1ccc(Cc2nnc(N3CC[N@H+]4C[C@H](Oc5cncnc5)C[C@H]4C3)c3ccccc23)cc1 ZINC001164742863 720753888 /nfs/dbraw/zinc/75/38/88/720753888.db2.gz OQSAQDWPZOIRPV-LEWJYISDSA-N 1 1 438.535 3.353 20 0 IGADMO c1ccc(Cc2nnc(N3CC[N@H+]4C[C@H](Oc5cncnc5)C[C@@H]4C3)c3ccccc23)cc1 ZINC001164742865 720754907 /nfs/dbraw/zinc/75/49/07/720754907.db2.gz OQSAQDWPZOIRPV-NHCUHLMSSA-N 1 1 438.535 3.353 20 0 IGADMO FC(F)(c1cc(-c2ccco2)nnc1Cl)N1CC[N@@H+]2C[C@@H](Oc3cncnc3)C[C@H]2C1 ZINC001164741133 720768723 /nfs/dbraw/zinc/76/87/23/720768723.db2.gz MJBOBIXBWAIXPE-KBPBESRZSA-N 1 1 448.861 3.067 20 0 IGADMO FC(F)(c1cc(-c2ccco2)nnc1Cl)N1CC[N@H+]2C[C@@H](Oc3cncnc3)C[C@H]2C1 ZINC001164741133 720768729 /nfs/dbraw/zinc/76/87/29/720768729.db2.gz MJBOBIXBWAIXPE-KBPBESRZSA-N 1 1 448.861 3.067 20 0 IGADMO Fc1cccc(Oc2nc(Cl)ncc2N2CC[N@H+]3C[C@H](Oc4cncnc4)C[C@H]3C2)c1 ZINC001164751274 720803189 /nfs/dbraw/zinc/80/31/89/720803189.db2.gz XTTDHZUIKHDWCP-DOTOQJQBSA-N 1 1 442.882 3.193 20 0 IGADMO Cc1cccc(CN2CC[C@]3(CCN(c4cc(OC5CC[NH+](C)CC5)ccn4)C3)C2=O)c1 ZINC001164852397 720808673 /nfs/dbraw/zinc/80/86/73/720808673.db2.gz NLNMPBOZIHLJPI-AREMUKBSSA-N 1 1 434.584 3.492 20 0 IGADMO c1ncn(C[C@@H]2C[C@@H]3CN(c4cc(Oc5ccccc5)ncn4)CC[C@H]3[N@H+]2CC2CC2)n1 ZINC001164741305 720816721 /nfs/dbraw/zinc/81/67/21/720816721.db2.gz NJZKLTPKYAVKNJ-RZUBCFFCSA-N 1 1 431.544 3.240 20 0 IGADMO Fc1ccc(-c2ccnc(N3CC[C@@H]4[C@@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)n2)cc1 ZINC001164742677 720826260 /nfs/dbraw/zinc/82/62/60/720826260.db2.gz QKWRQZXFVNRMPG-XKCSPQBFSA-N 1 1 433.535 3.254 20 0 IGADMO CSc1nc2c(c(N3CC[C@@H]4[C@@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)n1)CCCC2 ZINC001164739236 720826380 /nfs/dbraw/zinc/82/63/80/720826380.db2.gz HWEFMBUKKYVZGF-BBTUJRGHSA-N 1 1 439.633 3.048 20 0 IGADMO COCC[N@H+]1CCO[C@@H]2CN(C(F)(F)c3ccc4c(Cl)ncnc4c3)CC[C@@H]2C1 ZINC001164857081 720840036 /nfs/dbraw/zinc/84/00/36/720840036.db2.gz XFCGGHHUSMBXHF-RDTXWAMCSA-N 1 1 426.895 3.002 20 0 IGADMO Fc1cccc(Oc2ccnc(N3CC[C@@H]4[C@@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)n2)c1 ZINC001164747478 720841567 /nfs/dbraw/zinc/84/15/67/720841567.db2.gz QQWVTJPNIUJRTN-RCZSKKKRSA-N 1 1 449.534 3.379 20 0 IGADMO COCC[N@H+]1CCO[C@@H]2CN(C(F)(F)c3ccc4ncc(Cl)nc4c3)CC[C@@H]2C1 ZINC001164849648 720842087 /nfs/dbraw/zinc/84/20/87/720842087.db2.gz CENNBMYQEUIQPI-RDTXWAMCSA-N 1 1 426.895 3.002 20 0 IGADMO Cc1cc(N2CC[C@@H]3[C@H](C[C@@H](Cn4cncn4)[N@H+]3CC3CC3)C2)nc(-c2ccsc2)n1 ZINC001164743928 720851484 /nfs/dbraw/zinc/85/14/84/720851484.db2.gz BAGAISFFCFJHJV-QHAWAJNXSA-N 1 1 435.601 3.484 20 0 IGADMO Fc1ccccc1-c1ccc(N2CC[C@@H]3[C@H](C[C@@H](Cn4cncn4)[N@H+]3CC3CC3)C2)nn1 ZINC001164752671 720852261 /nfs/dbraw/zinc/85/22/61/720852261.db2.gz UEGMMYHALFWWDG-SELNLUPBSA-N 1 1 433.535 3.254 20 0 IGADMO Cc1nc(-c2ccncc2)nc(N2CC[C@@H]3[C@H](C[C@H](Cn4cncn4)[N@H+]3CC3CC3)C2)c1C ZINC001164745527 720853062 /nfs/dbraw/zinc/85/30/62/720853062.db2.gz DXDOJETWNPHVQX-DNVJHFABSA-N 1 1 444.587 3.126 20 0 IGADMO Fc1cnc(N2CC[C@@H]3[C@H](C[C@@H](Cn4cncn4)[N@H+]3CC3CC3)C2)nc1-c1ccsc1 ZINC001164753601 720858429 /nfs/dbraw/zinc/85/84/29/720858429.db2.gz YOZAGVRUJKVXFE-WSTZPKSXSA-N 1 1 439.564 3.315 20 0 IGADMO CCc1nc(Cl)nc(Cl)c1N1CC[C@@H]2[C@H](C[C@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164745475 720858512 /nfs/dbraw/zinc/85/85/12/720858512.db2.gz DSUBWGSGUUOZPV-BFYDXBDKSA-N 1 1 436.391 3.317 20 0 IGADMO Cc1c[nH]c2ncnc(N3CC[C@@]4(C3)C[N@@H+](CC3CC3)C[C@@H]4COCc3cccnc3)c12 ZINC001164753427 720868142 /nfs/dbraw/zinc/86/81/42/720868142.db2.gz PMUOJZHWFVZNOO-BWKNWUBXSA-N 1 1 432.572 3.416 20 0 IGADMO CSc1nccc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COCc2cccnc2)n1 ZINC001164749721 720870958 /nfs/dbraw/zinc/87/09/58/720870958.db2.gz HUZGHMBLHBNIIP-NZQKXSOJSA-N 1 1 425.602 3.349 20 0 IGADMO COC(=O)c1cccnc1N1CC[C@]2(C1)C[N@@H+](CC1CC1)C[C@@H]2COCc1cccnc1 ZINC001164754814 720877006 /nfs/dbraw/zinc/87/70/06/720877006.db2.gz SPERJGGXXDJWGW-PXDATVDWSA-N 1 1 436.556 3.018 20 0 IGADMO COC(=O)c1cccnc1N1CC[C@@]2(C1)C[N@@H+](CC1CC1)C[C@@H]2COCc1cccnc1 ZINC001164754812 720877234 /nfs/dbraw/zinc/87/72/34/720877234.db2.gz SPERJGGXXDJWGW-BWKNWUBXSA-N 1 1 436.556 3.018 20 0 IGADMO Cn1cnc2c1ccnc2N1CC[C@]2(C1)C[N@@H+](CC1CC1)C[C@@H]2COCc1cccnc1 ZINC001164752441 720877264 /nfs/dbraw/zinc/87/72/64/720877264.db2.gz NAFZGNSUEITDMN-PXDATVDWSA-N 1 1 432.572 3.118 20 0 IGADMO COCC[N@H+]1CCO[C@@H]2CN(c3cnc(Cl)nc3Oc3ccc(F)cc3)CC[C@@H]2C1 ZINC001164864246 720877997 /nfs/dbraw/zinc/87/79/97/720877997.db2.gz VFQYKGDKMNYEKM-DNVCBOLYSA-N 1 1 436.915 3.235 20 0 IGADMO COCC[N@H+]1CCO[C@@H]2CN(C(F)(F)c3cccc4c(Cl)ncnc43)CC[C@@H]2C1 ZINC001164864273 720879347 /nfs/dbraw/zinc/87/93/47/720879347.db2.gz VHNXSEUZWCCCIK-RHSMWYFYSA-N 1 1 426.895 3.002 20 0 IGADMO Fc1cc2c(cn1)ncnc2N1CC[C@@]2(C1)C[N@@H+](CC1CC1)C[C@H]2COCc1cccnc1 ZINC001164752182 720881467 /nfs/dbraw/zinc/88/14/67/720881467.db2.gz LYZAMSAJIYDMHK-CPJSRVTESA-N 1 1 448.546 3.314 20 0 IGADMO COc1cnnc(Cl)c1N1CC[C@]2(C1)C[N@@H+](CC1CC1)C[C@@H]2COCc1cccnc1 ZINC001164757119 720888469 /nfs/dbraw/zinc/88/84/69/720888469.db2.gz SQDGKEGGOGBPQX-AUSIDOKSSA-N 1 1 443.979 3.289 20 0 IGADMO COCC[N@H+]1CCO[C@H]2CN(c3cnc(Cl)nc3Oc3ccc(OC)cc3)CC[C@H]2C1 ZINC001164864815 720889543 /nfs/dbraw/zinc/88/95/43/720889543.db2.gz XLHSRCQGJUKGAM-JXFKEZNVSA-N 1 1 448.951 3.104 20 0 IGADMO Nc1cnc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COCc2cccnc2)c(Cl)c1 ZINC001164758492 720891214 /nfs/dbraw/zinc/89/12/14/720891214.db2.gz YOXBTPZHJRUZLC-CVDCTZTESA-N 1 1 427.980 3.467 20 0 IGADMO Cc1cc2ncnc(N3CC[C@@]4(C3)C[N@@H+](CC3CC3)C[C@H]4COCc3cccnc3)c2[nH]1 ZINC001164752524 720895020 /nfs/dbraw/zinc/89/50/20/720895020.db2.gz DWXMSMYUTQWUSC-OFVILXPXSA-N 1 1 432.572 3.416 20 0 IGADMO FC(F)Oc1cnc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COCc2cccnc2)nc1 ZINC001164754506 720896376 /nfs/dbraw/zinc/89/63/76/720896376.db2.gz JCOPTCNFTKFMAQ-WMZHIEFXSA-N 1 1 445.514 3.228 20 0 IGADMO Cc1cnc2c(ccnc2N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COCc2cccnc2)n1 ZINC001164755031 720924403 /nfs/dbraw/zinc/92/44/03/720924403.db2.gz XWCCTLRSZLZNBC-ATIYNZHBSA-N 1 1 444.583 3.483 20 0 IGADMO COc1ncc(Cl)c(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COCc2cccnc2)n1 ZINC001164746498 720928505 /nfs/dbraw/zinc/92/85/05/720928505.db2.gz BAMSKLBUQXPHIA-CVDCTZTESA-N 1 1 443.979 3.289 20 0 IGADMO CN1C[C@H](COCC2CC2)[C@@H]2CCN(c3ccc(C[N@@H+](C)C4CC4)cn3)CC[C@H]2C1=O ZINC001164860343 721029887 /nfs/dbraw/zinc/02/98/87/721029887.db2.gz LKZSCWVRRMZCFR-AKIFATBCSA-N 1 1 426.605 3.023 20 0 IGADMO FC(F)(c1ccc2ncnc(Cl)c2c1)N1CCc2[nH+]cc(Cn3cccn3)n2CC1 ZINC001164861360 721032237 /nfs/dbraw/zinc/03/22/37/721032237.db2.gz HCNRDCTVGWYVOE-UHFFFAOYSA-N 1 1 429.862 3.332 20 0 IGADMO CC(C)(C)c1noc(-c2ccnc(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@@H]4C3)c2)n1 ZINC001164872059 721127577 /nfs/dbraw/zinc/12/75/77/721127577.db2.gz GEVUNCGEFFUETA-WOJBJXKFSA-N 1 1 434.544 3.304 20 0 IGADMO FC(F)(c1nc2ccc(Cl)nc2[nH]1)N1CC[N@H+]2C[C@H](OCc3cccnc3)C[C@@H]2C1 ZINC001164878424 721156458 /nfs/dbraw/zinc/15/64/58/721156458.db2.gz QCJYFTSZIXNVGW-HUUCEWRRSA-N 1 1 434.878 3.031 20 0 IGADMO O=C(OCc1ccccc1)c1ccc(N2CC[N@H+]3C[C@@H](OCc4cccnc4)C[C@@H]3C2)nc1 ZINC001164871103 721157738 /nfs/dbraw/zinc/15/77/38/721157738.db2.gz DRFMRZANGYRYOT-RPWUZVMVSA-N 1 1 444.535 3.313 20 0 IGADMO COc1ccc(OC)c(-c2ccc(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@H]4C3)nn2)c1 ZINC001164880371 721165242 /nfs/dbraw/zinc/16/52/42/721165242.db2.gz WAKRWJQOCWOBTE-PZJWPPBQSA-N 1 1 447.539 3.036 20 0 IGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4nc(Cl)nc(Oc5cccc(F)c5)n4)C[C@@H]3C2)cn1 ZINC001164762098 721165896 /nfs/dbraw/zinc/16/58/96/721165896.db2.gz BXKQILDPTGODJA-CVEARBPZSA-N 1 1 443.914 3.148 20 0 IGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4nc(-c5ccccn5)nc5ccccc54)C[C@H]3C2)cn1 ZINC001164771849 721196814 /nfs/dbraw/zinc/19/68/14/721196814.db2.gz RGZRSQIOSGVLDC-WOJBJXKFSA-N 1 1 425.540 3.384 20 0 IGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4ncnc5c(-c6ccccc6)nsc54)C[C@H]3C2)cn1 ZINC001164772385 721203273 /nfs/dbraw/zinc/20/32/73/721203273.db2.gz UKDSCWVFVFXUQR-RTBURBONSA-N 1 1 431.569 3.445 20 0 IGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4ncc(C(=O)OC(C)(C)C)cc4Cl)C[C@@H]3C2)cn1 ZINC001164769737 721233202 /nfs/dbraw/zinc/23/32/02/721233202.db2.gz ZLJYLFKDZIJWNC-WMZOPIPTSA-N 1 1 431.968 3.382 20 0 IGADMO O=S(=O)(c1ccccc1)N1C[C@H]2CN(c3nc(Cl)ccc3C[NH+]3CCCC3)C[C@@H]2C1 ZINC001164878277 721307902 /nfs/dbraw/zinc/30/79/02/721307902.db2.gz KPHPKNDIAIJFCU-RTBURBONSA-N 1 1 447.004 3.088 20 0 IGADMO Cc1nc(COC[C@H]2Cn3nccc3CN(c3ccc(C[N@H+](C)C4CC4)cn3)C2)cs1 ZINC001164876718 721332455 /nfs/dbraw/zinc/33/24/55/721332455.db2.gz PMHQPVDATGCYNI-LJQANCHMSA-N 1 1 438.601 3.490 20 0 IGADMO COC(=O)c1cc(Cl)cnc1N1CCC[C@]2(C1)COCC[N@H+](Cc1c(C)noc1C)C2 ZINC001164776007 721335781 /nfs/dbraw/zinc/33/57/81/721335781.db2.gz BQMFMQJCJWXZLU-QFIPXVFZSA-N 1 1 448.951 3.245 20 0 IGADMO COC(=O)c1cc(Cl)cnc1N1CCC[C@]2(C1)COCC[N@@H+](Cc1c(C)noc1C)C2 ZINC001164776007 721335786 /nfs/dbraw/zinc/33/57/86/721335786.db2.gz BQMFMQJCJWXZLU-QFIPXVFZSA-N 1 1 448.951 3.245 20 0 IGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@]2(CCCN(c3nc(Cl)nc4c3CCC4)C2)C1 ZINC001164776984 721336566 /nfs/dbraw/zinc/33/65/66/721336566.db2.gz JGKGEWPNRDXCPL-JOCHJYFZSA-N 1 1 431.968 3.343 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@]2(CCCN(c3nc(Cl)nc4c3CCC4)C2)C1 ZINC001164776984 721336567 /nfs/dbraw/zinc/33/65/67/721336567.db2.gz JGKGEWPNRDXCPL-JOCHJYFZSA-N 1 1 431.968 3.343 20 0 IGADMO COc1cccc2c1ncnc2N1CCC[C@@]2(C1)COCC[N@@H+](Cc1c(C)noc1C)C2 ZINC001164777845 721340592 /nfs/dbraw/zinc/34/05/92/721340592.db2.gz IUCQTKIGYJNZOY-XMMPIXPASA-N 1 1 437.544 3.362 20 0 IGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@@]2(CCCN(c3nc4ncccc4nc3Cl)C2)C1 ZINC001164776149 721349894 /nfs/dbraw/zinc/34/98/94/721349894.db2.gz AHGZUQXSEAZHTE-QFIPXVFZSA-N 1 1 442.951 3.402 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@@]2(CCCN(c3nc4ncccc4nc3Cl)C2)C1 ZINC001164776149 721349899 /nfs/dbraw/zinc/34/98/99/721349899.db2.gz AHGZUQXSEAZHTE-QFIPXVFZSA-N 1 1 442.951 3.402 20 0 IGADMO COC(=O)c1cc(F)c(C)nc1N1CCC[C@]2(C1)COCC[N@H+](Cc1c(C)noc1C)C2 ZINC001164778695 721350866 /nfs/dbraw/zinc/35/08/66/721350866.db2.gz NUIAVMBQCBYQKY-QHCPKHFHSA-N 1 1 446.523 3.040 20 0 IGADMO COC(=O)c1cc(F)c(C)nc1N1CCC[C@]2(C1)COCC[N@@H+](Cc1c(C)noc1C)C2 ZINC001164778695 721350870 /nfs/dbraw/zinc/35/08/70/721350870.db2.gz NUIAVMBQCBYQKY-QHCPKHFHSA-N 1 1 446.523 3.040 20 0 IGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@]2(CCCN(c3cc(N4CCCCC4)ncn3)C2)C1 ZINC001164786072 721365441 /nfs/dbraw/zinc/36/54/41/721365441.db2.gz VTRDRCCLFWJJOP-XMMPIXPASA-N 1 1 440.592 3.191 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@]2(CCCN(c3cc(N4CCCCC4)ncn3)C2)C1 ZINC001164786072 721365444 /nfs/dbraw/zinc/36/54/44/721365444.db2.gz VTRDRCCLFWJJOP-XMMPIXPASA-N 1 1 440.592 3.191 20 0 IGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@@]2(CCCN(c3cc(-c4ccncc4)ncn3)C2)C1 ZINC001164780076 721367698 /nfs/dbraw/zinc/36/76/98/721367698.db2.gz DAOZUHGCAAVVLH-DEOSSOPVSA-N 1 1 434.544 3.262 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@@]2(CCCN(c3cc(-c4ccncc4)ncn3)C2)C1 ZINC001164780076 721367702 /nfs/dbraw/zinc/36/77/02/721367702.db2.gz DAOZUHGCAAVVLH-DEOSSOPVSA-N 1 1 434.544 3.262 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@]2(CCCN(c3cc4c(nn3)CC[C@H](C)C4)C2)C1 ZINC001164785263 721371763 /nfs/dbraw/zinc/37/17/63/721371763.db2.gz SWFHLZFWWGEXAM-BXKMTCNYSA-N 1 1 425.577 3.325 20 0 IGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@]2(CCCN(c3cc4c(nn3)CC[C@H](C)C4)C2)C1 ZINC001164785263 721371768 /nfs/dbraw/zinc/37/17/68/721371768.db2.gz SWFHLZFWWGEXAM-BXKMTCNYSA-N 1 1 425.577 3.325 20 0 IGADMO C[NH+]1CCN(C[C@H]2CCC[C@]3(CCN(C(F)(F)c4ccnc(Cl)c4F)C3)O2)CC1 ZINC001164887304 721385383 /nfs/dbraw/zinc/38/53/83/721385383.db2.gz HOJPHGIPCSLOEE-DNVCBOLYSA-N 1 1 432.918 3.184 20 0 IGADMO CCOC(=O)c1sc2ncnc(N3C[C@@H]4C[N@@H+](Cc5nccs5)C[C@@H]4C3)c2c1C ZINC001164787805 721388690 /nfs/dbraw/zinc/38/86/90/721388690.db2.gz XNOWTJULHXLNSJ-OKILXGFUSA-N 1 1 429.571 3.201 20 0 IGADMO CCOC(=O)c1sc2ncnc(N3C[C@@H]4C[N@H+](Cc5nccs5)C[C@@H]4C3)c2c1C ZINC001164787805 721388692 /nfs/dbraw/zinc/38/86/92/721388692.db2.gz XNOWTJULHXLNSJ-OKILXGFUSA-N 1 1 429.571 3.201 20 0 IGADMO CCOC(=O)c1sc2ncnc(N3C[C@H]4C[NH+](Cc5nccs5)C[C@@H]4C3)c2c1C ZINC001164787809 721389723 /nfs/dbraw/zinc/38/97/23/721389723.db2.gz XNOWTJULHXLNSJ-ZIAGYGMSSA-N 1 1 429.571 3.201 20 0 IGADMO Cc1cccc2c1nc(Cl)nc2N1CC[C@]2(C1)CCC[C@H](CN1CC[NH+](C)CC1)O2 ZINC001164888346 721401342 /nfs/dbraw/zinc/40/13/42/721401342.db2.gz OKBYGDDENMHGBM-JPYJTQIMSA-N 1 1 429.996 3.357 20 0 IGADMO CSc1nc2ccccc2c(N2CC[C@@]3(C2)CCC[C@H](CN2CC[NH+](C)CC2)O3)n1 ZINC001164888999 721417498 /nfs/dbraw/zinc/41/74/98/721417498.db2.gz PZPQTCBVDYFHCO-WZONZLPQSA-N 1 1 427.618 3.117 20 0 IGADMO CC(C)CNC(=O)c1ccc2c(c1)ncnc2N1C[C@@H]2C[NH+](Cc3nccs3)C[C@H]2C1 ZINC001164786360 721420115 /nfs/dbraw/zinc/42/01/15/721420115.db2.gz OVKOFKMSLLCOJY-ROUUACIJSA-N 1 1 436.585 3.040 20 0 IGADMO CC(C)(C)OC(=O)Nc1cnc(N2C[C@@H]3C[NH+](Cc4nccs4)C[C@H]3C2)c2[nH]cnc21 ZINC001164784813 721423921 /nfs/dbraw/zinc/42/39/21/721423921.db2.gz MNFOJEHOQVGIFE-KBPBESRZSA-N 1 1 441.561 3.330 20 0 IGADMO C[NH+]1CCN(C[C@@H]2CCC[C@@]3(CCN(c4cc(F)cc5ncnc(Cl)c54)C3)O2)CC1 ZINC001164892364 721428430 /nfs/dbraw/zinc/42/84/30/721428430.db2.gz IGVOPBSYAMKHRQ-JTSKRJEESA-N 1 1 433.959 3.188 20 0 IGADMO C[NH+]1CCN(C[C@H]2CCC[C@@]3(CCN(c4c(Cl)nc(Cl)nc4C4CC4)C3)O2)CC1 ZINC001164886473 721450803 /nfs/dbraw/zinc/45/08/03/721450803.db2.gz GSCGXCHICQIDGV-IERDGZPVSA-N 1 1 440.419 3.426 20 0 IGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1nc(Cl)nc3nc(C)[nH]c31)CC2 ZINC001164788711 721455721 /nfs/dbraw/zinc/45/57/21/721455721.db2.gz SVFPJUZPHDBXGD-QGZVFWFLSA-N 1 1 448.999 3.049 20 0 IGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(C(F)(F)c1cnnc(Cl)c1)CC2 ZINC001164784113 721460062 /nfs/dbraw/zinc/46/00/62/721460062.db2.gz GWSJNHCOIXQBNK-SFHVURJKSA-N 1 1 444.954 3.409 20 0 IGADMO COc1cc2nc(C)nc(N3CC[N@H+]4C[C@@H](Oc5cccc(F)c5)C[C@H]4C3)c2cc1OC ZINC001164910338 721535326 /nfs/dbraw/zinc/53/53/26/721535326.db2.gz UJCVGGROCRGKCO-HKUYNNGSSA-N 1 1 438.503 3.436 20 0 IGADMO CN(C)c1nc(-c2ccccc2)nc(N2CC[N@H+]3C[C@@H](Oc4cccc(F)c4)C[C@H]3C2)n1 ZINC001164911170 721541514 /nfs/dbraw/zinc/54/15/14/721541514.db2.gz VPPRUKSVCWTMPF-FPOVZHCZSA-N 1 1 434.519 3.086 20 0 IGADMO CC(C)(C)C(=O)Nc1ccc(CO)nc1N1CC[N@H+]2C[C@@H](Oc3cccc(F)c3)C[C@@H]2C1 ZINC001164906371 721546744 /nfs/dbraw/zinc/54/67/44/721546744.db2.gz KFMIFALPYXHFNJ-QUCCMNQESA-N 1 1 442.535 3.040 20 0 IGADMO COc1nc(Cl)ncc1C(F)(F)N1CC[N@H+]2C[C@@H](Oc3cccc(F)c3)C[C@H]2C1 ZINC001164902675 721549236 /nfs/dbraw/zinc/54/92/36/721549236.db2.gz AWNSGBYMHMJIRZ-ZFWWWQNUSA-N 1 1 428.842 3.165 20 0 IGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(C(F)(F)COc2ccnc(Cl)c2)[C@H]2CCCO[C@H]12 ZINC001164802993 721551370 /nfs/dbraw/zinc/55/13/70/721551370.db2.gz HCHHOIXRIZRVKH-NSHGMRRFSA-N 1 1 438.906 3.465 20 0 IGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(C(F)(F)COc2ccnc(Cl)c2)[C@H]2CCCO[C@H]12 ZINC001164802993 721551373 /nfs/dbraw/zinc/55/13/73/721551373.db2.gz HCHHOIXRIZRVKH-NSHGMRRFSA-N 1 1 438.906 3.465 20 0 IGADMO C[C@@H]1CCCN(C(=O)c2ccc(N3CC[N@H+]4C[C@H](Oc5cccc(F)c5)C[C@H]4C3)nc2)C1 ZINC001164910310 721552607 /nfs/dbraw/zinc/55/26/07/721552607.db2.gz WGAUQBGVDGXOCR-RZFNWQHOSA-N 1 1 438.547 3.435 20 0 IGADMO CC1CCN(C(=O)c2ccc(N3CC[N@H+]4C[C@H](Oc5cccc(F)c5)C[C@@H]4C3)nc2)CC1 ZINC001164908574 721553487 /nfs/dbraw/zinc/55/34/87/721553487.db2.gz QMOUICJBLRZCLN-FYYLOGMGSA-N 1 1 438.547 3.435 20 0 IGADMO CCOC(=O)c1nc(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@H]32)ccc1Cl ZINC001164800254 721570299 /nfs/dbraw/zinc/57/02/99/721570299.db2.gz DLHHBEPJUWUWEV-LVCYWYKZSA-N 1 1 430.936 3.175 20 0 IGADMO COc1ccccc1-c1cc(N2C[C@H]([N@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@H]32)ncn1 ZINC001164809443 721581651 /nfs/dbraw/zinc/58/16/51/721581651.db2.gz SAOWCSXFKNTATL-OTNCWRBYSA-N 1 1 431.540 3.415 20 0 IGADMO COc1ccccc1-c1cc(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@H]32)ncn1 ZINC001164809443 721581655 /nfs/dbraw/zinc/58/16/55/721581655.db2.gz SAOWCSXFKNTATL-OTNCWRBYSA-N 1 1 431.540 3.415 20 0 IGADMO FC1(F)CCN(c2ccc(CN3CCOCC3)cn2)C[C@]12CC[N@@H+](Cc1ccccn1)C2 ZINC001164907906 721585755 /nfs/dbraw/zinc/58/57/55/721585755.db2.gz WHZZQZDSOIEMEC-HSZRJFAPSA-N 1 1 443.542 3.047 20 0 IGADMO Cn1c(=O)ccc2ccc(N3CCC(F)(F)[C@@]4(CC[N@@H+](Cc5ccccn5)C4)C3)nc21 ZINC001164907379 721706319 /nfs/dbraw/zinc/70/63/19/721706319.db2.gz RHVDDPJNXQUQSB-JOCHJYFZSA-N 1 1 425.483 3.066 20 0 IGADMO CCOC(=O)c1c(C)ncnc1N1CCC(F)(F)[C@]2(CC[N@@H+](Cc3ccccn3)C2)C1 ZINC001164908720 721707001 /nfs/dbraw/zinc/70/70/01/721707001.db2.gz YUMNJELYDSDTMU-NRFANRHFSA-N 1 1 431.487 3.094 20 0 IGADMO Cc1ccc2c(c1)nc(Cl)nc2N1CCO[C@]2(C1)COCC[N@H+](Cc1cccnc1)C2 ZINC001164915226 721783020 /nfs/dbraw/zinc/78/30/20/721783020.db2.gz KMQKTWYCPYTBJU-HSZRJFAPSA-N 1 1 439.947 3.094 20 0 IGADMO Cc1ccc2c(c1)nc(Cl)nc2N1CCO[C@]2(C1)COCC[N@@H+](Cc1cccnc1)C2 ZINC001164915226 721783024 /nfs/dbraw/zinc/78/30/24/721783024.db2.gz KMQKTWYCPYTBJU-HSZRJFAPSA-N 1 1 439.947 3.094 20 0 IGADMO O=C1[C@@H]2CN(c3ccc4c(n3)CC[N@H+](Cc3ccccc3)C4)C[C@@H]2CN1c1cccnc1 ZINC001165024870 721789989 /nfs/dbraw/zinc/78/99/89/721789989.db2.gz UDHSTBBRASRLDA-FYYLOGMGSA-N 1 1 425.536 3.134 20 0 IGADMO C[NH+]1CCC(Oc2ccnc(N3CCO[C@@H]4[C@@H](COCc5nccs5)CC[C@@H]43)c2)CC1 ZINC001164918640 721811511 /nfs/dbraw/zinc/81/15/11/721811511.db2.gz SKQLEPVJXVRSSB-DHJUGAMNSA-N 1 1 444.601 3.212 20 0 IGADMO CCOC(=O)Cc1c(Cl)ncnc1N1C[C@@H]2CCC[C@H]([N@@H+](C)Cc3ccccn3)[C@@H]2C1 ZINC001165022681 721813123 /nfs/dbraw/zinc/81/31/23/721813123.db2.gz GPYIUAHYDZFNNW-DBVUQKKJSA-N 1 1 443.979 3.368 20 0 IGADMO C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@@H]2CN(c3nc(Cl)ncc3N3CCOCC3)C[C@@H]21 ZINC001165028964 721813183 /nfs/dbraw/zinc/81/31/83/721813183.db2.gz YFDDFYAWPKLCGK-YZGWKJHDSA-N 1 1 442.995 3.099 20 0 IGADMO CCOC(=O)Cc1c(Cl)ncnc1N1C[C@@H]2CCC[C@@H]([N@@H+](C)Cc3ccccn3)[C@H]2C1 ZINC001165022683 721813264 /nfs/dbraw/zinc/81/32/64/721813264.db2.gz GPYIUAHYDZFNNW-FFZOFVMBSA-N 1 1 443.979 3.368 20 0 IGADMO CN1CCOc2c(Cl)nnc(N3C[C@@H]4CCC[C@@H]([N@@H+](C)Cc5ccccn5)[C@H]4C3)c21 ZINC001165030169 721821298 /nfs/dbraw/zinc/82/12/98/721821298.db2.gz YDJZPNLCIUBPEF-RYQLBKOJSA-N 1 1 428.968 3.091 20 0 IGADMO Cc1nc2c(nc(Cl)nc2N2C[C@@H]3CCC[C@H]([N@@H+](C)Cc4ccccn4)[C@H]3C2)n1C ZINC001165026026 721822629 /nfs/dbraw/zinc/82/26/29/721822629.db2.gz OBSGFTQWVBLHCY-SZMVWBNQSA-N 1 1 425.968 3.457 20 0 IGADMO CN1CCc2nc(Cl)nc(N3C[C@@H]4CCC[C@H]([N@@H+](C)Cc5ccccn5)[C@@H]4C3)c2C1 ZINC001165021323 721829965 /nfs/dbraw/zinc/82/99/65/721829965.db2.gz DYQUQKHAYPVNRV-CDXJDZJCSA-N 1 1 426.996 3.250 20 0 IGADMO CCNC(=O)c1cc(Cl)nc(N2C[C@@H]3CCC[C@@H]([N@@H+](C)Cc4ccccn4)[C@@H]3C2)n1 ZINC001165029030 721832081 /nfs/dbraw/zinc/83/20/81/721832081.db2.gz WLMFRNZXXYMFIS-KVSKMBFKSA-N 1 1 428.968 3.012 20 0 IGADMO CCC[N@H+]1CCCC[C@@H]1c1ccc(N2CC[C@@]3(C2)C[C@@H](NC(=O)N(C)C)CCO3)nc1 ZINC001164952735 722010811 /nfs/dbraw/zinc/01/08/11/722010811.db2.gz AYVOMEQFLLYTOT-IMSXRSKXSA-N 1 1 429.609 3.418 20 0 IGADMO CON(C)C(=O)c1cc(Cl)nc(N2CCC3(CC[N@@H+](Cc4cccnc4)C3)CC2)c1 ZINC001164952530 722018186 /nfs/dbraw/zinc/01/81/86/722018186.db2.gz MZNUCDBYQHTYLI-UHFFFAOYSA-N 1 1 429.952 3.256 20 0 IGADMO CC(C)(C)C(=O)Nc1ccc(CO)nc1N1CCC2(CC[N@@H+](Cc3cccnc3)C2)CC1 ZINC001164955464 722019718 /nfs/dbraw/zinc/01/97/18/722019718.db2.gz HTRPBLPBYOSFOS-UHFFFAOYSA-N 1 1 437.588 3.446 20 0 IGADMO COC(=O)c1c[nH]c2nc(Cl)nc(N3CCC4(CC[N@@H+](Cc5cccnc5)C4)CC3)c12 ZINC001164955918 722021472 /nfs/dbraw/zinc/02/14/72/722021472.db2.gz SPQSKHJHKWBCCS-UHFFFAOYSA-N 1 1 440.935 3.285 20 0 IGADMO CSc1cc(N2CCC3(CC2)COCC[N@@H+](Cc2ccncc2)C3)nc(SC)n1 ZINC001164966916 722062411 /nfs/dbraw/zinc/06/24/11/722062411.db2.gz ZABVULSTBRBYQO-UHFFFAOYSA-N 1 1 431.631 3.434 20 0 IGADMO Clc1cc(-c2ccncc2)c(N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)nn1 ZINC001164986052 722104195 /nfs/dbraw/zinc/10/41/95/722104195.db2.gz XVBHFCVJPBNTNM-PZJWPPBQSA-N 1 1 436.947 3.314 20 0 IGADMO c1ccc(COc2cncc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)n2)cc1 ZINC001164983923 722106305 /nfs/dbraw/zinc/10/63/05/722106305.db2.gz RCFRUVJMDXURQO-PKTZIBPZSA-N 1 1 431.540 3.178 20 0 IGADMO Cc1nc(C(F)(F)N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)nc(Cl)c1C ZINC001164981018 722127976 /nfs/dbraw/zinc/12/79/76/722127976.db2.gz SAZYRORUYQZEPN-QZTJIDSGSA-N 1 1 437.922 3.414 20 0 IGADMO COC(=O)c1cc2ccccc2nc1N1CC[C@H]2C[N@@H+](Cc3cccnc3)CCO[C@H]2C1 ZINC001164979569 722129694 /nfs/dbraw/zinc/12/96/94/722129694.db2.gz LFBSZILPCQVMNT-REWPJTCUSA-N 1 1 432.524 3.144 20 0 IGADMO c1ccc(COc2cnc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)cn2)cc1 ZINC001164984924 722133233 /nfs/dbraw/zinc/13/32/33/722133233.db2.gz YLFWGWCCMKDCJO-GOTSBHOMSA-N 1 1 431.540 3.178 20 0 IGADMO CN(C)c1ccc(-c2ccnc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)n2)cc1 ZINC001164978027 722134422 /nfs/dbraw/zinc/13/44/22/722134422.db2.gz JDUPJUAAZYHQRJ-RDGATRHJSA-N 1 1 444.583 3.332 20 0 IGADMO c1cncc(C[N@H+]2CCO[C@@H]3CN(c4nc(-c5cccnc5)nc5c4CCC5)CC[C@@H]3C2)c1 ZINC001164985503 722149517 /nfs/dbraw/zinc/14/95/17/722149517.db2.gz ZQZGBWZKPWXCFG-ZJSXRUAMSA-N 1 1 442.567 3.150 20 0 IGADMO c1nc2c(nc(N3CCC[C@@H]4C[N@H+](Cc5ccccc5)C[C@H]43)nc2N2CCOCC2)s1 ZINC001164627958 719068944 /nfs/dbraw/zinc/06/89/44/719068944.db2.gz RMUIDPVIJCJYEF-RTBURBONSA-N 1 1 436.585 3.024 20 0 IGADMO Cc1ccc(S(=O)(=O)n2ccc3c2nc(Cl)nc3N2C[C@@H](C)[N@H+](C)C[C@@H]2C)cc1 ZINC001164632942 719170948 /nfs/dbraw/zinc/17/09/48/719170948.db2.gz GAIBVQVZWCFKFB-CABCVRRESA-N 1 1 433.965 3.159 20 0 IGADMO Cc1cc(N2CCc3c(C[NH+](C)C)nn(C(C)C)c3C2)nc(NC(=O)c2ccccc2)n1 ZINC001164653836 719316990 /nfs/dbraw/zinc/31/69/90/719316990.db2.gz ZZSDMBFFUNFOKT-UHFFFAOYSA-N 1 1 433.560 3.439 20 0 IGADMO C[C@@H]1CCc2c(sc3nc(CN4CCCCC4)nc(N4C[C@H]5OCC[N@@H+](C)[C@H]5C4)c23)C1 ZINC001164667892 719442946 /nfs/dbraw/zinc/44/29/46/719442946.db2.gz IEABGVWDSJKXAJ-NZSAHSFTSA-N 1 1 441.645 3.321 20 0 IGADMO CNC(=O)C[N@H+]1CCCC12CCN(c1nc3ccccc3nc1N1CCCC[C@@H]1C)CC2 ZINC001164689545 719740044 /nfs/dbraw/zinc/74/00/44/719740044.db2.gz HGOFRGWTNYUCTF-IBGZPJMESA-N 1 1 436.604 3.189 20 0 IGADMO CC(C)(c1ccnc(Cl)c1)[N@@H+]1CC[C@@H]2C[C@@H](C(=O)NCCc3ccccn3)O[C@@H]2C1 ZINC001164701398 719820556 /nfs/dbraw/zinc/82/05/56/719820556.db2.gz OVWRQDRZCNSGII-LSTHTHJFSA-N 1 1 428.964 3.203 20 0 IGADMO CC(C)(c1ccnc(Cl)c1)[N@H+]1CC[C@@H]2C[C@@H](C(=O)NCCc3ccccn3)O[C@@H]2C1 ZINC001164701398 719820558 /nfs/dbraw/zinc/82/05/58/719820558.db2.gz OVWRQDRZCNSGII-LSTHTHJFSA-N 1 1 428.964 3.203 20 0 IGADMO COC(=O)[C@@]1(C)C[C@@H]([NH+]2CCOCC2)CCN1c1ncnc2cc(C(C)(C)C)sc21 ZINC001164700831 719847407 /nfs/dbraw/zinc/84/74/07/719847407.db2.gz KYGONJJZFSVCRO-OYHNWAKOSA-N 1 1 432.590 3.222 20 0 IGADMO COC(=O)[C@]1(C)C[C@@H]([NH+]2CCOCC2)CCN1c1ncnc2sc3c(c21)CC[C@H](C)C3 ZINC001164701439 719853550 /nfs/dbraw/zinc/85/35/50/719853550.db2.gz KNSIPFDIFWRTRZ-KXNSMUHISA-N 1 1 444.601 3.049 20 0 IGADMO COC(=O)[C@]1(C)C[C@H]([NH+]2CCOCC2)CCN1c1nc(Cl)cc2cc(OC)ccc21 ZINC001164700118 719861689 /nfs/dbraw/zinc/86/16/89/719861689.db2.gz GMOIHOABHPSTGG-ZHRRBRCNSA-N 1 1 433.936 3.130 20 0 IGADMO CC[NH+](CC)Cc1nc2sc(C)c(C)c2c(N2C[C@H]3COC[C@]3(c3nc(C)no3)C2)n1 ZINC001164801020 720060530 /nfs/dbraw/zinc/06/05/30/720060530.db2.gz FMBZGGBERPEHDS-KSFYIVLOSA-N 1 1 442.589 3.246 20 0 IGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1ncnc3c1CN(Cc1ccccc1)CC3)C2 ZINC001164812332 720084117 /nfs/dbraw/zinc/08/41/17/720084117.db2.gz QPKQWOZEHXLTPE-KCWPFWIISA-N 1 1 447.627 3.220 20 0 IGADMO COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1cc(Cl)ncc1C(=O)OC)CC2 ZINC001164710370 720095724 /nfs/dbraw/zinc/09/57/24/720095724.db2.gz JHRGBVLIVFCMNO-GOSISDBHSA-N 1 1 444.963 3.424 20 0 IGADMO CCOC(=O)Cc1cccnc1N1CCC2(C[C@@H](COC)[N@@H+](Cc3ccccn3)C2)CC1 ZINC001164712522 720100670 /nfs/dbraw/zinc/10/06/70/720100670.db2.gz WQMDWNVFKLTYIE-QFIPXVFZSA-N 1 1 438.572 3.090 20 0 IGADMO COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1nc(Cl)nc3c1COC3)CC2 ZINC001164718013 720107960 /nfs/dbraw/zinc/10/79/60/720107960.db2.gz QBDJMXXAFSTRLU-QGZVFWFLSA-N 1 1 429.952 3.063 20 0 IGADMO COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1ncc3ncn(C(C)C)c3n1)CC2 ZINC001164713946 720143078 /nfs/dbraw/zinc/14/30/78/720143078.db2.gz UGWXVNTUCPXVLQ-HXUWFJFHSA-N 1 1 435.576 3.310 20 0 IGADMO CCCNC(=O)c1ccc(N2CCC3(C[C@@H](COC)[N@@H+](Cc4ccccn4)C3)CC2)nc1 ZINC001164711751 720143631 /nfs/dbraw/zinc/14/36/31/720143631.db2.gz JMDPUCHOPAMXPM-QFIPXVFZSA-N 1 1 437.588 3.124 20 0 IGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1ccc(C(=O)N3CCC(C)CC3)cn1)C2 ZINC001164819548 720167563 /nfs/dbraw/zinc/16/75/63/720167563.db2.gz XSZBMYFEABWQPS-DHLKQENFSA-N 1 1 426.605 3.138 20 0 IGADMO COc1ccc2nc(Cl)nc(N3CCCn4c(=O)cc(C[N@@H+](C)C(C)C)nc4C3)c2c1 ZINC001164810810 720209609 /nfs/dbraw/zinc/20/96/09/720209609.db2.gz CUUPPAMKLUWGCY-UHFFFAOYSA-N 1 1 442.951 3.099 20 0 IGADMO CC(C)[N@@H+](C)Cc1cc(=O)n2c(n1)CN(c1nccc(-c3ccc(N(C)C)cc3)n1)CCC2 ZINC001164814476 720232373 /nfs/dbraw/zinc/23/23/73/720232373.db2.gz UNONRACKZMGSQJ-UHFFFAOYSA-N 1 1 447.587 3.017 20 0 IGADMO CC(C)[N@@H+](C)Cc1cc(=O)n2c(n1)CN(c1cc3nc(Cl)cnc3cc1F)CCC2 ZINC001164814469 720240519 /nfs/dbraw/zinc/24/05/19/720240519.db2.gz UHHLCAIHGVANFH-UHFFFAOYSA-N 1 1 430.915 3.230 20 0 IGADMO CCN(c1ccccc1)c1cc(N2CCCn3c(=O)cc(C[N@@H+](C)C(C)C)nc3C2)ncn1 ZINC001164813472 720241919 /nfs/dbraw/zinc/24/19/19/720241919.db2.gz OSOSOLVKYGBVBA-UHFFFAOYSA-N 1 1 447.587 3.442 20 0 IGADMO CCOC(Cc1c(Cl)ncnc1N1CC[C@H]2[C@@H]1CC[N@H+]2Cc1cccnc1)OCC ZINC001164723032 720385217 /nfs/dbraw/zinc/38/52/17/720385217.db2.gz FPFLMEIMZFZZSE-OALUTQOASA-N 1 1 431.968 3.320 20 0 IGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@H]2CN(c3cc(NC(=O)OC(C)(C)C)ncn3)CC[C@@H]21 ZINC001164834588 720518865 /nfs/dbraw/zinc/51/88/65/720518865.db2.gz GPGVQAGBWXKNST-FHWLQOOXSA-N 1 1 441.580 3.398 20 0 IGADMO CC(C)[N@@H+]1[C@@H]2CCN(c3nc(-c4ccccc4)nc(N(C)C)n3)C[C@@H]2C[C@H]1Cn1cccn1 ZINC001164842103 720561578 /nfs/dbraw/zinc/56/15/78/720561578.db2.gz WNIPCLNFBRVENL-FDFHNCONSA-N 1 1 446.603 3.179 20 0 IGADMO COc1nc(Cl)ncc1C(F)(F)N1CC[C@@H]2[C@H](C[C@H](Cn3cccn3)[N@H+]2C(C)C)C1 ZINC001164838767 720588247 /nfs/dbraw/zinc/58/82/47/720588247.db2.gz LPYXLLGAYVADFS-BFYDXBDKSA-N 1 1 440.926 3.258 20 0 IGADMO Cc1cc(NC(=O)c2cccnc2N2CC[C@@H]3[C@H](C[C@H](Cn4cccn4)[N@@H+]3C(C)C)C2)no1 ZINC001164842737 720597406 /nfs/dbraw/zinc/59/74/06/720597406.db2.gz VIGRQBIJBIOLOP-SFHLNBCPSA-N 1 1 449.559 3.205 20 0 IGADMO COC(=O)c1cc(Cl)c(N2CC[C@@H]3[C@H](C[C@H](Cn4cccn4)[N@H+]3C(C)C)C2)nc1C ZINC001164840236 720638768 /nfs/dbraw/zinc/63/87/68/720638768.db2.gz PFOKWATWBPGEJR-MBOZVWFJSA-N 1 1 431.968 3.404 20 0 IGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@@H]2CN(C(F)(F)c3cc[n+]([O-])c(Cl)c3)CC[C@@H]21 ZINC001164837005 720647872 /nfs/dbraw/zinc/64/78/72/720647872.db2.gz AQTPAIXQZOERJO-NJAFHUGGSA-N 1 1 425.911 3.093 20 0 IGADMO COC(=O)CSc1cncc(N2CCC3(C[C@@H]([N@@H+](C)Cc4ccccc4)CO3)CC2)n1 ZINC001164839015 720719161 /nfs/dbraw/zinc/71/91/61/720719161.db2.gz KHCGIGLHIVWIEJ-LJQANCHMSA-N 1 1 442.585 3.002 20 0 IGADMO Fc1cccc(Oc2nc(Cl)ncc2N2CC[N@H+]3C[C@@H](Oc4cncnc4)C[C@H]3C2)c1 ZINC001164751276 720802784 /nfs/dbraw/zinc/80/27/84/720802784.db2.gz XTTDHZUIKHDWCP-RDJZCZTQSA-N 1 1 442.882 3.193 20 0 IGADMO Fc1ccc(C(F)(F)N2CC[C@@H]3[C@H](C[C@H](Cn4cncn4)[N@H+]3CC3CC3)C2)nc1Cl ZINC001164742695 720814937 /nfs/dbraw/zinc/81/49/37/720814937.db2.gz DAUWGZMMKYXFON-BFYDXBDKSA-N 1 1 440.901 3.390 20 0 IGADMO Clc1ncnc2scc(N3CC[C@@H]4[C@@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)c21 ZINC001164741744 720822929 /nfs/dbraw/zinc/82/29/29/720822929.db2.gz OCJIHNAEMHBMMB-HRCADAONSA-N 1 1 429.981 3.316 20 0 IGADMO CC(C)(C)OC(=O)c1ccc(N2CC[C@@H]3[C@H](C[C@H](Cn4cncn4)[N@H+]3CC3CC3)C2)nc1 ZINC001164743833 720828057 /nfs/dbraw/zinc/82/80/57/720828057.db2.gz SSIJZNLBVPEPNB-NJDAHSKKSA-N 1 1 438.576 3.008 20 0 IGADMO c1ncn(C[C@@H]2C[C@H]3CN(c4ncnc5[nH]c6ccccc6c54)CC[C@H]3[N@H+]2CC2CC2)n1 ZINC001164741166 720832674 /nfs/dbraw/zinc/83/26/74/720832674.db2.gz DNHFOFIFPXMXHS-BBTUJRGHSA-N 1 1 428.544 3.082 20 0 IGADMO Cc1nc2c(nc(Cl)nc2N2CC[C@@H]3[C@@H](C[C@H](Cn4cncn4)[N@H+]3CC3CC3)C2)s1 ZINC001164743544 720833002 /nfs/dbraw/zinc/83/30/02/720833002.db2.gz JBXDWQQNDOPPPL-ARFHVFGLSA-N 1 1 444.996 3.019 20 0 IGADMO COc1ccccc1-c1ccc(N2CC[C@@H]3[C@H](C[C@H](Cn4cncn4)[N@H+]3CC3CC3)C2)nn1 ZINC001164745204 720847674 /nfs/dbraw/zinc/84/76/74/720847674.db2.gz MRCPYIBNQVUGKT-TXTKFYIRSA-N 1 1 445.571 3.123 20 0 IGADMO CCc1nc(Cl)c(N2CC[C@@H]3[C@@H](C[C@@H](Cn4cncn4)[N@H+]3CC3CC3)C2)c(Cl)n1 ZINC001164745192 720851064 /nfs/dbraw/zinc/85/10/64/720851064.db2.gz MNNQCNMYWZCKIM-HRCADAONSA-N 1 1 436.391 3.317 20 0 IGADMO CCc1nc(Cl)nc(Cl)c1N1CC[C@@H]2[C@@H](C[C@@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164745477 720858227 /nfs/dbraw/zinc/85/82/27/720858227.db2.gz DSUBWGSGUUOZPV-YQQAZPJKSA-N 1 1 436.391 3.317 20 0 IGADMO COCC[N@H+]1CCO[C@H]2CN(C(F)(F)c3nc4ccccc4nc3Cl)CC[C@@H]2C1 ZINC001164853108 720863837 /nfs/dbraw/zinc/86/38/37/720863837.db2.gz GMPCIVLKUQMPGW-PBHICJAKSA-N 1 1 426.895 3.002 20 0 IGADMO COC(=O)c1ccnc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COCc2cccnc2)c1 ZINC001164749686 720871242 /nfs/dbraw/zinc/87/12/42/720871242.db2.gz HQAYJUPRLHEFNU-WIOPSUGQSA-N 1 1 436.556 3.018 20 0 IGADMO CSc1ccnc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COCc2cccnc2)n1 ZINC001164750524 720876260 /nfs/dbraw/zinc/87/62/60/720876260.db2.gz JGWHZOLSGBVHAB-NFBKMPQASA-N 1 1 425.602 3.349 20 0 IGADMO Nc1cc(Cl)nc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COCc2cccnc2)c1 ZINC001164758448 720884078 /nfs/dbraw/zinc/88/40/78/720884078.db2.gz YDQRKWJHJRSPIU-CVDCTZTESA-N 1 1 427.980 3.467 20 0 IGADMO CC(=O)Nc1cccc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COCc2cccnc2)n1 ZINC001164756231 720889610 /nfs/dbraw/zinc/88/96/10/720889610.db2.gz ONMVXTNYKPAYKV-DHLKQENFSA-N 1 1 435.572 3.190 20 0 IGADMO CC(=O)Nc1cccc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COCc2cccnc2)n1 ZINC001164756233 720889834 /nfs/dbraw/zinc/88/98/34/720889834.db2.gz ONMVXTNYKPAYKV-RDGATRHJSA-N 1 1 435.572 3.190 20 0 IGADMO c1cncc(COC[C@H]2C[N@@H+](CC3CC3)C[C@@]23CCN(c2cncc(N4CCCC4)n2)C3)c1 ZINC001164751620 720898468 /nfs/dbraw/zinc/89/84/68/720898468.db2.gz CZAWJCHYSXXORW-ZEQKJWHPSA-N 1 1 448.615 3.227 20 0 IGADMO CC(C)Oc1cncc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COCc2cccnc2)n1 ZINC001164752817 720914722 /nfs/dbraw/zinc/91/47/22/720914722.db2.gz OZKYYUCDCWJDRZ-RDGATRHJSA-N 1 1 437.588 3.414 20 0 IGADMO CC(C)Oc1nccnc1N1CC[C@]2(C1)C[N@@H+](CC1CC1)C[C@@H]2COCc1cccnc1 ZINC001164752694 720925691 /nfs/dbraw/zinc/92/56/91/720925691.db2.gz OLPFGPOOJPBDON-RCZVLFRGSA-N 1 1 437.588 3.414 20 0 IGADMO Cc1cnc2c(ccnc2N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COCc2cccnc2)n1 ZINC001164755033 720926255 /nfs/dbraw/zinc/92/62/55/720926255.db2.gz XWCCTLRSZLZNBC-BKMJKUGQSA-N 1 1 444.583 3.483 20 0 IGADMO CCOC(=O)c1cc2ncnc(N3CCn4c(C[N@@H+](C)C(C)C)cnc4[C@H]3C)c2s1 ZINC001164863477 720979388 /nfs/dbraw/zinc/97/93/88/720979388.db2.gz VRLMGXTUTKVPRI-CQSZACIVSA-N 1 1 428.562 3.486 20 0 IGADMO CCC[N@H+]1CCCC[C@@H]1c1ccc(N2CC[C@@H]3CO[C@H](CNC(=O)N(C)C)[C@H]3C2)nc1 ZINC001164757348 721000454 /nfs/dbraw/zinc/00/04/54/721000454.db2.gz OMBPJWPRANFFRE-CIAFKFPVSA-N 1 1 429.609 3.131 20 0 IGADMO CC(C)[N@@H+](C)Cc1cnc2n1CCN(C(F)(F)c1cc(N(C)C)nc(Cl)n1)[C@H]2C ZINC001164861225 721016733 /nfs/dbraw/zinc/01/67/33/721016733.db2.gz NUVAHKKNLYYPBK-ZDUSSCGKSA-N 1 1 427.931 3.359 20 0 IGADMO C[NH+]1CCC(Oc2ccnc(N3CCC[C@]4(C[C@H](OCc5ccccn5)CO4)C3)c2)CC1 ZINC001164761477 721032032 /nfs/dbraw/zinc/03/20/32/721032032.db2.gz GFHXQBYCYKVQON-ZCYQVOJMSA-N 1 1 438.572 3.294 20 0 IGADMO FC(F)(c1nc(Cl)cc(Cl)n1)N1CC[N@H+]2C[C@@H](OCc3cccnc3)C[C@@H]2C1 ZINC001164868017 721054106 /nfs/dbraw/zinc/05/41/06/721054106.db2.gz MBXXXJZPRYAICV-KGLIPLIRSA-N 1 1 430.286 3.203 20 0 IGADMO COc1ccc2nc(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@@H]4C3)c(Cl)nc2c1 ZINC001164866407 721076459 /nfs/dbraw/zinc/07/64/59/721076459.db2.gz TZTUXJGCKKYALN-AEFFLSMTSA-N 1 1 425.920 3.167 20 0 IGADMO CCOC(=O)c1cc2c(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@H]4C3)[nH]c(C)c(C)c-2n1 ZINC001164866352 721106721 /nfs/dbraw/zinc/10/67/21/721106721.db2.gz SOGMCKSRYSZVFC-VQTJNVASSA-N 1 1 449.555 3.231 20 0 IGADMO FC(F)(c1cnc2c(Cl)ncnc2c1)N1CC[N@H+]2C[C@H](OCc3cccnc3)C[C@@H]2C1 ZINC001164870375 721127430 /nfs/dbraw/zinc/12/74/30/721127430.db2.gz CROLJLXBKFCXJS-IAGOWNOFSA-N 1 1 446.889 3.098 20 0 IGADMO FC(F)(c1cnc2c(Cl)ncnc2c1)N1CC[N@H+]2C[C@@H](OCc3cccnc3)C[C@H]2C1 ZINC001164870380 721128526 /nfs/dbraw/zinc/12/85/26/721128526.db2.gz CROLJLXBKFCXJS-IRXDYDNUSA-N 1 1 446.889 3.098 20 0 IGADMO Clc1nc2c(Cl)nccc2c(N2CC[N@H+]3C[C@H](OCc4cccnc4)C[C@H]3C2)n1 ZINC001164871039 721137217 /nfs/dbraw/zinc/13/72/17/721137217.db2.gz DARPSMGLARGFJO-LSDHHAIUSA-N 1 1 431.327 3.206 20 0 IGADMO CCOC(=O)c1cc2c(N3C[C@H]4CC[N@@H+](Cc5cnn(C)c5)C[C@@H]4C3)[nH]c(C)c(C)c-2n1 ZINC001164773555 721159214 /nfs/dbraw/zinc/15/92/14/721159214.db2.gz YIPYZFWXMQGRNR-RTBURBONSA-N 1 1 436.560 3.048 20 0 IGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(C(F)(F)Cc4nc(Cl)cc(Cl)n4)C[C@@H]3C2)cn1 ZINC001164772338 721181286 /nfs/dbraw/zinc/18/12/86/721181286.db2.gz SJCHWWDZBSRMGJ-KBPBESRZSA-N 1 1 431.318 3.106 20 0 IGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4ncc(C(=O)NC5CCCC5)cc4Cl)C[C@H]3C2)cn1 ZINC001164773387 721206558 /nfs/dbraw/zinc/20/65/58/721206558.db2.gz WWTXXQBCDJCXOP-IEBWSBKVSA-N 1 1 442.995 3.099 20 0 IGADMO CCC[N@H+]1CCCC[C@H]1c1ccc(N2CCn3c(CNC(=O)c4ccno4)cnc3C2)nc1 ZINC001164764427 721268860 /nfs/dbraw/zinc/26/88/60/721268860.db2.gz GNPLNRYMQRPZFJ-FQEVSTJZSA-N 1 1 449.559 3.153 20 0 IGADMO O=S(=O)(c1ccccc1)N1C[C@H]2CN(c3nc(Cl)ccc3C[NH+]3CCCC3)C[C@H]2C1 ZINC001164878269 721307860 /nfs/dbraw/zinc/30/78/60/721307860.db2.gz KPHPKNDIAIJFCU-KDURUIRLSA-N 1 1 447.004 3.088 20 0 IGADMO CCOC(=O)c1ccc(C)c(N2CCC[C@@]3(C2)COCC[N@@H+](Cc2c(C)noc2C)C3)n1 ZINC001164776983 721330645 /nfs/dbraw/zinc/33/06/45/721330645.db2.gz JGEGYKRZQYISJC-XMMPIXPASA-N 1 1 442.560 3.291 20 0 IGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@]2(CCCN(C(F)(F)c3ccnc(Cl)n3)C2)C1 ZINC001164776118 721331097 /nfs/dbraw/zinc/33/10/97/721331097.db2.gz CPMJPTFCNHOLTI-LJQANCHMSA-N 1 1 441.910 3.399 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@]2(CCCN(C(F)(F)c3ccnc(Cl)n3)C2)C1 ZINC001164776118 721331099 /nfs/dbraw/zinc/33/10/99/721331099.db2.gz CPMJPTFCNHOLTI-LJQANCHMSA-N 1 1 441.910 3.399 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@]2(CCCN(c3nnc(Cl)c4ccncc43)C2)C1 ZINC001164776530 721338005 /nfs/dbraw/zinc/33/80/05/721338005.db2.gz GCSHLIHEIZRYJX-JOCHJYFZSA-N 1 1 442.951 3.402 20 0 IGADMO COc1cccc2c1ncnc2N1CCC[C@]2(C1)COCC[N@@H+](Cc1c(C)noc1C)C2 ZINC001164777844 721341025 /nfs/dbraw/zinc/34/10/25/721341025.db2.gz IUCQTKIGYJNZOY-DEOSSOPVSA-N 1 1 437.544 3.362 20 0 IGADMO COc1nc2ccccc2nc1N1CCC[C@@]2(C1)COCC[N@H+](Cc1c(C)noc1C)C2 ZINC001164776826 721341891 /nfs/dbraw/zinc/34/18/91/721341891.db2.gz DCGJAGCJPGRGLO-XMMPIXPASA-N 1 1 437.544 3.362 20 0 IGADMO COc1nc2ccccc2nc1N1CCC[C@@]2(C1)COCC[N@@H+](Cc1c(C)noc1C)C2 ZINC001164776826 721341895 /nfs/dbraw/zinc/34/18/95/721341895.db2.gz DCGJAGCJPGRGLO-XMMPIXPASA-N 1 1 437.544 3.362 20 0 IGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2C[C@@H]3CCCO[C@H]3[C@@H](NC(=O)c3cccnc3)C2)nc1 ZINC001164788540 721381681 /nfs/dbraw/zinc/38/16/81/721381681.db2.gz ZPFJMPHDJSXXSX-LYGMZBLVSA-N 1 1 449.599 3.437 20 0 IGADMO CCOC(=O)c1c2ccccn2c2ncnc(N3C[C@@H]4C[NH+](Cc5nccs5)C[C@H]4C3)c21 ZINC001164779634 721389912 /nfs/dbraw/zinc/38/99/12/721389912.db2.gz BMTZHUMUVKPODX-HOTGVXAUSA-N 1 1 448.552 3.084 20 0 IGADMO C[NH+]1CCN(C[C@H]2CCC[C@@]3(CCN(c4nccnc4C4SCCCS4)C3)O2)CC1 ZINC001164889363 721398965 /nfs/dbraw/zinc/39/89/65/721398965.db2.gz LUIOJXRFPGPVSK-GCJKJVERSA-N 1 1 449.690 3.111 20 0 IGADMO Cc1cccc2c1nc(Cl)nc2N1CC[C@@]2(C1)CCC[C@H](CN1CC[NH+](C)CC1)O2 ZINC001164888352 721401246 /nfs/dbraw/zinc/40/12/46/721401246.db2.gz OKBYGDDENMHGBM-WZONZLPQSA-N 1 1 429.996 3.357 20 0 IGADMO C[NH+]1CCN(C[C@@H]2CCC[C@]3(CCN(c4nc(Cl)nc5cccc(F)c54)C3)O2)CC1 ZINC001164883500 721401323 /nfs/dbraw/zinc/40/13/23/721401323.db2.gz AFBOMUTXSUDCMI-KSFYIVLOSA-N 1 1 433.959 3.188 20 0 IGADMO CSc1nc2ccsc2c(N2CC[C@]3(C2)CCC[C@H](CN2CC[NH+](C)CC2)O3)n1 ZINC001164891953 721406729 /nfs/dbraw/zinc/40/67/29/721406729.db2.gz WYHKHUKNHXAFKV-IERDGZPVSA-N 1 1 433.647 3.179 20 0 IGADMO C[NH+]1CCN(C[C@H]2CCC[C@@]3(CCN(c4nc(Cl)nc5c4CCCCC5)C3)O2)CC1 ZINC001164887747 721407527 /nfs/dbraw/zinc/40/75/27/721407527.db2.gz NEVMGADYTPBGCA-JPYJTQIMSA-N 1 1 434.028 3.164 20 0 IGADMO C[NH+]1CCN(C[C@@H]2CCC[C@]3(CCN(C(F)(F)c4nc(Cl)ccc4F)C3)O2)CC1 ZINC001164885143 721409708 /nfs/dbraw/zinc/40/97/08/721409708.db2.gz FWUPUDRSKKNCDY-HNAYVOBHSA-N 1 1 432.918 3.184 20 0 IGADMO CCOC(=O)c1ccc2nc(Cl)nc(N3C[C@@H]4C[NH+](Cc5nccs5)C[C@H]4C3)c2c1 ZINC001164783539 721423794 /nfs/dbraw/zinc/42/37/94/721423794.db2.gz IYDOCCZHSWPNJH-GJZGRUSLSA-N 1 1 443.960 3.485 20 0 IGADMO C[NH+]1CCN(C[C@@H]2CCC[C@]3(CCN(c4ncc5c(n4)-c4ccccc4CC5)C3)O2)CC1 ZINC001164895377 721427503 /nfs/dbraw/zinc/42/75/03/721427503.db2.gz OCSXWBGXRZTSCG-BKMJKUGQSA-N 1 1 433.600 3.008 20 0 IGADMO Cc1nc2sc3c(c2c(N2CC[C@@]4(C2)CCC[C@H](CN2CC[NH+](C)CC2)O4)n1)CCC3 ZINC001164895800 721433393 /nfs/dbraw/zinc/43/33/93/721433393.db2.gz PQUGDGGQSABMLZ-HOYKHHGWSA-N 1 1 441.645 3.254 20 0 IGADMO COc1ccc(CN(C)c2ccnc(N3C[C@H]4C[NH+](Cc5nccs5)C[C@@H]4C3)n2)cc1 ZINC001164783475 721435015 /nfs/dbraw/zinc/43/50/15/721435015.db2.gz IQQHPAMHQHVFBJ-RTBURBONSA-N 1 1 436.585 3.146 20 0 IGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1nc(Cl)nc3cc[nH]c31)CC2 ZINC001164788718 721448560 /nfs/dbraw/zinc/44/85/60/721448560.db2.gz SXXWUEVQUDQZOE-QGZVFWFLSA-N 1 1 433.984 3.345 20 0 IGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1ncc3cccc(OC)c3n1)CC2 ZINC001164789374 721460975 /nfs/dbraw/zinc/46/09/75/721460975.db2.gz XNIDWCUUYYQASH-NRFANRHFSA-N 1 1 440.588 3.372 20 0 IGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(C(F)(F)c1nccnc1Cl)CC2 ZINC001164784866 721464804 /nfs/dbraw/zinc/46/48/04/721464804.db2.gz KNIMGWGSFQVPNJ-QGZVFWFLSA-N 1 1 444.954 3.409 20 0 IGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1cc(N3CCCCC3)ncn1)CC2 ZINC001164787985 721466673 /nfs/dbraw/zinc/46/66/73/721466673.db2.gz HIZRRQFFVLEIKZ-JOCHJYFZSA-N 1 1 443.636 3.201 20 0 IGADMO Clc1ccc(C[NH+]2CCCC2)c(N2CCCn3nnc(CNc4cccnc4)c3C2)n1 ZINC001164791280 721474922 /nfs/dbraw/zinc/47/49/22/721474922.db2.gz WIXVDFJGFZNYKV-UHFFFAOYSA-N 1 1 438.967 3.340 20 0 IGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2CC[C@@H]3OCC[C@@H](C(=O)N4CCCO4)[C@H]3C2)nc1 ZINC001164791898 721483265 /nfs/dbraw/zinc/48/32/65/721483265.db2.gz KLKUDNURTRSWKJ-YSFYHYPLSA-N 1 1 428.577 3.024 20 0 IGADMO O=C1NC2(C[C@H]1c1ccncc1)CCN(c1nc(Cl)ccc1C[NH+]1CCCC1)CC2 ZINC001164899673 721504318 /nfs/dbraw/zinc/50/43/18/721504318.db2.gz ZVPHGLFLGNGFTL-IBGZPJMESA-N 1 1 425.964 3.369 20 0 IGADMO CCOC(=O)c1cc2ncnc(N3CC[N@H+]4C[C@H](Oc5cccc(F)c5)C[C@@H]4C3)c2s1 ZINC001164907291 721545282 /nfs/dbraw/zinc/54/52/82/721545282.db2.gz MVARGZDGCPPVAJ-NVXWUHKLSA-N 1 1 442.516 3.349 20 0 IGADMO COC(=O)c1c(Cl)cnc(N2CC[N@H+]3C[C@H](Oc4cccc(F)c4)C[C@H]3C2)c1OC ZINC001164909354 721549292 /nfs/dbraw/zinc/54/92/92/721549292.db2.gz RQWZRFPKQKMYAX-GOEBONIOSA-N 1 1 435.883 3.011 20 0 IGADMO Fc1cccc(O[C@@H]2C[C@@H]3CN(c4ccc(-c5ccc6c(c5)OCCO6)nn4)CC[N@H+]3C2)c1 ZINC001164910911 721553972 /nfs/dbraw/zinc/55/39/72/721553972.db2.gz XNFHWVRXTPIAKM-TZIWHRDSSA-N 1 1 448.498 3.396 20 0 IGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2cnc(OCc3ccccc3)cn2)[C@@H]2CCCO[C@@H]12 ZINC001164805640 721569799 /nfs/dbraw/zinc/56/97/99/721569799.db2.gz OGEPOMVLUUYTOD-TZBSWOFLSA-N 1 1 431.540 3.319 20 0 IGADMO COC(=O)/C=C/c1cc2cc[nH]c2c(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@H]32)n1 ZINC001164806689 721570316 /nfs/dbraw/zinc/57/03/16/721570316.db2.gz QUGQYZXJYKDGJY-HBLUSQOVSA-N 1 1 447.539 3.012 20 0 IGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2nc3ccccc3nc2N2CCCC2)[C@@H]2CCCO[C@H]12 ZINC001164805793 721575526 /nfs/dbraw/zinc/57/55/26/721575526.db2.gz OVZPGUMDTXECIJ-SMIHKQSGSA-N 1 1 444.583 3.493 20 0 IGADMO CC1CCN(C(=O)c2cccnc2N2C[C@H]([N@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@@H]32)CC1 ZINC001164801761 721576585 /nfs/dbraw/zinc/57/65/85/721576585.db2.gz HESJDPYGXNTARI-KMDXXIMOSA-N 1 1 449.599 3.217 20 0 IGADMO CC1CCN(C(=O)c2cccnc2N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@@H]32)CC1 ZINC001164801761 721576589 /nfs/dbraw/zinc/57/65/89/721576589.db2.gz HESJDPYGXNTARI-KMDXXIMOSA-N 1 1 449.599 3.217 20 0 IGADMO Cc1cn(-c2ccc(N3CCC(F)(F)[C@]4(CC[N@@H+](Cc5ccccn5)C4)C3)nn2)cn1 ZINC001164906498 721716225 /nfs/dbraw/zinc/71/62/25/721716225.db2.gz MJIZZYODMMQCGO-NRFANRHFSA-N 1 1 425.487 3.103 20 0 IGADMO CN(C)C(=O)C[NH+]1CCC2(CCCN2C(F)(F)c2nc(Cl)c3ccccc3n2)CC1 ZINC001165008792 721731355 /nfs/dbraw/zinc/73/13/55/721731355.db2.gz QVTLEWUBYIUHEJ-UHFFFAOYSA-N 1 1 437.922 3.351 20 0 IGADMO CN(C)C(=O)C[NH+]1CCC2(CCCN2C(F)(F)Oc2ccc(Cl)nc2Cl)CC1 ZINC001165012864 721748776 /nfs/dbraw/zinc/74/87/76/721748776.db2.gz PNNKXKOWEBEJRL-UHFFFAOYSA-N 1 1 437.318 3.336 20 0 IGADMO CCC[N@H+]1CCCC[C@@H]1c1ccc(N2CCOC[C@@]3(CN(C(=O)C(C)C)CCO3)C2)nc1 ZINC001165025673 721788267 /nfs/dbraw/zinc/78/82/67/721788267.db2.gz WGSSCQZWAVIDCV-RDGATRHJSA-N 1 1 444.620 3.109 20 0 IGADMO CN1CCOc2c(Cl)nnc(N3C[C@@H]4CCC[C@H]([N@@H+](C)Cc5ccccn5)[C@H]4C3)c21 ZINC001165030170 721821287 /nfs/dbraw/zinc/82/12/87/721821287.db2.gz YDJZPNLCIUBPEF-SZMVWBNQSA-N 1 1 428.968 3.091 20 0 IGADMO CN(C)CC[N@H+]1CC[C@H]2[C@@H]1CCN2c1nc(-c2cccnc2)nc2sc3c(c21)CCC3 ZINC001164929414 721879436 /nfs/dbraw/zinc/87/94/36/721879436.db2.gz BGSIJTADGUTBJL-OALUTQOASA-N 1 1 434.613 3.457 20 0 IGADMO C[NH+](C)CCN1CC[C@H]2[C@@H]1CCN2c1nc(-c2cccnc2)nc2sc3c(c21)CCC3 ZINC001164929414 721879437 /nfs/dbraw/zinc/87/94/37/721879437.db2.gz BGSIJTADGUTBJL-OALUTQOASA-N 1 1 434.613 3.457 20 0 IGADMO Cc1sc2nc(CN3CCCC3)nc(N3CC[C@H]4[C@@H]3CC[N@@H+]4CCN(C)C)c2c1C ZINC001164929511 721879686 /nfs/dbraw/zinc/87/96/86/721879686.db2.gz BNOSWEODVGURLP-OALUTQOASA-N 1 1 428.650 3.119 20 0 IGADMO Cc1sc2nc(CN3CCCC3)nc(N3CC[C@H]4[C@@H]3CCN4CC[NH+](C)C)c2c1C ZINC001164929511 721879688 /nfs/dbraw/zinc/87/96/88/721879688.db2.gz BNOSWEODVGURLP-OALUTQOASA-N 1 1 428.650 3.119 20 0 IGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2CCC3(CC2)COCCN3Cc2ccn(C)n2)nc1 ZINC001164935966 721909619 /nfs/dbraw/zinc/90/96/19/721909619.db2.gz QHZHCLNEVLATCM-HSZRJFAPSA-N 1 1 438.620 3.233 20 0 IGADMO COC(=O)c1ccc(NC(=O)C(C)(C)C)c(N2CC[NH+](CCOc3ccccc3)CC2)n1 ZINC001165044032 721958493 /nfs/dbraw/zinc/95/84/93/721958493.db2.gz CUDPQKHTOSRYMJ-UHFFFAOYSA-N 1 1 440.544 3.054 20 0 IGADMO O=C1NCC[N@@H+](Cc2ccccc2)C12CCN(c1cc(F)cc3ncnc(Cl)c31)CC2 ZINC001164945044 721977607 /nfs/dbraw/zinc/97/76/07/721977607.db2.gz BAHZIQVNDVFMOD-UHFFFAOYSA-N 1 1 439.922 3.393 20 0 IGADMO O=C1NCC[N@H+](Cc2ccccc2)C12CCN(c1cc(F)cc3ncnc(Cl)c31)CC2 ZINC001164945044 721977608 /nfs/dbraw/zinc/97/76/08/721977608.db2.gz BAHZIQVNDVFMOD-UHFFFAOYSA-N 1 1 439.922 3.393 20 0 IGADMO CSc1ccc2ncnc(N3CCC4(CC3)C(=O)NCC[N@H+]4Cc3ccccc3)c2c1 ZINC001164948334 721980865 /nfs/dbraw/zinc/98/08/65/721980865.db2.gz KYOAHMUBVPXCCE-UHFFFAOYSA-N 1 1 433.581 3.323 20 0 IGADMO CSc1ccc2ncnc(N3CCC4(CC3)C(=O)NCC[N@@H+]4Cc3ccccc3)c2c1 ZINC001164948334 721980866 /nfs/dbraw/zinc/98/08/66/721980866.db2.gz KYOAHMUBVPXCCE-UHFFFAOYSA-N 1 1 433.581 3.323 20 0 IGADMO CCOC(=O)c1cc(N2CCC3(CC2)COCC[N@@H+](Cc2ccncc2)C3)ncc1Cl ZINC001164959520 722053156 /nfs/dbraw/zinc/05/31/56/722053156.db2.gz LSZMDWMACFMTLE-UHFFFAOYSA-N 1 1 444.963 3.426 20 0 IGADMO Nc1cc(Cl)nc(C(F)(F)N2CCC3(CC2)COCC[N@@H+](Cc2ccncc2)C3)c1 ZINC001164962217 722057273 /nfs/dbraw/zinc/05/72/73/722057273.db2.gz BMPSZLFPSBOJAL-UHFFFAOYSA-N 1 1 437.922 3.376 20 0 IGADMO COC(OC)c1cc(C)cnc1N1CCC2(CC1)COCC[N@@H+](Cc1ccncc1)C2 ZINC001164963393 722058188 /nfs/dbraw/zinc/05/81/88/722058188.db2.gz YFFPNGXOJKATJT-UHFFFAOYSA-N 1 1 426.561 3.195 20 0 IGADMO O=C(Nc1ccc(Cl)nc1)c1ccc(F)c(N2C[C@@H]3C[N@H+](CC4CC4)C[C@H](C2)O3)c1 ZINC001164967887 722072019 /nfs/dbraw/zinc/07/20/19/722072019.db2.gz TXPLPGFDXITEHM-HDICACEKSA-N 1 1 430.911 3.426 20 0 IGADMO CC(=O)N1CCC[C@]2(C1)CN(c1nc(C[NH+]3CCCC3)nc3sc(C)c(C)c31)CCO2 ZINC001164968553 722083829 /nfs/dbraw/zinc/08/38/29/722083829.db2.gz DMTVXUJZHNQNPU-QHCPKHFHSA-N 1 1 443.617 3.122 20 0 IGADMO C[NH+]1CCC(Oc2ccnc(N3CCC4(CC[C@@H](C(=O)NCC5CC5)C4)CC3)c2)CC1 ZINC001164975236 722091857 /nfs/dbraw/zinc/09/18/57/722091857.db2.gz DZFSNSZUQMXGIQ-HXUWFJFHSA-N 1 1 426.605 3.468 20 0 IGADMO COc1cccc2c1nc(Cl)nc2N1CC[C@H]2C[N@@H+](Cc3cccnc3)CCO[C@H]2C1 ZINC001164972533 722116292 /nfs/dbraw/zinc/11/62/92/722116292.db2.gz FYCXZNWDCOWFQO-PXNSSMCTSA-N 1 1 439.947 3.414 20 0 IGADMO COc1ccc(C(F)(F)N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)nc1Cl ZINC001164975585 722125195 /nfs/dbraw/zinc/12/51/95/722125195.db2.gz JXCZLSNJWSIGIU-AEFFLSMTSA-N 1 1 438.906 3.411 20 0 IGADMO COc1cccc(-c2ccnc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)n2)c1 ZINC001164985555 722130504 /nfs/dbraw/zinc/13/05/04/722130504.db2.gz ZUIOMHWRXZCVIZ-ZJSXRUAMSA-N 1 1 431.540 3.275 20 0 IGADMO COc1cccc(Oc2cncc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)n2)c1 ZINC001164977102 722131247 /nfs/dbraw/zinc/13/12/47/722131247.db2.gz ITAUVXURQIRPFN-NZQKXSOJSA-N 1 1 447.539 3.400 20 0 IGADMO COc1ccccc1-c1ccc(N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)nn1 ZINC001164985090 722141892 /nfs/dbraw/zinc/14/18/92/722141892.db2.gz ZELPULJERNHFIM-YKSBVNFPSA-N 1 1 431.540 3.275 20 0 IGADMO c1cncc(C[N@H+]2CCO[C@@H]3CN(c4nc(-c5ccncc5)nc5c4CCC5)CC[C@H]3C2)c1 ZINC001164984577 722149184 /nfs/dbraw/zinc/14/91/84/722149184.db2.gz XEFNXLPIMXQQDI-XUZZJYLKSA-N 1 1 442.567 3.150 20 0 IGADMO Cc1nc(CN2CCO[C@H]3CCN(c4cc[nH+]c(N5CCCCC5)n4)CC[C@H]32)cs1 ZINC001164987013 722184964 /nfs/dbraw/zinc/18/49/64/722184964.db2.gz IESCFFHUIXTAIG-UXHICEINSA-N 1 1 428.606 3.102 20 0 IGADMO CC(C)NC(=O)[C@H]1C[C@@H]2[C@H](C1)OCCN2c1ccc2c(n1)CC[N@H+](Cc1ccccc1)C2 ZINC001164994316 722214608 /nfs/dbraw/zinc/21/46/08/722214608.db2.gz ALRJLLFZQVSDIU-QTJGBDASSA-N 1 1 434.584 3.148 20 0 IGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2CC[C@@H](OCCOC)[C@@H]2Cc2cnn(C)c2)nc1 ZINC001164998397 722225221 /nfs/dbraw/zinc/22/52/21/722225221.db2.gz BHBXFRLUIGMKFM-XPWALMASSA-N 1 1 427.593 3.215 20 0 IGADMO COc1ccc2c(cc(Cl)nc2N2CCc3ncnc(N4CC[NH+](C)CC4)c3CC2)c1 ZINC001164998042 722235353 /nfs/dbraw/zinc/23/53/53/722235353.db2.gz ZRTAFNUUVHIIRH-UHFFFAOYSA-N 1 1 438.963 3.044 20 0 IGADMO COc1cc2cnc(Cl)cc2cc1N1CCc2ncnc(N3CC[NH+](C)CC3)c2CC1 ZINC001165002380 722240701 /nfs/dbraw/zinc/24/07/01/722240701.db2.gz CGXHYAOZGWDIJZ-UHFFFAOYSA-N 1 1 438.963 3.044 20 0 IGADMO c1nc2c(nc(N3CCC[C@H]4C[N@H+](Cc5ccccc5)C[C@@H]43)nc2N2CCOCC2)s1 ZINC001164627950 719069302 /nfs/dbraw/zinc/06/93/02/719069302.db2.gz RMUIDPVIJCJYEF-OALUTQOASA-N 1 1 436.585 3.024 20 0 IGADMO c1ccc(C[N@@H+]2C[C@H]3[C@H](C2)CCCN3c2nc(N3CCCC3)nc(N3CCCC3)n2)cc1 ZINC001164621872 719095962 /nfs/dbraw/zinc/09/59/62/719095962.db2.gz BIWYZKFHAUSSSX-VXKWHMMOSA-N 1 1 433.604 3.173 20 0 IGADMO COC(=O)c1cnc(Cl)cc1C(F)(F)N1CCc2c(C[NH+](C)C)nn(C(C)C)c2C1 ZINC001164651941 719315066 /nfs/dbraw/zinc/31/50/66/719315066.db2.gz KYFHHZOFOZDTNC-UHFFFAOYSA-N 1 1 441.910 3.468 20 0 IGADMO Fc1ccc(CN2CCOCC23CCN(c2cc[nH+]c(N4CCCCC4)n2)CC3)cc1 ZINC001164672556 719520753 /nfs/dbraw/zinc/52/07/53/719520753.db2.gz KOMBFRFHPZYRBN-UHFFFAOYSA-N 1 1 425.552 3.477 20 0 IGADMO CNC(=O)C[N@H+]1CCCC12CCN(c1cnc(Cl)nc1Oc1ccc(C)cc1)CC2 ZINC001164690159 719753182 /nfs/dbraw/zinc/75/31/82/719753182.db2.gz UQQBFPTXDNXKHQ-UHFFFAOYSA-N 1 1 429.952 3.412 20 0 IGADMO CNC(=O)C[N@H+]1CCCC12CCN(c1cnc(Cl)nc1Oc1ccccc1F)CC2 ZINC001164690306 719753714 /nfs/dbraw/zinc/75/37/14/719753714.db2.gz ZAXUKKBFEXYPGI-UHFFFAOYSA-N 1 1 433.915 3.242 20 0 IGADMO Cc1nc(C[N@H+]2CCCC23CCN(c2ccc(CN4C(=O)CCC4=O)cn2)CC3)cs1 ZINC001164692191 719811330 /nfs/dbraw/zinc/81/13/30/719811330.db2.gz NOUSDYQXYCVVGX-UHFFFAOYSA-N 1 1 439.585 3.131 20 0 IGADMO COC(=O)[C@]1(C)C[C@H]([NH+]2CCOCC2)CCN1c1ncc(OC)c2ccc(Cl)cc21 ZINC001164701376 719854764 /nfs/dbraw/zinc/85/47/64/719854764.db2.gz KIKWUCJFCMQGQG-ZHRRBRCNSA-N 1 1 433.936 3.130 20 0 IGADMO COC(=O)[C@]1(C)C[C@H]([NH+]2CCOCC2)CCN1c1cc(Cl)nnc1-c1ccccc1 ZINC001164701936 719854898 /nfs/dbraw/zinc/85/48/98/719854898.db2.gz MCBVIQGKWPQHGE-VGSWGCGISA-N 1 1 430.936 3.030 20 0 IGADMO COC(=O)[C@@]1(C)C[C@H]([NH+]2CCOCC2)CCN1c1nnc(Cl)c2ccc(Cl)cc21 ZINC001164708216 719874408 /nfs/dbraw/zinc/87/44/08/719874408.db2.gz YRKPOTVUNWVLHW-JLTOFOAXSA-N 1 1 439.343 3.169 20 0 IGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1ncnc3c1CN(Cc1ccccc1)CC3)C2 ZINC001164812334 720083530 /nfs/dbraw/zinc/08/35/30/720083530.db2.gz QPKQWOZEHXLTPE-WNCULLNHSA-N 1 1 447.627 3.220 20 0 IGADMO COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1ncc(C(=O)OC)cc1Cl)CC2 ZINC001164711176 720094337 /nfs/dbraw/zinc/09/43/37/720094337.db2.gz OYUZZVXCHIWXAE-LJQANCHMSA-N 1 1 444.963 3.424 20 0 IGADMO COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1nc(SC)ncc1OC)CC2 ZINC001164711007 720097407 /nfs/dbraw/zinc/09/74/07/720097407.db2.gz MTZUUZUBQOCTTM-GOSISDBHSA-N 1 1 429.590 3.110 20 0 IGADMO COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1nc(SC)ncc1OC)CC2 ZINC001164711009 720098011 /nfs/dbraw/zinc/09/80/11/720098011.db2.gz MTZUUZUBQOCTTM-SFHVURJKSA-N 1 1 429.590 3.110 20 0 IGADMO CCOC(=O)Cc1cccnc1N1CCC2(C[C@H](COC)[N@@H+](Cc3ccccn3)C2)CC1 ZINC001164712521 720100843 /nfs/dbraw/zinc/10/08/43/720100843.db2.gz WQMDWNVFKLTYIE-JOCHJYFZSA-N 1 1 438.572 3.090 20 0 IGADMO COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1nccc3c1C(=O)OC3(C)C)CC2 ZINC001164716894 720114308 /nfs/dbraw/zinc/11/43/08/720114308.db2.gz LHEQVTPKGZTRLR-LJQANCHMSA-N 1 1 436.556 3.390 20 0 IGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1nc3cc(OC)c(OC)cc3nc1Cl)C2 ZINC001164813864 720119978 /nfs/dbraw/zinc/11/99/78/720119978.db2.gz RJANTIGZXCVRJH-HJPURHCSSA-N 1 1 446.979 3.485 20 0 IGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1cc(C(=O)NC(C)(C)C)cc(Cl)n1)C2 ZINC001164807298 720128286 /nfs/dbraw/zinc/12/82/86/720128286.db2.gz BUKVIKPJHBRAQX-FDDCHVKYSA-N 1 1 435.012 3.448 20 0 IGADMO CCCNC(=O)c1ccc(N2CCC3(C[C@H](COC)[N@@H+](Cc4ccccn4)C3)CC2)nc1 ZINC001164711750 720143127 /nfs/dbraw/zinc/14/31/27/720143127.db2.gz JMDPUCHOPAMXPM-JOCHJYFZSA-N 1 1 437.588 3.124 20 0 IGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1ncccc1C(=O)N1CCc3ccccc31)C2 ZINC001164815554 720164245 /nfs/dbraw/zinc/16/42/45/720164245.db2.gz IDPCDQJFUNNDCT-AMGIVPHBSA-N 1 1 446.595 3.469 20 0 IGADMO CC(C)[N@@H+](C)Cc1cc(=O)n2c(n1)CN(c1nc(Cl)nc3[nH]cc(Cl)c31)CCC2 ZINC001164812897 720209702 /nfs/dbraw/zinc/20/97/02/720209702.db2.gz NBGWYBBJEDHJDM-UHFFFAOYSA-N 1 1 436.347 3.072 20 0 IGADMO CC(C)[N@@H+](C)Cc1cc(=O)n2c(n1)CN(C(F)(F)c1nc(Cl)cc(Cl)n1)CCC2 ZINC001164810332 720212677 /nfs/dbraw/zinc/21/26/77/720212677.db2.gz CHDJJECXHHBPBP-UHFFFAOYSA-N 1 1 447.317 3.136 20 0 IGADMO Cc1cccc2nc(Cl)nc(N3CCCn4c(=O)cc(C[N@H+](C)C(C)C)nc4C3)c12 ZINC001164812890 720230282 /nfs/dbraw/zinc/23/02/82/720230282.db2.gz JWRRMYQKLWLIPK-UHFFFAOYSA-N 1 1 426.952 3.399 20 0 IGADMO Cc1nc(CN2C(=O)CC[C@H]3[C@@H]2CCN3c2cc(OC3CC[NH+](C)CC3)ccn2)cs1 ZINC001164815139 720259832 /nfs/dbraw/zinc/25/98/32/720259832.db2.gz BBIVACZEUAHEJV-SFTDATJTSA-N 1 1 441.601 3.089 20 0 IGADMO CCOC(=O)c1c2ccccn2c2ncnc(N3CC[C@@H]4[C@H]3CC[N@H+]4Cc3cccnc3)c12 ZINC001164721746 720332095 /nfs/dbraw/zinc/33/20/95/720332095.db2.gz DGRDENDXLMIEGJ-RTBURBONSA-N 1 1 442.523 3.307 20 0 IGADMO CCOC(=O)c1c(Cl)nc(SC)nc1N1CC[C@@H]2[C@H]1CC[N@H+]2Cc1cccnc1 ZINC001164723080 720381976 /nfs/dbraw/zinc/38/19/76/720381976.db2.gz GADLNRDQOYGAFF-HUUCEWRRSA-N 1 1 433.965 3.277 20 0 IGADMO Fc1ccccc1Cn1cnc2c1ncnc2N1CC[C@@H]2[C@@H]1CC[N@H+]2Cc1cccnc1 ZINC001164731013 720402243 /nfs/dbraw/zinc/40/22/43/720402243.db2.gz XZVDWJWULUJWRW-RTWAWAEBSA-N 1 1 429.503 3.262 20 0 IGADMO Cc1cc2nc(N3CC[C@H]4[C@@H]3CC[N@H+]4Cc3cccnc3)nc(N3CCOCC3)c2s1 ZINC001164731003 720404000 /nfs/dbraw/zinc/40/40/00/720404000.db2.gz XWNIZTIDFGFTLJ-PMACEKPBSA-N 1 1 436.585 3.085 20 0 IGADMO FC(F)[C@](F)(COc1cncc(Cl)n1)N1CC[C@H]2[C@@H]1CC[N@@H+]2Cc1cccnc1 ZINC001164730163 720451611 /nfs/dbraw/zinc/45/16/11/720451611.db2.gz IDDHRZBATAYNOR-DOXZYTNZSA-N 1 1 427.858 3.184 20 0 IGADMO FC(F)[C@](F)(COc1cncc(Cl)n1)N1CC[C@H]2[C@@H]1CC[N@H+]2Cc1cccnc1 ZINC001164730163 720451617 /nfs/dbraw/zinc/45/16/17/720451617.db2.gz IDDHRZBATAYNOR-DOXZYTNZSA-N 1 1 427.858 3.184 20 0 IGADMO O=C(Nc1cccnc1)[C@]12CCO[C@@H]1CCN(c1nc(Cl)ccc1C[NH+]1CCCC1)C2 ZINC001164725803 720501581 /nfs/dbraw/zinc/50/15/81/720501581.db2.gz KLJJHWNJTXDVQM-XXBNENTESA-N 1 1 441.963 3.350 20 0 IGADMO CCOC(=O)c1cnc(N2CC[C@@H]3[C@@H](C[C@@H](Cn4cccn4)[N@H+]3C(C)C)C2)cc1OCC ZINC001164838431 720540206 /nfs/dbraw/zinc/54/02/06/720540206.db2.gz NUWXPCZFWBNCPO-IRFCIJBXSA-N 1 1 441.576 3.231 20 0 IGADMO CCOC(=O)c1cnc(N2CC[C@@H]3[C@@H](C[C@H](Cn4cccn4)[N@H+]3C(C)C)C2)cc1OCC ZINC001164838433 720540761 /nfs/dbraw/zinc/54/07/61/720540761.db2.gz NUWXPCZFWBNCPO-QKNQBKEWSA-N 1 1 441.576 3.231 20 0 IGADMO COc1nnc(Cl)cc1C(F)(F)N1CC[C@@H]2[C@@H](C[C@H](Cn3cccn3)[N@H+]2C(C)C)C1 ZINC001164843182 720645180 /nfs/dbraw/zinc/64/51/80/720645180.db2.gz UORUFZSPNYGZPE-ZMSDIMECSA-N 1 1 440.926 3.258 20 0 IGADMO CSc1ccc(C(F)(F)N2CC[N@@H+]3C[C@H](Oc4cncnc4)C[C@@H]3C2)nc1Cl ZINC001164739662 720713622 /nfs/dbraw/zinc/71/36/22/720713622.db2.gz OOGFNJLQSOOKGZ-CHWSQXEVSA-N 1 1 427.908 3.134 20 0 IGADMO CSc1ccc(C(F)(F)N2CC[N@H+]3C[C@H](Oc4cncnc4)C[C@@H]3C2)nc1Cl ZINC001164739662 720713632 /nfs/dbraw/zinc/71/36/32/720713632.db2.gz OOGFNJLQSOOKGZ-CHWSQXEVSA-N 1 1 427.908 3.134 20 0 IGADMO CSc1cnc(Cl)c(C(F)(F)N2CC[N@@H+]3C[C@H](Oc4cncnc4)C[C@@H]3C2)c1 ZINC001164744116 720749963 /nfs/dbraw/zinc/74/99/63/720749963.db2.gz REYHFDFWWFLQOL-CHWSQXEVSA-N 1 1 427.908 3.134 20 0 IGADMO CSc1cnc(Cl)c(C(F)(F)N2CC[N@H+]3C[C@H](Oc4cncnc4)C[C@@H]3C2)c1 ZINC001164744116 720749964 /nfs/dbraw/zinc/74/99/64/720749964.db2.gz REYHFDFWWFLQOL-CHWSQXEVSA-N 1 1 427.908 3.134 20 0 IGADMO c1ccc(Cc2nnc(N3CC[N@H+]4C[C@@H](Oc5cncnc5)C[C@H]4C3)c3ccccc23)cc1 ZINC001164742870 720753696 /nfs/dbraw/zinc/75/36/96/720753696.db2.gz OQSAQDWPZOIRPV-SFTDATJTSA-N 1 1 438.535 3.353 20 0 IGADMO Cc1nc2sc3c(c2c(N2CC[N@H+]4C[C@H](Oc5cncnc5)C[C@H]4C2)n1)CCCCC3 ZINC001164737454 720764855 /nfs/dbraw/zinc/76/48/55/720764855.db2.gz BTNAOIVIGFNBPN-DLBZAZTESA-N 1 1 436.585 3.401 20 0 IGADMO Cc1cccc(CN2CC[C@@]3(CCN(c4cc(OC5CC[NH+](C)CC5)ccn4)C3)C2=O)c1 ZINC001164852398 720808382 /nfs/dbraw/zinc/80/83/82/720808382.db2.gz NLNMPBOZIHLJPI-SANMLTNESA-N 1 1 434.584 3.492 20 0 IGADMO Fc1ccc2nc(Cl)nc(N3CC[C@@H]4[C@@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)c2c1 ZINC001164745456 720814696 /nfs/dbraw/zinc/81/46/96/720814696.db2.gz KKCQGVPJKVKGFV-XAUMDUMWSA-N 1 1 441.942 3.393 20 0 IGADMO c1ncn(C[C@H]2C[C@H]3CN(c4cc(Oc5ccccc5)ncn4)CC[C@H]3[N@H+]2CC2CC2)n1 ZINC001164741307 720816902 /nfs/dbraw/zinc/81/69/02/720816902.db2.gz NJZKLTPKYAVKNJ-TUNNFDKTSA-N 1 1 431.544 3.240 20 0 IGADMO Fc1cccc2nc(Cl)nc(N3CC[C@@H]4[C@@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)c12 ZINC001164746268 720822238 /nfs/dbraw/zinc/82/22/38/720822238.db2.gz YSULPUPZRMLIMO-TXPKVOOTSA-N 1 1 441.942 3.393 20 0 IGADMO Fc1ccc(-c2ccnc(N3CC[C@@H]4[C@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)n2)cc1 ZINC001164742673 720826264 /nfs/dbraw/zinc/82/62/64/720826264.db2.gz QKWRQZXFVNRMPG-KJXAQDMKSA-N 1 1 433.535 3.254 20 0 IGADMO Clc1nc2c(c(N3CC[C@@H]4[C@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)n1)CCCCC2 ZINC001164740779 720826272 /nfs/dbraw/zinc/82/62/72/720826272.db2.gz LGELSFSYUGWWOD-DBXWQHBBSA-N 1 1 442.011 3.370 20 0 IGADMO Cc1nc2c(nc(Cl)nc2N2CC[C@@H]3[C@H](C[C@@H](Cn4cncn4)[N@H+]3CC3CC3)C2)s1 ZINC001164743556 720832756 /nfs/dbraw/zinc/83/27/56/720832756.db2.gz JBXDWQQNDOPPPL-OWCLPIDISA-N 1 1 444.996 3.019 20 0 IGADMO COCC[N@H+]1CCO[C@H]2CN(C(F)(F)c3ccc4c(Cl)ncnc4c3)CC[C@@H]2C1 ZINC001164857079 720840507 /nfs/dbraw/zinc/84/05/07/720840507.db2.gz XFCGGHHUSMBXHF-KDOFPFPSSA-N 1 1 426.895 3.002 20 0 IGADMO CC(C)(C)c1cc(Cl)nc(N2CC[C@@H]3[C@@H](C[C@@H](Cn4cncn4)[N@H+]3CC3CC3)C2)n1 ZINC001164742544 720842642 /nfs/dbraw/zinc/84/26/42/720842642.db2.gz HLAOZXWGFLQYSR-OKZBNKHCSA-N 1 1 430.000 3.398 20 0 IGADMO COc1ccc(-c2ccc(N3CC[C@@H]4[C@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)nn2)cc1 ZINC001164745157 720846436 /nfs/dbraw/zinc/84/64/36/720846436.db2.gz LWFDSCZXVQFHRZ-ZFGGDYGUSA-N 1 1 445.571 3.123 20 0 IGADMO c1ncn(C[C@@H]2C[C@@H]3CN(c4ncnc5sc6c(c54)CCC6)CC[C@H]3[N@H+]2CC2CC2)n1 ZINC001164740537 720846564 /nfs/dbraw/zinc/84/65/64/720846564.db2.gz CHRWTJXHYAPTIM-ZIFCJYIRSA-N 1 1 435.601 3.151 20 0 IGADMO COc1cc2cnc(N3CC[C@@H]4[C@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)cc2cc1OC ZINC001164745848 720850235 /nfs/dbraw/zinc/85/02/35/720850235.db2.gz NRNAEIZNCDGWHK-YPAWHYETSA-N 1 1 448.571 3.223 20 0 IGADMO COc1ccccc1-c1cc(N2CC[C@@H]3[C@@H](C[C@@H](Cn4cncn4)[N@H+]3CC3CC3)C2)ncn1 ZINC001164748784 720850248 /nfs/dbraw/zinc/85/02/48/720850248.db2.gz UXHSSUIANOWOFH-SXWKCWPCSA-N 1 1 445.571 3.123 20 0 IGADMO Fc1cc2ncc(Cl)nc2cc1N1CC[C@@H]2[C@H](C[C@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164744638 720851083 /nfs/dbraw/zinc/85/10/83/720851083.db2.gz LABSMUIOUUJJRN-JXXFODFXSA-N 1 1 441.942 3.393 20 0 IGADMO Fc1ccccc1-c1ccc(N2CC[C@@H]3[C@@H](C[C@@H](Cn4cncn4)[N@H+]3CC3CC3)C2)nn1 ZINC001164752673 720852196 /nfs/dbraw/zinc/85/21/96/720852196.db2.gz UEGMMYHALFWWDG-SFYKDHMMSA-N 1 1 433.535 3.254 20 0 IGADMO c1cncc(COC[C@H]2C[N@@H+](CC3CC3)C[C@]23CCN(c2ncnc4cccnc42)C3)c1 ZINC001164749031 720876524 /nfs/dbraw/zinc/87/65/24/720876524.db2.gz GHRQNWYHMDCNMQ-BWKNWUBXSA-N 1 1 430.556 3.175 20 0 IGADMO COC(=O)c1cccnc1N1CC[C@]2(C1)C[N@@H+](CC1CC1)C[C@H]2COCc1cccnc1 ZINC001164754815 720877230 /nfs/dbraw/zinc/87/72/30/720877230.db2.gz SPERJGGXXDJWGW-SQJMNOBHSA-N 1 1 436.556 3.018 20 0 IGADMO COCC[N@H+]1CCO[C@@H]2CN(C(F)(F)c3cc(-c4ccco4)nnc3Cl)CC[C@H]2C1 ZINC001164860768 720877916 /nfs/dbraw/zinc/87/79/16/720877916.db2.gz PCPQHEOLAYVLCX-KBXCAEBGSA-N 1 1 442.894 3.108 20 0 IGADMO COCC[N@H+]1CCO[C@H]2CN(C(F)(F)c3cccc4c(Cl)ncnc43)CC[C@@H]2C1 ZINC001164864269 720878454 /nfs/dbraw/zinc/87/84/54/720878454.db2.gz VHNXSEUZWCCCIK-PBHICJAKSA-N 1 1 426.895 3.002 20 0 IGADMO COCC[N@H+]1CCO[C@@H]2CN(c3nc(C(F)F)nc4ccc(Cl)cc43)CC[C@H]2C1 ZINC001164860823 720886058 /nfs/dbraw/zinc/88/60/58/720886058.db2.gz PEOORESARNYKGB-SUMWQHHRSA-N 1 1 426.895 3.394 20 0 IGADMO COCC[N@H+]1CCO[C@@H]2CN(C(F)(F)c3ccc(Cl)nc3C(F)(F)F)CC[C@@H]2C1 ZINC001164855847 720886216 /nfs/dbraw/zinc/88/62/16/720886216.db2.gz HZITWNDELJANFS-TZMCWYRMSA-N 1 1 443.844 3.472 20 0 IGADMO Fc1cc(Cl)nnc1N1CC[C@@]2(C1)C[N@@H+](CC1CC1)C[C@@H]2COCc1cccnc1 ZINC001164749983 720890531 /nfs/dbraw/zinc/89/05/31/720890531.db2.gz BGPFFUGNMVIFBQ-GCJKJVERSA-N 1 1 431.943 3.419 20 0 IGADMO CCC[N@H+]1CCCC[C@H]1c1ccc(N2CCCn3c(=O)cc(Cn4ccnc4)nc3C2)nc1 ZINC001164858607 720896785 /nfs/dbraw/zinc/89/67/85/720896785.db2.gz MLTFKRKRLSSBBM-QFIPXVFZSA-N 1 1 447.587 3.230 20 0 IGADMO Nc1cc(Cl)ncc1N1CC[C@@]2(C1)C[N@@H+](CC1CC1)C[C@@H]2COCc1cccnc1 ZINC001164754688 720905960 /nfs/dbraw/zinc/90/59/60/720905960.db2.gz XIVAYKBSJFSSNQ-XXBNENTESA-N 1 1 427.980 3.467 20 0 IGADMO CCC[C@@H](C)NS(=O)(=O)c1ccc(N2CCn3c(C[N@@H+](C)C(C)C)cnc3[C@H]2C)nc1 ZINC001164863543 721006243 /nfs/dbraw/zinc/00/62/43/721006243.db2.gz WBVXGOVNPCDAGV-QZTJIDSGSA-N 1 1 448.637 3.166 20 0 IGADMO CC(C)(c1ccnc(Cl)c1)[N@H+]1CC[C@@H]2OCC[C@H](C(=O)NCc3ccccn3)[C@H]2C1 ZINC001164760084 721023382 /nfs/dbraw/zinc/02/33/82/721023382.db2.gz NUGJHBREKKCZRS-ZCNNSNEGSA-N 1 1 428.964 3.409 20 0 IGADMO FC(F)(c1cccc2c(Cl)ncnc21)N1CCc2[nH+]cc(Cn3cccn3)n2CC1 ZINC001164864050 721033395 /nfs/dbraw/zinc/03/33/95/721033395.db2.gz WVXGUIQFSNQPAN-UHFFFAOYSA-N 1 1 429.862 3.332 20 0 IGADMO CCOC(=O)c1cc2c(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@@H]4C3)[nH]c(C)c(C)c-2n1 ZINC001164866353 721107216 /nfs/dbraw/zinc/10/72/16/721107216.db2.gz SOGMCKSRYSZVFC-WOJBJXKFSA-N 1 1 449.555 3.231 20 0 IGADMO FC(F)(c1c2c(nnc1Cl)CCC2)N1CC[N@H+]2C[C@@H](OCc3cccnc3)C[C@@H]2C1 ZINC001164881191 721149978 /nfs/dbraw/zinc/14/99/78/721149978.db2.gz ZRENJIWJKVWUGD-CVEARBPZSA-N 1 1 435.906 3.038 20 0 IGADMO O=C(OCc1ccccc1)c1ccc(N2CC[N@H+]3C[C@H](OCc4cccnc4)C[C@H]3C2)nc1 ZINC001164871101 721155922 /nfs/dbraw/zinc/15/59/22/721155922.db2.gz DRFMRZANGYRYOT-BJKOFHAPSA-N 1 1 444.535 3.313 20 0 IGADMO COc1ccc(-c2ccc(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@@H]4C3)nn2)c(OC)c1 ZINC001164879103 721161912 /nfs/dbraw/zinc/16/19/12/721161912.db2.gz RTSRKVBWWNGCIH-CTNGQTDRSA-N 1 1 447.539 3.036 20 0 IGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4ncc(C(=O)N5CCCCC5)cc4Cl)C[C@H]3C2)cn1 ZINC001164761970 721206970 /nfs/dbraw/zinc/20/69/70/721206970.db2.gz BGYNKDUXRFZCDW-AZUAARDMSA-N 1 1 442.995 3.053 20 0 IGADMO COC(=O)/C=C/c1ccc(NC(=O)C(C)(C)C)c(N2CC3(C2)CC[N@@H+](CC2CC2)C3)n1 ZINC001164767926 721293818 /nfs/dbraw/zinc/29/38/18/721293818.db2.gz CCDWUDYQVAHZBB-CSKARUKUSA-N 1 1 426.561 3.175 20 0 IGADMO Cc1sc2nc(CN3CCOCC3)nc(N3CC4(C3)CC[N@@H+](CC3CC3)C4)c2c1C ZINC001164769708 721298021 /nfs/dbraw/zinc/29/80/21/721298021.db2.gz MHZPOKZHCLXLBH-UHFFFAOYSA-N 1 1 427.618 3.062 20 0 IGADMO O=S(=O)(c1ccccc1)N1C[C@@H]2CN(c3nc(Cl)ccc3C[NH+]3CCCC3)C[C@H]2C1 ZINC001164878273 721307795 /nfs/dbraw/zinc/30/77/95/721307795.db2.gz KPHPKNDIAIJFCU-OALUTQOASA-N 1 1 447.004 3.088 20 0 IGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2C[C@H]3CN(S(=O)(=O)c4ccccc4)C[C@@H]3C2)nc1 ZINC001164877325 721309628 /nfs/dbraw/zinc/30/96/28/721309628.db2.gz IKGZPEXRIUDCNV-QNWVGRARSA-N 1 1 440.613 3.385 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@@]2(CCCN(c3ncc(C)c(NC(C)C)n3)C2)C1 ZINC001164777370 721330348 /nfs/dbraw/zinc/33/03/48/721330348.db2.gz MMFUWBJQYFPCFY-QHCPKHFHSA-N 1 1 428.581 3.329 20 0 IGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@@]2(CCCN(c3ncc(C)c(NC(C)C)n3)C2)C1 ZINC001164777370 721330351 /nfs/dbraw/zinc/33/03/51/721330351.db2.gz MMFUWBJQYFPCFY-QHCPKHFHSA-N 1 1 428.581 3.329 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@@]2(CCCN(c3ncnc4cc(F)ccc43)C2)C1 ZINC001164778403 721336678 /nfs/dbraw/zinc/33/66/78/721336678.db2.gz VKFYWLWIRRQTRV-QHCPKHFHSA-N 1 1 425.508 3.493 20 0 IGADMO COc1ccc2ncnc(N3CCC[C@@]4(C3)COCC[N@@H+](Cc3c(C)noc3C)C4)c2c1 ZINC001164778211 721340365 /nfs/dbraw/zinc/34/03/65/721340365.db2.gz LDSWGWLFCRQHQU-XMMPIXPASA-N 1 1 437.544 3.362 20 0 IGADMO O=C1C[C@H]2[C@@H](CCN2c2ncnc3c2CC[N@H+](Cc2ccccc2)C3)N1c1ccsc1 ZINC001164883207 721355762 /nfs/dbraw/zinc/35/57/62/721355762.db2.gz ODFGCKFAKNYPQX-YADHBBJMSA-N 1 1 431.565 3.481 20 0 IGADMO O=C1C[C@H]2[C@@H](CCN2c2ncnc3c2CC[N@@H+](Cc2ccccc2)C3)N1c1ccsc1 ZINC001164883207 721355770 /nfs/dbraw/zinc/35/57/70/721355770.db2.gz ODFGCKFAKNYPQX-YADHBBJMSA-N 1 1 431.565 3.481 20 0 IGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@@]2(CCCN(c3cncc(N4CCCCC4)n3)C2)C1 ZINC001164786051 721360903 /nfs/dbraw/zinc/36/09/03/721360903.db2.gz VDUNFWWSEYUCDV-DEOSSOPVSA-N 1 1 440.592 3.191 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@@]2(CCCN(c3cncc(N4CCCCC4)n3)C2)C1 ZINC001164786051 721360908 /nfs/dbraw/zinc/36/09/08/721360908.db2.gz VDUNFWWSEYUCDV-DEOSSOPVSA-N 1 1 440.592 3.191 20 0 IGADMO Cc1noc(-c2cccnc2N2CCC[C@]3(C2)COCC[N@@H+](Cc2c(C)noc2C)C3)n1 ZINC001164781384 721366683 /nfs/dbraw/zinc/36/66/83/721366683.db2.gz IURCXGATXIBEMF-QHCPKHFHSA-N 1 1 438.532 3.164 20 0 IGADMO COc1cccc2ncnc(N3CCC[C@]4(C3)COCC[N@@H+](Cc3c(C)noc3C)C4)c21 ZINC001164786063 721367479 /nfs/dbraw/zinc/36/74/79/721367479.db2.gz VNXAGEPRHAKCEV-DEOSSOPVSA-N 1 1 437.544 3.362 20 0 IGADMO C[NH+]1CCN(C[C@H]2CCC[C@]3(CCN(c4nc(Cl)nc5ccc(F)cc54)C3)O2)CC1 ZINC001164891856 721388728 /nfs/dbraw/zinc/38/87/28/721388728.db2.gz QXUMQXJEQZZDFM-VGOFRKELSA-N 1 1 433.959 3.188 20 0 IGADMO O=C(c1cc(Cl)nc(N2C[C@@H]3C[N@@H+](Cc4nccs4)C[C@@H]3C2)c1)N1CCCCC1 ZINC001164781632 721398369 /nfs/dbraw/zinc/39/83/69/721398369.db2.gz CIOHDZPVBQLDHM-CALCHBBNSA-N 1 1 431.993 3.386 20 0 IGADMO O=C(c1cc(Cl)nc(N2C[C@@H]3C[N@H+](Cc4nccs4)C[C@@H]3C2)c1)N1CCCCC1 ZINC001164781632 721398372 /nfs/dbraw/zinc/39/83/72/721398372.db2.gz CIOHDZPVBQLDHM-CALCHBBNSA-N 1 1 431.993 3.386 20 0 IGADMO Cc1ccc2nc(N3CC[C@@]4(C3)CCC[C@H](CN3CC[NH+](C)CC3)O4)c(Cl)nc2c1 ZINC001164888941 721406723 /nfs/dbraw/zinc/40/67/23/721406723.db2.gz PPXXNKVIJOYHOZ-WZONZLPQSA-N 1 1 429.996 3.357 20 0 IGADMO C[NH+]1CCN(C[C@H]2CCC[C@]3(CCN(C(F)(F)c4nc(Cl)ccc4F)C3)O2)CC1 ZINC001164885141 721409414 /nfs/dbraw/zinc/40/94/14/721409414.db2.gz FWUPUDRSKKNCDY-DNVCBOLYSA-N 1 1 432.918 3.184 20 0 IGADMO Cc1ccc2c(c1)nc(Cl)nc2N1CC[C@]2(C1)CCC[C@@H](CN1CC[NH+](C)CC1)O2 ZINC001164885212 721412707 /nfs/dbraw/zinc/41/27/07/721412707.db2.gz GGJDVIQXUDTYFW-MBSDFSHPSA-N 1 1 429.996 3.357 20 0 IGADMO COc1cc2c(cc1Cl)ncnc2N1CC[C@]2(C1)CCC[C@H](CN1CC[NH+](C)CC1)O2 ZINC001164886581 721413015 /nfs/dbraw/zinc/41/30/15/721413015.db2.gz KGOOIEZBTMZDFN-HXOBKFHXSA-N 1 1 445.995 3.057 20 0 IGADMO C[NH+]1CCN(C[C@@H]2CCC[C@@]3(CCN(c4cncc(Oc5cccc(F)c5)n4)C3)O2)CC1 ZINC001164889600 721424427 /nfs/dbraw/zinc/42/44/27/721424427.db2.gz CFZOIDYCJVTVCU-URXFXBBRSA-N 1 1 441.551 3.173 20 0 IGADMO O=C(c1cnc(N2C[C@@H]3C[NH+](Cc4nccs4)C[C@H]3C2)c(Cl)c1)N1CCCCC1 ZINC001164782552 721428453 /nfs/dbraw/zinc/42/84/53/721428453.db2.gz GPPKFZPRNHRRLM-IRXDYDNUSA-N 1 1 431.993 3.386 20 0 IGADMO C[NH+]1CCN(C[C@@H]2CCC[C@]3(CCN(c4nc(C(F)F)nc5ccccc54)C3)O2)CC1 ZINC001164893012 721439705 /nfs/dbraw/zinc/43/97/05/721439705.db2.gz IQSBURAHFNOYAS-GAJHUEQPSA-N 1 1 431.531 3.333 20 0 IGADMO C[NH+]1CCN(C[C@H]2CCC[C@]3(CCN(c4nc(C(F)F)nc5ccc(F)cc54)C3)O2)CC1 ZINC001164894339 721445568 /nfs/dbraw/zinc/44/55/68/721445568.db2.gz LSUKNKVQLYYNDO-UZUQRXQVSA-N 1 1 449.521 3.472 20 0 IGADMO CCOC(=O)c1ccc(C)c(N2CCC3(C[C@@H](COCC4CC4)[N@@H+](CCOC)C3)CC2)n1 ZINC001164786705 721448218 /nfs/dbraw/zinc/44/82/18/721448218.db2.gz NIJWYPWATOMUDF-NRFANRHFSA-N 1 1 445.604 3.301 20 0 IGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1ccc(N3CCCCC3)nn1)CC2 ZINC001164785201 721448437 /nfs/dbraw/zinc/44/84/37/721448437.db2.gz HECVCDLJDBJFOT-JOCHJYFZSA-N 1 1 443.636 3.201 20 0 IGADMO C[NH+]1CCN(C[C@@H]2CCC[C@]3(CCN(c4c(F)ccc5c(Cl)ncnc54)C3)O2)CC1 ZINC001164891645 721451507 /nfs/dbraw/zinc/45/15/07/721451507.db2.gz VDEUEHNTJAXGBK-KSFYIVLOSA-N 1 1 433.959 3.188 20 0 IGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1nc(Cl)nc3cnccc31)CC2 ZINC001164790452 721455849 /nfs/dbraw/zinc/45/58/49/721455849.db2.gz ZCBVXYYDNCSRLA-GOSISDBHSA-N 1 1 445.995 3.412 20 0 IGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1nc3ncccc3nc1Cl)CC2 ZINC001164783848 721459649 /nfs/dbraw/zinc/45/96/49/721459649.db2.gz GDYUEWHLQYWYOS-GOSISDBHSA-N 1 1 445.995 3.412 20 0 IGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1ncc3cc(OC)ccc3n1)CC2 ZINC001164790027 721460998 /nfs/dbraw/zinc/46/09/98/721460998.db2.gz ZBFHURPCYYNYLU-NRFANRHFSA-N 1 1 440.588 3.372 20 0 IGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2CC[C@@H]3OCC[C@@H](C(=O)N4CCCO4)[C@@H]3C2)nc1 ZINC001164791897 721482976 /nfs/dbraw/zinc/48/29/76/721482976.db2.gz KLKUDNURTRSWKJ-MBDNFAEBSA-N 1 1 428.577 3.024 20 0 IGADMO Fc1cccnc1OC[C@]12COC[C@H]1CN(c1nc(Cl)ccc1C[NH+]1CCCC1)C2 ZINC001164793360 721486871 /nfs/dbraw/zinc/48/68/71/721486871.db2.gz QTMYMBNQYNJZKU-VGSWGCGISA-N 1 1 432.927 3.397 20 0 IGADMO CCOC(=O)c1nc2ccccc2c(N2CC[N@H+]3C[C@@H](Oc4cccc(F)c4)C[C@@H]3C2)n1 ZINC001164900065 721514200 /nfs/dbraw/zinc/51/42/00/721514200.db2.gz NRPHPFZUFYMFTO-MJGOQNOKSA-N 1 1 436.487 3.288 20 0 IGADMO CN(C)c1cc(Cl)nc(C(F)(F)N2CC[N@H+]3C[C@H](Oc4cccc(F)c4)C[C@H]3C2)n1 ZINC001164901453 721518644 /nfs/dbraw/zinc/51/86/44/721518644.db2.gz XPALCKOYFMMGOB-GOEBONIOSA-N 1 1 441.885 3.222 20 0 IGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2nc(Cl)nc(-c3ccccc3)n2)[C@@H]2CCCO[C@H]21 ZINC001164803022 721545391 /nfs/dbraw/zinc/54/53/91/721545391.db2.gz HKYQMCWCTSCWIE-VAMGGRTRSA-N 1 1 436.947 3.455 20 0 IGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2nc(Cl)nc(-c3ccccc3)n2)[C@@H]2CCCO[C@H]21 ZINC001164803022 721545397 /nfs/dbraw/zinc/54/53/97/721545397.db2.gz HKYQMCWCTSCWIE-VAMGGRTRSA-N 1 1 436.947 3.455 20 0 IGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2nc(Cl)nc(-c3ccccc3)n2)[C@H]2CCCO[C@H]12 ZINC001164803025 721545482 /nfs/dbraw/zinc/54/54/82/721545482.db2.gz HKYQMCWCTSCWIE-ZCNNSNEGSA-N 1 1 436.947 3.455 20 0 IGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2nc(Cl)nc(-c3ccccc3)n2)[C@H]2CCCO[C@H]12 ZINC001164803025 721545486 /nfs/dbraw/zinc/54/54/86/721545486.db2.gz HKYQMCWCTSCWIE-ZCNNSNEGSA-N 1 1 436.947 3.455 20 0 IGADMO COC(=O)c1c(Cl)cnc(N2CC[N@H+]3C[C@@H](Oc4cccc(F)c4)C[C@@H]3C2)c1OC ZINC001164909356 721549371 /nfs/dbraw/zinc/54/93/71/721549371.db2.gz RQWZRFPKQKMYAX-ZBFHGGJFSA-N 1 1 435.883 3.011 20 0 IGADMO COC(=O)c1nc(Cl)c(N2CC[N@@H+]3C[C@H](Oc4cccc(F)c4)C[C@H]3C2)c(Cl)n1 ZINC001164906088 721566186 /nfs/dbraw/zinc/56/61/86/721566186.db2.gz ITWUUAUFPWXDOA-GXTWGEPZSA-N 1 1 441.290 3.051 20 0 IGADMO COC(=O)c1nc(Cl)c(N2CC[N@H+]3C[C@H](Oc4cccc(F)c4)C[C@H]3C2)c(Cl)n1 ZINC001164906088 721566190 /nfs/dbraw/zinc/56/61/90/721566190.db2.gz ITWUUAUFPWXDOA-GXTWGEPZSA-N 1 1 441.290 3.051 20 0 IGADMO COC(=O)/C=C\c1cc2cc[nH]c2c(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@@H]32)n1 ZINC001164806692 721570893 /nfs/dbraw/zinc/57/08/93/721570893.db2.gz QUGQYZXJYKDGJY-MZBHBBFKSA-N 1 1 447.539 3.012 20 0 IGADMO COC(=O)c1cc(Cl)nc(N2CCC(F)(F)[C@]3(CC[N@@H+](Cc4ccccn4)C3)C2)n1 ZINC001164905610 721584668 /nfs/dbraw/zinc/58/46/68/721584668.db2.gz KCGJCTSRNLEKHP-IBGZPJMESA-N 1 1 437.878 3.049 20 0 IGADMO Cc1nc(-c2ccncc2)nc(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@H]3OCCC[C@H]32)c1C ZINC001164811989 721585232 /nfs/dbraw/zinc/58/52/32/721585232.db2.gz ZGNLKRQFFIHOPY-VJBWXMMDSA-N 1 1 430.556 3.419 20 0 IGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2nc(Cl)cc(-c3ccncc3)n2)[C@H]2CCCO[C@H]12 ZINC001164802589 721589100 /nfs/dbraw/zinc/58/91/00/721589100.db2.gz GXMYOWHKODPVCN-VWPQPMDRSA-N 1 1 436.947 3.455 20 0 IGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2nc(Cl)cc(-c3ccncc3)n2)[C@H]2CCCO[C@H]12 ZINC001164802589 721589102 /nfs/dbraw/zinc/58/91/02/721589102.db2.gz GXMYOWHKODPVCN-VWPQPMDRSA-N 1 1 436.947 3.455 20 0 IGADMO CCCSc1ncnc(N2C[C@H]([N@H+](C)Cc3cccnc3)[C@H]3OCCC[C@H]32)c1OC ZINC001164810818 721590981 /nfs/dbraw/zinc/59/09/81/721590981.db2.gz WGKVDRDBXXESOX-QYZOEREBSA-N 1 1 429.590 3.251 20 0 IGADMO CCCSc1ncnc(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@H]3OCCC[C@H]32)c1OC ZINC001164810818 721590982 /nfs/dbraw/zinc/59/09/82/721590982.db2.gz WGKVDRDBXXESOX-QYZOEREBSA-N 1 1 429.590 3.251 20 0 IGADMO C[C@@H]1CN(c2ccc(C[N@@H+](C)C3CC3)cn2)CC[C@]12CC[C@H](C(=O)Nc1cccnc1)O2 ZINC001165010745 721691708 /nfs/dbraw/zinc/69/17/08/721691708.db2.gz WUMZIWRITIXZCK-YBGOQADZSA-N 1 1 435.572 3.474 20 0 IGADMO COC(=O)c1cc2c[nH]c(N3CCC(F)(F)[C@@]4(CC[N@@H+](Cc5ccccn5)C4)C3)cc-2n1 ZINC001164907423 721718361 /nfs/dbraw/zinc/71/83/61/721718361.db2.gz RXKTYDBPJQOMSU-JOCHJYFZSA-N 1 1 441.482 3.482 20 0 IGADMO COC(=O)c1cnc(Cl)nc1N1CCc2c(C[N@H+](C)Cc3ccco3)cncc2C1 ZINC001164909362 721746158 /nfs/dbraw/zinc/74/61/58/721746158.db2.gz PMJLZSAGGCTGFL-UHFFFAOYSA-N 1 1 427.892 3.099 20 0 IGADMO COC(=O)c1cnc(Cl)nc1N1CCc2c(C[N@@H+](C)Cc3ccco3)cncc2C1 ZINC001164909362 721746168 /nfs/dbraw/zinc/74/61/68/721746168.db2.gz PMJLZSAGGCTGFL-UHFFFAOYSA-N 1 1 427.892 3.099 20 0 IGADMO CCc1cc(N2CCc3c(CN(C)Cc4ccco4)cncc3C2)nc(N2CCOCC2)[nH+]1 ZINC001164909556 721758325 /nfs/dbraw/zinc/75/83/25/721758325.db2.gz HVXSWCWMOJCYRF-UHFFFAOYSA-N 1 1 448.571 3.058 20 0 IGADMO C[N@H+](Cc1ccco1)Cc1cncc2c1CCN(c1ccc(C(=O)NC3CCCC3)nn1)C2 ZINC001164912555 721762726 /nfs/dbraw/zinc/76/27/26/721762726.db2.gz ZPJQTPQEVMELAB-UHFFFAOYSA-N 1 1 446.555 3.332 20 0 IGADMO C[N@@H+](Cc1ccco1)Cc1cncc2c1CCN(c1ccc(C(=O)NC3CCCC3)nn1)C2 ZINC001164912555 721762728 /nfs/dbraw/zinc/76/27/28/721762728.db2.gz ZPJQTPQEVMELAB-UHFFFAOYSA-N 1 1 446.555 3.332 20 0 IGADMO c1ccc(C[N@@H+]2CCc3c(ncnc3N3CC[C@]4(C[C@H](Oc5cccnc5)CO4)C3)C2)cc1 ZINC001164916515 721805649 /nfs/dbraw/zinc/80/56/49/721805649.db2.gz PSGRHXHPMJBBOA-NVQXNPDNSA-N 1 1 443.551 3.247 20 0 IGADMO c1ccc(C[N@H+]2CCc3c(ncnc3N3CC[C@]4(C[C@H](Oc5cccnc5)CO4)C3)C2)cc1 ZINC001164916515 721805652 /nfs/dbraw/zinc/80/56/52/721805652.db2.gz PSGRHXHPMJBBOA-NVQXNPDNSA-N 1 1 443.551 3.247 20 0 IGADMO CCOC(=O)Cc1nc(Cl)cc(N2C[C@@H]3CCC[C@@H]([N@@H+](C)Cc4ccccn4)[C@@H]3C2)n1 ZINC001165026510 721809912 /nfs/dbraw/zinc/80/99/12/721809912.db2.gz QXKJDEBNWDUNOH-QXAKKESOSA-N 1 1 443.979 3.368 20 0 IGADMO C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@@H]2CN(c3c(Cl)nc(Cl)nc3C(N)=O)C[C@@H]21 ZINC001165025238 721815540 /nfs/dbraw/zinc/81/55/40/721815540.db2.gz MAYKWRQJVYOVBP-VHDGCEQUSA-N 1 1 435.359 3.014 20 0 IGADMO CN(c1ncccn1)[C@H]1CO[C@]2(C1)CCCN(c1nc(Cl)ccc1C[NH+]1CCCC1)C2 ZINC001164925287 721836173 /nfs/dbraw/zinc/83/61/73/721836173.db2.gz ODZNCFRIFBIUAV-XXBNENTESA-N 1 1 442.995 3.385 20 0 IGADMO CN1C(=O)CC[C@H]2[C@H]1CCN2c1nc(C[NH+]2CCCCC2)nc2sc3c(c21)CCC3 ZINC001164934458 721893300 /nfs/dbraw/zinc/89/33/00/721893300.db2.gz PTNSBWDVWJUYOS-SJORKVTESA-N 1 1 425.602 3.365 20 0 IGADMO CN1C(=O)CC[C@@H]2[C@@H]1CCN2c1nc(C[NH+]2CCCCC2)nc2sc3c(c21)CCC3 ZINC001164934355 721893418 /nfs/dbraw/zinc/89/34/18/721893418.db2.gz PTNSBWDVWJUYOS-DLBZAZTESA-N 1 1 425.602 3.365 20 0 IGADMO C[C@H]1CCc2c(sc3nc(C[NH+]4CCCCC4)nc(N4CCN(C(N)=O)CC4)c32)C1 ZINC001165042276 721941233 /nfs/dbraw/zinc/94/12/33/721941233.db2.gz MBXOYTQOBODPMP-HNNXBMFYSA-N 1 1 428.606 3.003 20 0 IGADMO Cc1cc(Cl)nc(C(F)(F)N2CCC3(CC2)COCC[N@@H+](Cc2ccncc2)C3)n1 ZINC001164961946 722052463 /nfs/dbraw/zinc/05/24/63/722052463.db2.gz ZPDHEMCBJSZGFM-UHFFFAOYSA-N 1 1 437.922 3.497 20 0 IGADMO COc1cc(C)c2ncnc(N3CCC4(CC3)COCC[N@@H+](Cc3ccncc3)C4)c2c1 ZINC001164964395 722062799 /nfs/dbraw/zinc/06/27/99/722062799.db2.gz GECQNWTVUGIICV-UHFFFAOYSA-N 1 1 433.556 3.461 20 0 IGADMO CN(C)C(=O)N[C@@H]1c2ccccc2[C@H]2CN(c3cc(OC4CC[NH+](C)CC4)ccn3)C[C@H]21 ZINC001164985734 722098200 /nfs/dbraw/zinc/09/82/00/722098200.db2.gz WJPWRAKKTDXXMB-CQOQZXRMSA-N 1 1 435.572 3.101 20 0 IGADMO CCOC(=O)c1cc(Cl)nc(N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)c1 ZINC001164982846 722099300 /nfs/dbraw/zinc/09/93/00/722099300.db2.gz PJVARSORUXQIKZ-MJGOQNOKSA-N 1 1 430.936 3.034 20 0 IGADMO Clc1c[nH]c2nc(Cl)nc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)c12 ZINC001164986302 722100281 /nfs/dbraw/zinc/10/02/81/722100281.db2.gz YQBHIBLIDZPMEH-ZBFHGGJFSA-N 1 1 433.343 3.387 20 0 IGADMO CCOC(=O)c1c(Cl)cc(C)nc1N1CC[C@H]2C[N@@H+](Cc3cccnc3)CCO[C@H]2C1 ZINC001164985189 722101523 /nfs/dbraw/zinc/10/15/23/722101523.db2.gz VGSNFBJVUNWGMV-ICSRJNTNSA-N 1 1 444.963 3.342 20 0 IGADMO CCOC(=O)c1c(C)nc(Cl)cc1N1CC[C@H]2C[N@@H+](Cc3cccnc3)CCO[C@@H]2C1 ZINC001164983100 722109318 /nfs/dbraw/zinc/10/93/18/722109318.db2.gz YHCFXUZTSKJBQY-AZUAARDMSA-N 1 1 444.963 3.342 20 0 IGADMO Cc1nc(CN2CCO[C@@H]3CCN(c4cc[nH+]c(N5CCCCC5)n4)CC[C@@H]32)cs1 ZINC001164987014 722184972 /nfs/dbraw/zinc/18/49/72/722184972.db2.gz IESCFFHUIXTAIG-VQTJNVASSA-N 1 1 428.606 3.102 20 0 IGADMO CCOC(=O)c1nnc(SC)nc1N1CCC[C@]2(CC[N@H+]2Cc2cccc(F)c2)C1 ZINC001164995523 722196553 /nfs/dbraw/zinc/19/65/53/722196553.db2.gz VFOOHLLJDJEBKM-NRFANRHFSA-N 1 1 431.537 3.154 20 0 IGADMO Fc1cccc(C[N@H+]2CC[C@]23CCCN(c2nc(Cl)ncc2N2CCOCC2)C3)c1 ZINC001164994454 722200291 /nfs/dbraw/zinc/20/02/91/722200291.db2.gz HFTZPDHTSUISQC-QFIPXVFZSA-N 1 1 431.943 3.351 20 0 IGADMO C[NH+]1CCN(c2ncnc3c2CCN(C(F)(F)c2cnc(Cl)cc2Cl)CC3)CC1 ZINC001164998079 722229859 /nfs/dbraw/zinc/22/98/59/722229859.db2.gz WPDKISKJJQMIRA-UHFFFAOYSA-N 1 1 443.329 3.080 20 0 IGADMO CCOC(=O)c1cc2n(n1)CCCN(c1ccc3c(n1)CC[N@H+](Cc1ccccc1)C3)C2 ZINC001164408850 718866511 /nfs/dbraw/zinc/86/65/11/718866511.db2.gz NQMSYECBQLPNAS-UHFFFAOYSA-N 1 1 431.540 3.423 20 0 IGADMO CN1CCN(c2cccc(N(c3cccc(F)c3)[C@H]3CO[C@]4(C3)CCC[NH2+]C4)n2)CC1 ZINC001164646335 719297135 /nfs/dbraw/zinc/29/71/35/719297135.db2.gz AJTMALHGVZLCFJ-QPPBQGQZSA-N 1 1 425.552 3.022 20 0 IGADMO CN1CCN(c2cccc(N(c3cccc(F)c3)[C@H]3CO[C@@]4(C3)CCC[NH2+]C4)n2)CC1 ZINC001164646338 719297140 /nfs/dbraw/zinc/29/71/40/719297140.db2.gz AJTMALHGVZLCFJ-ZJSXRUAMSA-N 1 1 425.552 3.022 20 0 IGADMO O=C1CCCN1[C@@H]1CN(c2ccc3c(n2)CC[N@H+](Cc2ccccc2)C3)C[C@@H]2CCCO[C@@H]12 ZINC001164656901 719303047 /nfs/dbraw/zinc/30/30/47/719303047.db2.gz ZFCISXRNSWURBE-CAKYRVLISA-N 1 1 446.595 3.246 20 0 IGADMO COC(=O)c1cc(C(F)(F)N2CCc3c(C[NH+](C)C)nn(C(C)C)c3C2)cnc1Cl ZINC001164646176 719309250 /nfs/dbraw/zinc/30/92/50/719309250.db2.gz BWSYCZMIFOALBZ-UHFFFAOYSA-N 1 1 441.910 3.468 20 0 IGADMO COC(=O)c1cc2c(N3CCc4c(C[NH+](C)C)nn(C(C)C)c4C3)[nH]c(Cl)cc-2n1 ZINC001164652073 719313677 /nfs/dbraw/zinc/31/36/77/719313677.db2.gz MXFQVIFIEOGTST-UHFFFAOYSA-N 1 1 430.940 3.405 20 0 IGADMO CCC[N@H+]1CCCC[C@H]1c1ccc(N2CCc3onc(COCC(=O)N(C)C)c3C2)nc1 ZINC001164662180 719341470 /nfs/dbraw/zinc/34/14/70/719341470.db2.gz OITINIFJVVQTET-NRFANRHFSA-N 1 1 441.576 3.174 20 0 IGADMO Cc1nc2c(cc(-c3nc(N4C[C@H]5OCC[N@@H+](C)[C@@H]5C4)ncc3F)cc2F)n1C(C)C ZINC001164670242 719393943 /nfs/dbraw/zinc/39/39/43/719393943.db2.gz WIDSUCVLAKHECG-RTBURBONSA-N 1 1 428.487 3.180 20 0 IGADMO O=C([C@@H]1C[C@H]2OCC[C@@H]2N(c2ccc3c(n2)CC[N@H+](Cc2ccccc2)C3)C1)N1CCCC1 ZINC001164679227 719537265 /nfs/dbraw/zinc/53/72/65/719537265.db2.gz VZRPZQMEOQLXMD-PZUNEJSGSA-N 1 1 446.595 3.246 20 0 IGADMO CNC(=O)C[N@H+]1CCCC12CCN(c1ncnc3c1c(C)c(C)n3Cc1ccccc1)CC2 ZINC001164690297 719740507 /nfs/dbraw/zinc/74/05/07/719740507.db2.gz YVRCRHWSCIVWMT-UHFFFAOYSA-N 1 1 446.599 3.277 20 0 IGADMO CC(C)(c1ccnc(Cl)c1)[N@@H+]1CC[C@@H]2C[C@H](C(=O)NCCc3ccccn3)O[C@H]2C1 ZINC001164701394 719820685 /nfs/dbraw/zinc/82/06/85/719820685.db2.gz OVWRQDRZCNSGII-AHRSYUTCSA-N 1 1 428.964 3.203 20 0 IGADMO CC(C)(c1ccnc(Cl)c1)[N@H+]1CC[C@@H]2C[C@H](C(=O)NCCc3ccccn3)O[C@H]2C1 ZINC001164701394 719820686 /nfs/dbraw/zinc/82/06/86/719820686.db2.gz OVWRQDRZCNSGII-AHRSYUTCSA-N 1 1 428.964 3.203 20 0 IGADMO COC(=O)[C@]1(C)C[C@H]([NH+]2CCOCC2)CCN1c1ncnc2cc(C(C)(C)C)sc21 ZINC001164700833 719847027 /nfs/dbraw/zinc/84/70/27/719847027.db2.gz KYGONJJZFSVCRO-QRQCRPRQSA-N 1 1 432.590 3.222 20 0 IGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1ncccc1C(=O)NCc1ccccc1)C2 ZINC001164808454 720079312 /nfs/dbraw/zinc/07/93/12/720079312.db2.gz HKSJWVIZDICBAU-BKMJKUGQSA-N 1 1 434.584 3.196 20 0 IGADMO COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1ncc(OC)c(NC(C)C)n1)CC2 ZINC001164710176 720092988 /nfs/dbraw/zinc/09/29/88/720092988.db2.gz GRLHWKQZHCWVHO-FQEVSTJZSA-N 1 1 440.592 3.208 20 0 IGADMO COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1ncc(C(=O)OC)cc1Cl)CC2 ZINC001164711175 720093200 /nfs/dbraw/zinc/09/32/00/720093200.db2.gz OYUZZVXCHIWXAE-IBGZPJMESA-N 1 1 444.963 3.424 20 0 IGADMO COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1cc(C(=O)OC)c(Cl)cn1)CC2 ZINC001164711178 720098380 /nfs/dbraw/zinc/09/83/80/720098380.db2.gz OZHHEYUTYVTYID-GOSISDBHSA-N 1 1 444.963 3.424 20 0 IGADMO COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1c(C)nc(Cl)nc1OC)CC2 ZINC001164719574 720117526 /nfs/dbraw/zinc/11/75/26/720117526.db2.gz ZHEVHNCJJMLUBB-SFHVURJKSA-N 1 1 431.968 3.350 20 0 IGADMO COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1nc(Cl)cc(N(C)C)n1)CC2 ZINC001164719094 720122306 /nfs/dbraw/zinc/12/23/06/720122306.db2.gz VXIQCUCRYXCSOG-GOSISDBHSA-N 1 1 430.984 3.099 20 0 IGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1nc(Cl)ccc1C(=O)NC(C)(C)C)C2 ZINC001164814437 720127520 /nfs/dbraw/zinc/12/75/20/720127520.db2.gz SOALMGHIBGVTDO-GAJHUEQPSA-N 1 1 435.012 3.448 20 0 IGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(C(F)(F)c1ccc3ncnc(Cl)c3n1)C2 ZINC001164815512 720135791 /nfs/dbraw/zinc/13/57/91/720135791.db2.gz WCQCQXVWFGJCTO-YWZLYKJASA-N 1 1 437.922 3.408 20 0 IGADMO COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1ccc(-c3ccccn3)nn1)CC2 ZINC001164714396 720148688 /nfs/dbraw/zinc/14/86/88/720148688.db2.gz WVWXNVABNHKWOU-OAQYLSRUSA-N 1 1 430.556 3.441 20 0 IGADMO COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN([C@@H](F)Oc1cncc(Cl)n1)CC2 ZINC001164713094 720153096 /nfs/dbraw/zinc/15/30/96/720153096.db2.gz QOUSCMRQVQUXDI-YLJYHZDGSA-N 1 1 435.931 3.160 20 0 IGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(C(F)(F)c1cc(C(=O)OC)cnc1Cl)C2 ZINC001164819743 720155550 /nfs/dbraw/zinc/15/55/50/720155550.db2.gz XYKFVCPDNMXPHO-OXQOHEQNSA-N 1 1 443.922 3.251 20 0 IGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1cc([C@H](CC(=O)OC)C3CC3)ccn1)C2 ZINC001164817890 720158808 /nfs/dbraw/zinc/15/88/08/720158808.db2.gz QQYPQMRSSNGWGR-SGIRGMQISA-N 1 1 427.589 3.323 20 0 IGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1ccc(C(=O)N3CCC[C@@H](C)C3)cn1)C2 ZINC001164816382 720164658 /nfs/dbraw/zinc/16/46/58/720164658.db2.gz LDMPYAJUYVHOND-WPWBMXPQSA-N 1 1 426.605 3.138 20 0 IGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(C(F)(F)c1c3c(nnc1Cl)CCC3)C2 ZINC001164817152 720173107 /nfs/dbraw/zinc/17/31/07/720173107.db2.gz OGILFIGBAYVNKP-QRWLVFNGSA-N 1 1 426.939 3.348 20 0 IGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(C(F)(F)c1nc3ccc(Cl)nc3[nH]1)C2 ZINC001164820161 720176544 /nfs/dbraw/zinc/17/65/44/720176544.db2.gz ZSDOTNPMOGHTNK-LIRRHRJNSA-N 1 1 425.911 3.341 20 0 IGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1cc(C)nc(NC(=O)c3ccccc3)n1)C2 ZINC001164818400 720188901 /nfs/dbraw/zinc/18/89/01/720188901.db2.gz SLYXDXDXLZWPRP-PXDATVDWSA-N 1 1 435.572 3.222 20 0 IGADMO COc1cc2ccnc(N3CCCn4c(=O)cc(C[N@@H+](C)C(C)C)nc4C3)c2cc1OC ZINC001164812119 720225051 /nfs/dbraw/zinc/22/50/51/720225051.db2.gz DROUZNAZESTGFY-UHFFFAOYSA-N 1 1 437.544 3.059 20 0 IGADMO Cc1c(Cl)nc(CC(C)C)nc1N1CCCn2c(=O)cc(C[N@@H+](C)C(C)C)nc2C1 ZINC001164816935 720243341 /nfs/dbraw/zinc/24/33/41/720243341.db2.gz NYPAXUZKGUVTQT-UHFFFAOYSA-N 1 1 433.000 3.444 20 0 IGADMO c1ccc(N2CCN(c3ccc(N4CC[C@@H]5[C@H]4CC[N@@H+]5Cc4cccnc4)nn3)CC2)cc1 ZINC001164729301 720441998 /nfs/dbraw/zinc/44/19/98/720441998.db2.gz GVDHVYHXWRZGIG-DNQXCXABSA-N 1 1 441.583 3.051 20 0 IGADMO COc1ccc(-c2ccc(N3CC[C@@H]4[C@@H]3CC[N@H+]4Cc3cccnc3)nn2)c(OC)c1OC ZINC001164728902 720465605 /nfs/dbraw/zinc/46/56/05/720465605.db2.gz PKDWRFZMYCYYMD-RTWAWAEBSA-N 1 1 447.539 3.418 20 0 IGADMO COc1ccc(CN(C)c2ccnc(N3CC[C@H]4[C@H]3CC[N@H+]4Cc3cccnc3)n2)cc1 ZINC001164728958 720470511 /nfs/dbraw/zinc/47/05/11/720470511.db2.gz QAHMQCXJLFPVDM-XZOQPEGZSA-N 1 1 430.556 3.370 20 0 IGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@H]2CN(c3ncccc3C(=O)N3CCCCC3)CC[C@@H]21 ZINC001164832942 720512093 /nfs/dbraw/zinc/51/20/93/720512093.db2.gz CBQNSXXGFDIGDE-FUDKSRODSA-N 1 1 436.604 3.282 20 0 IGADMO CC(C)[N@@H+]1[C@@H]2CCN(c3ncccc3C(=O)N3CCCCC3)C[C@@H]2C[C@H]1Cn1cccn1 ZINC001164832947 720512236 /nfs/dbraw/zinc/51/22/36/720512236.db2.gz CBQNSXXGFDIGDE-QNWVGRARSA-N 1 1 436.604 3.282 20 0 IGADMO CCOC(=O)c1cc2cccnc2nc1N1CC[C@@H]2[C@@H](C[C@@H](Cn3cccn3)[N@H+]2C(C)C)C1 ZINC001164835054 720541554 /nfs/dbraw/zinc/54/15/54/720541554.db2.gz GVEYJVJLZVWRDJ-JAXLGGSGSA-N 1 1 448.571 3.381 20 0 IGADMO C[NH+]1CCC(Oc2ccnc(N3CCO[C@]4(CCC[C@@H]4COc4ccccn4)C3)c2)CC1 ZINC001164734301 720541933 /nfs/dbraw/zinc/54/19/33/720541933.db2.gz HSYIAHKMKHVPTN-CJFMBICVSA-N 1 1 438.572 3.404 20 0 IGADMO CC(C)[N@@H+]1[C@@H]2CCN(C(F)(F)Oc3cnc(Cl)cn3)C[C@H]2C[C@H]1Cn1cccn1 ZINC001164842442 720648563 /nfs/dbraw/zinc/64/85/63/720648563.db2.gz RQBMZLWPDSKNMD-OWCLPIDISA-N 1 1 426.899 3.129 20 0 IGADMO C[C@@H]1CCCCN1c1nc2ccccc2nc1N1CC[N@H+]2C[C@H](Oc3cncnc3)C[C@H]2C1 ZINC001164740448 720760282 /nfs/dbraw/zinc/76/02/82/720760282.db2.gz LERCUOKJVHZKBG-HSALFYBXSA-N 1 1 445.571 3.141 20 0 IGADMO Cc1nc2sc3c(c2c(N2CC[N@H+]4C[C@H](Oc5cncnc5)C[C@@H]4C2)n1)CCCCC3 ZINC001164737455 720765462 /nfs/dbraw/zinc/76/54/62/720765462.db2.gz BTNAOIVIGFNBPN-IAGOWNOFSA-N 1 1 436.585 3.401 20 0 IGADMO FC(F)(c1cc(-c2ccco2)nnc1Cl)N1CC[N@@H+]2C[C@@H](Oc3cncnc3)C[C@@H]2C1 ZINC001164741135 720769595 /nfs/dbraw/zinc/76/95/95/720769595.db2.gz MJBOBIXBWAIXPE-KGLIPLIRSA-N 1 1 448.861 3.067 20 0 IGADMO FC(F)(c1cc(-c2ccco2)nnc1Cl)N1CC[N@H+]2C[C@@H](Oc3cncnc3)C[C@@H]2C1 ZINC001164741135 720769600 /nfs/dbraw/zinc/76/96/00/720769600.db2.gz MJBOBIXBWAIXPE-KGLIPLIRSA-N 1 1 448.861 3.067 20 0 IGADMO COc1cc2c(cc1F)cc(Cl)nc2N1CC[N@H+]2C[C@H](Oc3cncnc3)C[C@H]2C1 ZINC001164748237 720807305 /nfs/dbraw/zinc/80/73/05/720807305.db2.gz QCFMPXVWWZCYEM-LSDHHAIUSA-N 1 1 429.883 3.168 20 0 IGADMO CSc1nc2sccc2c(N2CC[C@@H]3[C@@H](C[C@H](Cn4cncn4)[N@H+]3CC3CC3)C2)n1 ZINC001164751216 720813956 /nfs/dbraw/zinc/81/39/56/720813956.db2.gz XMAHVPVUDLCXFH-LZLYRXPVSA-N 1 1 441.630 3.384 20 0 IGADMO FC(F)(Oc1ccc(Cl)nc1)N1CC[C@@H]2[C@@H](C[C@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164745990 720820787 /nfs/dbraw/zinc/82/07/87/720820787.db2.gz XRFYIZRUUVCRGZ-LZLYRXPVSA-N 1 1 438.910 3.131 20 0 IGADMO COCC[N@H+]1CCO[C@H]2CN(C(F)(F)c3ccc4ncc(Cl)nc4c3)CC[C@H]2C1 ZINC001164849646 720842219 /nfs/dbraw/zinc/84/22/19/720842219.db2.gz CENNBMYQEUIQPI-KSSFIOAISA-N 1 1 426.895 3.002 20 0 IGADMO CC(C)(C)c1cc(Cl)nc(N2CC[C@@H]3[C@@H](C[C@H](Cn4cncn4)[N@H+]3CC3CC3)C2)n1 ZINC001164742545 720842300 /nfs/dbraw/zinc/84/23/00/720842300.db2.gz HLAOZXWGFLQYSR-RCCFBDPRSA-N 1 1 430.000 3.398 20 0 IGADMO COc1ccccc1-c1cc(N2CC[C@@H]3[C@H](C[C@H](Cn4cncn4)[N@H+]3CC3CC3)C2)ncn1 ZINC001164748788 720850491 /nfs/dbraw/zinc/85/04/91/720850491.db2.gz UXHSSUIANOWOFH-TXTKFYIRSA-N 1 1 445.571 3.123 20 0 IGADMO COCC[N@H+]1CCO[C@H]2CN(C(F)(F)c3ccc4cnc(Cl)nc4c3)CC[C@@H]2C1 ZINC001164852373 720863138 /nfs/dbraw/zinc/86/31/38/720863138.db2.gz CNDIORRNWHWLEG-QAPCUYQASA-N 1 1 426.895 3.002 20 0 IGADMO CCN(C)c1ccnc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COCc2cccnc2)n1 ZINC001164747414 720868531 /nfs/dbraw/zinc/86/85/31/720868531.db2.gz BQKFUOIDCAFZGS-DHLKQENFSA-N 1 1 436.604 3.083 20 0 IGADMO COC(=O)c1ccnc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COCc2cccnc2)c1 ZINC001164749659 720871061 /nfs/dbraw/zinc/87/10/61/720871061.db2.gz HQAYJUPRLHEFNU-DHLKQENFSA-N 1 1 436.556 3.018 20 0 IGADMO COc1cnc(Cl)nc1N1CC[C@]2(C1)C[N@@H+](CC1CC1)C[C@H]2COCc1cccnc1 ZINC001164752404 720871259 /nfs/dbraw/zinc/87/12/59/720871259.db2.gz MWQBXGQZIFJRSJ-WMZHIEFXSA-N 1 1 443.979 3.289 20 0 IGADMO CCOC(=O)c1c(Cl)c2ccccc2nc1N1CC[C@@H]2C[N@@H+](CCOC)CCO[C@H]2C1 ZINC001164855144 720874238 /nfs/dbraw/zinc/87/42/38/720874238.db2.gz GKEGQYCJBZZVBM-APWZRJJASA-N 1 1 447.963 3.238 20 0 IGADMO COCC[N@H+]1CCO[C@H]2CN(c3cc(-c4nc(-c5cccs5)no4)ccn3)CC[C@@H]2C1 ZINC001164859107 720883559 /nfs/dbraw/zinc/88/35/59/720883559.db2.gz LPZHQPVJBFPTND-MSOLQXFVSA-N 1 1 441.557 3.034 20 0 IGADMO COCC[N@H+]1CCO[C@@H]2CN(c3cnc(Cl)nc3Oc3cccc(F)c3)CC[C@H]2C1 ZINC001164858530 720888727 /nfs/dbraw/zinc/88/87/27/720888727.db2.gz KZYHCYGPVIYJFF-HNAYVOBHSA-N 1 1 436.915 3.235 20 0 IGADMO COCC[N@H+]1CCO[C@@H]2CN(c3cnc(Cl)nc3Oc3ccccc3C)CC[C@@H]2C1 ZINC001164858563 720888813 /nfs/dbraw/zinc/88/88/13/720888813.db2.gz LDKDBZLIAZRBQC-YLJYHZDGSA-N 1 1 432.952 3.404 20 0 IGADMO c1cncc(COC[C@H]2C[N@@H+](CC3CC3)C[C@]23CCN(c2ncc4cccnc4n2)C3)c1 ZINC001164755969 720892686 /nfs/dbraw/zinc/89/26/86/720892686.db2.gz NVADXEXWOBEBHG-RDGATRHJSA-N 1 1 430.556 3.175 20 0 IGADMO c1nc2cnc(N3CC[C@@]4(C3)C[N@H+](CC3CC3)C[C@H]4COCc3cccnc3)nc2s1 ZINC001164755628 720896665 /nfs/dbraw/zinc/89/66/65/720896665.db2.gz MFKNDAIGNZVKCY-CVDCTZTESA-N 1 1 436.585 3.236 20 0 IGADMO c1cncc(COC[C@@H]2C[N@@H+](CC3CC3)C[C@]23CCN(c2cncc(N4CCCC4)n2)C3)c1 ZINC001164751619 720898837 /nfs/dbraw/zinc/89/88/37/720898837.db2.gz CZAWJCHYSXXORW-OZXSUGGESA-N 1 1 448.615 3.227 20 0 IGADMO Nc1cc(Cl)cnc1N1CC[C@@]2(C1)C[N@@H+](CC1CC1)C[C@@H]2COCc1cccnc1 ZINC001164754202 720905290 /nfs/dbraw/zinc/90/52/90/720905290.db2.gz UGVZJLKPBHIVTA-XXBNENTESA-N 1 1 427.980 3.467 20 0 IGADMO c1ccc2nc(N3CC[C@@]4(C3)C[N@H+](CC3CC3)C[C@@H]4COCc3cccnc3)nnc2c1 ZINC001164754625 720918083 /nfs/dbraw/zinc/91/80/83/720918083.db2.gz WKUFAHHTFRQKRI-BWKNWUBXSA-N 1 1 430.556 3.175 20 0 IGADMO CC(C)Oc1nccnc1N1CC[C@@]2(C1)C[N@@H+](CC1CC1)C[C@H]2COCc1cccnc1 ZINC001164752689 720926017 /nfs/dbraw/zinc/92/60/17/720926017.db2.gz OLPFGPOOJPBDON-DHLKQENFSA-N 1 1 437.588 3.414 20 0 IGADMO COc1ncc(Cl)c(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COCc2cccnc2)n1 ZINC001164746500 720929267 /nfs/dbraw/zinc/92/92/67/720929267.db2.gz BAMSKLBUQXPHIA-XXBNENTESA-N 1 1 443.979 3.289 20 0 IGADMO c1ncn2c1CN(c1ncnc3c1CC[N@H+](Cc1ccccc1)C3)C[C@@H](COCC1CC1)C2 ZINC001164757251 720976611 /nfs/dbraw/zinc/97/66/11/720976611.db2.gz NOTFWUFYYRNNGQ-JOCHJYFZSA-N 1 1 444.583 3.294 20 0 IGADMO c1ncn2c1CN(c1ncnc3c1CC[N@@H+](Cc1ccccc1)C3)C[C@@H](COCC1CC1)C2 ZINC001164757251 720976620 /nfs/dbraw/zinc/97/66/20/720976620.db2.gz NOTFWUFYYRNNGQ-JOCHJYFZSA-N 1 1 444.583 3.294 20 0 IGADMO COc1cccc2c1nc(Cl)nc2N1CC[N@H+]2C[C@H](OCc3cccnc3)C[C@H]2C1 ZINC001164863345 721086075 /nfs/dbraw/zinc/08/60/75/721086075.db2.gz CBQNYWWBGAXRHQ-DLBZAZTESA-N 1 1 425.920 3.167 20 0 IGADMO FC(F)(c1ccc2ncnc(Cl)c2n1)N1CC[N@H+]2C[C@H](OCc3cccnc3)C[C@H]2C1 ZINC001164864574 721107514 /nfs/dbraw/zinc/10/75/14/721107514.db2.gz GLWNMVOGAOKLET-JKSUJKDBSA-N 1 1 446.889 3.098 20 0 IGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4ncnc5c4ccn5Cc4cccc(F)c4)C[C@H]3C2)cn1 ZINC001164762681 721144333 /nfs/dbraw/zinc/14/43/33/721144333.db2.gz DECTXKAMWMSLSX-NHCUHLMSSA-N 1 1 445.546 3.311 20 0 IGADMO FC(F)(c1cc(C2CC2)nnc1Cl)N1CC[N@H+]2C[C@H](OCc3cccnc3)C[C@H]2C1 ZINC001164879832 721150027 /nfs/dbraw/zinc/15/00/27/721150027.db2.gz UJQRTYJWQQQVGS-DLBZAZTESA-N 1 1 435.906 3.427 20 0 IGADMO FC(F)(c1nc2ccc(Cl)nc2[nH]1)N1CC[N@H+]2C[C@@H](OCc3cccnc3)C[C@H]2C1 ZINC001164878420 721156108 /nfs/dbraw/zinc/15/61/08/721156108.db2.gz QCJYFTSZIXNVGW-GJZGRUSLSA-N 1 1 434.878 3.031 20 0 IGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4cc(Cl)ncc4C(=O)OC(C)(C)C)C[C@H]3C2)cn1 ZINC001164768340 721156992 /nfs/dbraw/zinc/15/69/92/721156992.db2.gz OHUVAKNEAJHPHV-DLBZAZTESA-N 1 1 431.968 3.382 20 0 IGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(C(F)(F)c4nc(-c5ccc(Cl)nc5)no4)C[C@@H]3C2)cn1 ZINC001164764787 721228732 /nfs/dbraw/zinc/22/87/32/721228732.db2.gz QESUZVSGNXIZDQ-HOTGVXAUSA-N 1 1 449.893 3.022 20 0 IGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4nc(-c5ccccn5)nc5sccc54)C[C@@H]3C2)cn1 ZINC001164766164 721229456 /nfs/dbraw/zinc/22/94/56/721229456.db2.gz SIBGRTNTVPUKPI-MSOLQXFVSA-N 1 1 431.569 3.445 20 0 IGADMO CN(C)C(=O)C[N@H+]1CCOCC2(CCN(c3cc(-c4ccccc4)cc(Cl)n3)CC2)C1 ZINC001164868978 721272519 /nfs/dbraw/zinc/27/25/19/721272519.db2.gz IAIFGZLIFJHTPU-UHFFFAOYSA-N 1 1 442.991 3.409 20 0 IGADMO COC(=O)/C=C\c1ccc(NC(=O)C(C)(C)C)c(N2CC3(C2)CC[N@@H+](CC2CC2)C3)n1 ZINC001164767928 721293884 /nfs/dbraw/zinc/29/38/84/721293884.db2.gz CCDWUDYQVAHZBB-NTMALXAHSA-N 1 1 426.561 3.175 20 0 IGADMO CC(=O)Nc1c(C)ccnc1N1CCC[C@]2(C1)COCC[N@H+](Cc1c(C)noc1C)C2 ZINC001164780260 721362844 /nfs/dbraw/zinc/36/28/44/721362844.db2.gz DWIABLDPEPMXOW-QHCPKHFHSA-N 1 1 427.549 3.072 20 0 IGADMO CC(=O)Nc1c(C)ccnc1N1CCC[C@]2(C1)COCC[N@@H+](Cc1c(C)noc1C)C2 ZINC001164780260 721362848 /nfs/dbraw/zinc/36/28/48/721362848.db2.gz DWIABLDPEPMXOW-QHCPKHFHSA-N 1 1 427.549 3.072 20 0 IGADMO Cc1noc(C)c1CN1CCOC[C@@]2(CCCN(c3ccc(C[N@@H+](C)C4CC4)cn3)C2)C1 ZINC001164780762 721368472 /nfs/dbraw/zinc/36/84/72/721368472.db2.gz HELOBKDNAWLPMP-VWLOTQADSA-N 1 1 439.604 3.400 20 0 IGADMO Cc1noc(C)c1CN1CCOC[C@@]2(CCCN(c3ccc(C[N@H+](C)C4CC4)cn3)C2)C1 ZINC001164780762 721368474 /nfs/dbraw/zinc/36/84/74/721368474.db2.gz HELOBKDNAWLPMP-VWLOTQADSA-N 1 1 439.604 3.400 20 0 IGADMO CCOC(=O)c1c2ccccn2c2ncnc(N3C[C@H]4C[NH+](Cc5nccs5)C[C@@H]4C3)c21 ZINC001164779635 721389498 /nfs/dbraw/zinc/38/94/98/721389498.db2.gz BMTZHUMUVKPODX-HZPDHXFCSA-N 1 1 448.552 3.084 20 0 IGADMO C[NH+]1CCN(C[C@H]2CCC[C@@]3(CCN(c4nc(Cl)nc5cccc(F)c54)C3)O2)CC1 ZINC001164883502 721401181 /nfs/dbraw/zinc/40/11/81/721401181.db2.gz AFBOMUTXSUDCMI-ZHRRBRCNSA-N 1 1 433.959 3.188 20 0 IGADMO COc1ccc2nc(Cl)cc(N3CC[C@]4(C3)CCC[C@H](CN3CC[NH+](C)CC3)O4)c2n1 ZINC001164891470 721416149 /nfs/dbraw/zinc/41/61/49/721416149.db2.gz WIFIKPZAIAUXOM-HXOBKFHXSA-N 1 1 445.995 3.057 20 0 IGADMO COc1ccc(CN(C)c2ccnc(N3C[C@@H]4C[N@@H+](Cc5nccs5)C[C@@H]4C3)n2)cc1 ZINC001164783464 721434546 /nfs/dbraw/zinc/43/45/46/721434546.db2.gz IQQHPAMHQHVFBJ-KDURUIRLSA-N 1 1 436.585 3.146 20 0 IGADMO COc1ccc(CN(C)c2ccnc(N3C[C@@H]4C[N@H+](Cc5nccs5)C[C@@H]4C3)n2)cc1 ZINC001164783464 721434550 /nfs/dbraw/zinc/43/45/50/721434550.db2.gz IQQHPAMHQHVFBJ-KDURUIRLSA-N 1 1 436.585 3.146 20 0 IGADMO C[NH+]1CCN(C[C@H]2CCC[C@]3(CCN(c4nc(C(F)F)nc5ccccc54)C3)O2)CC1 ZINC001164893018 721439696 /nfs/dbraw/zinc/43/96/96/721439696.db2.gz IQSBURAHFNOYAS-UZUQRXQVSA-N 1 1 431.531 3.333 20 0 IGADMO CC(C)c1noc(-c2ccnc(N3CC[C@]4(C3)CCC[C@@H](CN3CC[NH+](C)CC3)O4)c2)n1 ZINC001164898391 721442978 /nfs/dbraw/zinc/44/29/78/721442978.db2.gz VXCPYZFENWBXSC-RDPSFJRHSA-N 1 1 440.592 3.020 20 0 IGADMO C[NH+]1CCN(C[C@@H]2CCC[C@]3(CCN(c4nnc(Cl)c5ccc(F)cc54)C3)O2)CC1 ZINC001164899769 721443773 /nfs/dbraw/zinc/44/37/73/721443773.db2.gz YYYYHYSJIHJOBQ-HTAPYJJXSA-N 1 1 433.959 3.188 20 0 IGADMO Cc1c(Cl)nc(C2CCC2)nc1N1CC[C@]2(C1)CCC[C@H](CN1CC[NH+](C)CC1)O2 ZINC001164891377 721448435 /nfs/dbraw/zinc/44/84/35/721448435.db2.gz UNBWTIWUXGYHKB-XXBNENTESA-N 1 1 434.028 3.471 20 0 IGADMO Cc1c(Cl)nc(C2CCC2)nc1N1CC[C@]2(C1)CCC[C@@H](CN1CC[NH+](C)CC1)O2 ZINC001164891372 721448529 /nfs/dbraw/zinc/44/85/29/721448529.db2.gz UNBWTIWUXGYHKB-CVDCTZTESA-N 1 1 434.028 3.471 20 0 IGADMO CCOC(=O)c1cnc(N2CCC3(C[C@@H](COCC4CC4)[N@@H+](CCOC)C3)CC2)c(C)c1 ZINC001164786917 721455257 /nfs/dbraw/zinc/45/52/57/721455257.db2.gz OQTUTNMTVBBXFB-QFIPXVFZSA-N 1 1 445.604 3.301 20 0 IGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1cnc3ccc(OC)cc3n1)CC2 ZINC001164788586 721459866 /nfs/dbraw/zinc/45/98/66/721459866.db2.gz ULBQCZYSOMCUIA-FQEVSTJZSA-N 1 1 440.588 3.372 20 0 IGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(C(F)(F)c1cncc(Cl)n1)CC2 ZINC001164785492 721463955 /nfs/dbraw/zinc/46/39/55/721463955.db2.gz LOLZSVBYLCGTQX-QGZVFWFLSA-N 1 1 444.954 3.409 20 0 IGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1ccc(-c3nc(C)no3)cn1)CC2 ZINC001164788772 721468221 /nfs/dbraw/zinc/46/82/21/721468221.db2.gz KGXAJQCQQBIAJP-NRFANRHFSA-N 1 1 441.576 3.174 20 0 IGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1cc3c(nn1)CC[C@@H](C)C3)CC2 ZINC001164789561 721470875 /nfs/dbraw/zinc/47/08/75/721470875.db2.gz OEAXWEYXGFJMGJ-KNQAVFIVSA-N 1 1 428.621 3.335 20 0 IGADMO CCOC(=O)c1cnc(C2CC2)nc1N1CC[N@H+]2C[C@@H](Oc3cccc(F)c3)C[C@@H]2C1 ZINC001164908268 721533755 /nfs/dbraw/zinc/53/37/55/721533755.db2.gz PPABFFFXUPWEFZ-MJGOQNOKSA-N 1 1 426.492 3.012 20 0 IGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2cc(NC(=O)OC(C)(C)C)ncn2)[C@@H]2CCCO[C@@H]12 ZINC001164808946 721536689 /nfs/dbraw/zinc/53/66/89/721536689.db2.gz SNKKBCNVORCYRC-DBXWQHBBSA-N 1 1 440.548 3.087 20 0 IGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2cc(NC(=O)OC(C)(C)C)ncn2)[C@@H]2CCCO[C@@H]12 ZINC001164808946 721536692 /nfs/dbraw/zinc/53/66/92/721536692.db2.gz SNKKBCNVORCYRC-DBXWQHBBSA-N 1 1 440.548 3.087 20 0 IGADMO CCOC(=O)c1cc2ncnc(N3CC[N@H+]4C[C@@H](Oc5cccc(F)c5)C[C@@H]4C3)c2s1 ZINC001164907293 721545044 /nfs/dbraw/zinc/54/50/44/721545044.db2.gz MVARGZDGCPPVAJ-WBVHZDCISA-N 1 1 442.516 3.349 20 0 IGADMO CSc1nc2c(c(N3C[C@H]([N@@H+](C)Cc4cccnc4)[C@H]4OCCC[C@@H]43)n1)CCCC2 ZINC001164803008 721550565 /nfs/dbraw/zinc/55/05/65/721550565.db2.gz HDZRXNUOCJGCPV-ACRUOGEOSA-N 1 1 425.602 3.341 20 0 IGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2cc(OCc3ccccc3)cnn2)[C@H]2CCCO[C@@H]12 ZINC001164804025 721562079 /nfs/dbraw/zinc/56/20/79/721562079.db2.gz KSRVPUYIORUVGM-JBRSBNLGSA-N 1 1 431.540 3.319 20 0 IGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2cc(OCc3ccccc3)cnn2)[C@H]2CCCO[C@@H]12 ZINC001164804025 721562081 /nfs/dbraw/zinc/56/20/81/721562081.db2.gz KSRVPUYIORUVGM-JBRSBNLGSA-N 1 1 431.540 3.319 20 0 IGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(C(F)(F)c2cc(Cl)nc(=S)[nH]2)[C@H]2CCCO[C@H]12 ZINC001164803951 721571702 /nfs/dbraw/zinc/57/17/02/721571702.db2.gz JXNJGLHNZAZVFD-VBQJREDUSA-N 1 1 441.935 3.227 20 0 IGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(C(F)(F)c2cc(Cl)nc(=S)[nH]2)[C@H]2CCCO[C@H]12 ZINC001164803951 721571707 /nfs/dbraw/zinc/57/17/07/721571707.db2.gz JXNJGLHNZAZVFD-VBQJREDUSA-N 1 1 441.935 3.227 20 0 IGADMO CCc1cc2c(nc(Cl)nc2N2C[C@H]([N@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@@H]32)[nH]1 ZINC001164806051 721573136 /nfs/dbraw/zinc/57/31/36/721573136.db2.gz PFJQCNXTRFULHT-GBESFXJTSA-N 1 1 426.952 3.437 20 0 IGADMO CCc1cc2c(nc(Cl)nc2N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@@H]32)[nH]1 ZINC001164806051 721573140 /nfs/dbraw/zinc/57/31/40/721573140.db2.gz PFJQCNXTRFULHT-GBESFXJTSA-N 1 1 426.952 3.437 20 0 IGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2nc(-c3ccncc3)nc3c2CCC3)[C@H]2CCCO[C@H]12 ZINC001164807565 721585960 /nfs/dbraw/zinc/58/59/60/721585960.db2.gz OMMANKKTDPHFHW-VXNXHJTFSA-N 1 1 442.567 3.291 20 0 IGADMO Cc1cccc(CN2CCO[C@@H]3C[N@@H+](C(C)(C)c4ccnc(Cl)c4)CC[C@H]3C2=O)n1 ZINC001164798887 721603346 /nfs/dbraw/zinc/60/33/46/721603346.db2.gz JKRSLDXIIFLCKI-WOJBJXKFSA-N 1 1 428.964 3.423 20 0 IGADMO Cc1cccc(CN2CCO[C@@H]3C[N@H+](C(C)(C)c4ccnc(Cl)c4)CC[C@H]3C2=O)n1 ZINC001164798887 721603349 /nfs/dbraw/zinc/60/33/49/721603349.db2.gz JKRSLDXIIFLCKI-WOJBJXKFSA-N 1 1 428.964 3.423 20 0 IGADMO COC(=O)c1c[nH]c2nc(N3CCC(F)(F)[C@]4(CC[N@@H+](Cc5ccccn5)C4)C3)ccc12 ZINC001164904888 721696558 /nfs/dbraw/zinc/69/65/58/721696558.db2.gz HNDYSMCQDNYLBQ-QFIPXVFZSA-N 1 1 441.482 3.482 20 0 IGADMO Cc1cc2c(nc(Cl)nc2N2CCO[C@@]3(C2)COCC[N@H+](Cc2cccnc2)C3)s1 ZINC001164910793 721777245 /nfs/dbraw/zinc/77/72/45/721777245.db2.gz CFNNGNINPRECKL-NRFANRHFSA-N 1 1 445.976 3.156 20 0 IGADMO Cc1cc2c(nc(Cl)nc2N2CCO[C@@]3(C2)COCC[N@@H+](Cc2cccnc2)C3)s1 ZINC001164910793 721777250 /nfs/dbraw/zinc/77/72/50/721777250.db2.gz CFNNGNINPRECKL-NRFANRHFSA-N 1 1 445.976 3.156 20 0 IGADMO Cc1nc2cc(Cl)ccc2c(N2CCO[C@]3(C2)COCC[N@H+](Cc2cccnc2)C3)n1 ZINC001164915582 721783220 /nfs/dbraw/zinc/78/32/20/721783220.db2.gz LMHRGTBRGIJGTF-HSZRJFAPSA-N 1 1 439.947 3.094 20 0 IGADMO Cc1nc2cc(Cl)ccc2c(N2CCO[C@]3(C2)COCC[N@@H+](Cc2cccnc2)C3)n1 ZINC001164915582 721783221 /nfs/dbraw/zinc/78/32/21/721783221.db2.gz LMHRGTBRGIJGTF-HSZRJFAPSA-N 1 1 439.947 3.094 20 0 IGADMO Cc1ccc2c(c1)nc(Cl)nc2N1CCO[C@@]2(C1)COCC[N@H+](Cc1cccnc1)C2 ZINC001164915227 721783428 /nfs/dbraw/zinc/78/34/28/721783428.db2.gz KMQKTWYCPYTBJU-QHCPKHFHSA-N 1 1 439.947 3.094 20 0 IGADMO Cc1ccc2c(c1)nc(Cl)nc2N1CCO[C@@]2(C1)COCC[N@@H+](Cc1cccnc1)C2 ZINC001164915227 721783436 /nfs/dbraw/zinc/78/34/36/721783436.db2.gz KMQKTWYCPYTBJU-QHCPKHFHSA-N 1 1 439.947 3.094 20 0 IGADMO Cc1c[nH]c2nc(Cl)cc(N3CCO[C@@]4(C3)COCC[N@H+](Cc3cccnc3)C4)c12 ZINC001164914335 721793036 /nfs/dbraw/zinc/79/30/36/721793036.db2.gz LYHAFLCTEQSLKZ-QFIPXVFZSA-N 1 1 427.936 3.028 20 0 IGADMO Cc1c[nH]c2nc(Cl)cc(N3CCO[C@@]4(C3)COCC[N@@H+](Cc3cccnc3)C4)c12 ZINC001164914335 721793039 /nfs/dbraw/zinc/79/30/39/721793039.db2.gz LYHAFLCTEQSLKZ-QFIPXVFZSA-N 1 1 427.936 3.028 20 0 IGADMO FC(F)c1nc2ccccc2c(N2CCO[C@@]3(C2)COCC[N@H+](Cc2cccnc2)C3)n1 ZINC001164913996 721796181 /nfs/dbraw/zinc/79/61/81/721796181.db2.gz JQOKFBDHOJLLMJ-QHCPKHFHSA-N 1 1 441.482 3.070 20 0 IGADMO FC(F)c1nc2ccccc2c(N2CCO[C@@]3(C2)COCC[N@@H+](Cc2cccnc2)C3)n1 ZINC001164913996 721796186 /nfs/dbraw/zinc/79/61/86/721796186.db2.gz JQOKFBDHOJLLMJ-QHCPKHFHSA-N 1 1 441.482 3.070 20 0 IGADMO CCOC(=O)Cc1nc(Cl)cc(N2C[C@@H]3CCC[C@H]([N@@H+](C)Cc4ccccn4)[C@H]3C2)n1 ZINC001165026514 721809997 /nfs/dbraw/zinc/80/99/97/721809997.db2.gz QXKJDEBNWDUNOH-WDSOQIARSA-N 1 1 443.979 3.368 20 0 IGADMO CCOC(=O)Cc1c(Cl)ncnc1N1C[C@@H]2CCC[C@@H]([N@@H+](C)Cc3ccccn3)[C@@H]2C1 ZINC001165022685 721813144 /nfs/dbraw/zinc/81/31/44/721813144.db2.gz GPYIUAHYDZFNNW-PWIZWCRZSA-N 1 1 443.979 3.368 20 0 IGADMO CN1CCc2nc(Cl)nc(N3C[C@@H]4CCC[C@@H]([N@@H+](C)Cc5ccccn5)[C@@H]4C3)c2C1 ZINC001165021331 721830172 /nfs/dbraw/zinc/83/01/72/721830172.db2.gz DYQUQKHAYPVNRV-YRISNDGFSA-N 1 1 426.996 3.250 20 0 IGADMO CN(C)CC[N@H+]1CC[C@@H]2[C@H]1CCN2c1nc(-c2cnccn2)nc2sc3c(c21)CCCC3 ZINC001164931515 721885009 /nfs/dbraw/zinc/88/50/09/721885009.db2.gz GGTKRRFLYOSJFW-RTBURBONSA-N 1 1 449.628 3.242 20 0 IGADMO C[NH+](C)CCN1CC[C@@H]2[C@H]1CCN2c1nc(-c2cnccn2)nc2sc3c(c21)CCCC3 ZINC001164931515 721885011 /nfs/dbraw/zinc/88/50/11/721885011.db2.gz GGTKRRFLYOSJFW-RTBURBONSA-N 1 1 449.628 3.242 20 0 IGADMO CCOC(=O)c1cnc(Cl)nc1N1CCC2(CC1)C[N@@H+](Cc1ccc(C)cc1)CCO2 ZINC001164939481 721920497 /nfs/dbraw/zinc/92/04/97/721920497.db2.gz UFVJSAILVOYWGH-UHFFFAOYSA-N 1 1 444.963 3.487 20 0 IGADMO Cc1ccc(C[N@H+]2CCOC3(CCN(c4[nH]c5cc(=O)[nH]c-5cc4Cl)CC3)C2)cc1 ZINC001164939836 721926627 /nfs/dbraw/zinc/92/66/27/721926627.db2.gz NUWCCSIPYJVJOY-UHFFFAOYSA-N 1 1 426.948 3.409 20 0 IGADMO Cc1ccc(C[N@H+]2CCOC3(CCN(c4cc(N5CCSCC5)ncn4)CC3)C2)cc1 ZINC001164940724 721932786 /nfs/dbraw/zinc/93/27/86/721932786.db2.gz YWDIWHIDFXQXDP-UHFFFAOYSA-N 1 1 439.629 3.210 20 0 IGADMO C[NH+]1CCC(Oc2ccnc(N3CCCn4cnc(COc5cccnc5)c4C3)c2)CC1 ZINC001164953491 721998363 /nfs/dbraw/zinc/99/83/63/721998363.db2.gz XZZRMCUSMPPGEV-UHFFFAOYSA-N 1 1 434.544 3.135 20 0 IGADMO CCOC(=O)c1c(Cl)cc(C)nc1N1CC[C@H]2C[N@@H+](Cc3cccnc3)CCO[C@@H]2C1 ZINC001164985188 722101696 /nfs/dbraw/zinc/10/16/96/722101696.db2.gz VGSNFBJVUNWGMV-AZUAARDMSA-N 1 1 444.963 3.342 20 0 IGADMO COCc1cc(N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)nc(-c2ccccc2)n1 ZINC001164976350 722102520 /nfs/dbraw/zinc/10/25/20/722102520.db2.gz CQJQERGSVJWJPC-UPVQGACJSA-N 1 1 445.567 3.412 20 0 IGADMO CC1(C)OCc2c1nc(Cl)nc2N1CC[C@@H]2C[N@@H+](Cc3cccnc3)CCO[C@H]2C1 ZINC001164983213 722108863 /nfs/dbraw/zinc/10/88/63/722108863.db2.gz YNDYVIPFEPJWCZ-AEFFLSMTSA-N 1 1 429.952 3.018 20 0 IGADMO CCOC(=O)c1nc(N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)ccc1Cl ZINC001164974177 722134806 /nfs/dbraw/zinc/13/48/06/722134806.db2.gz CLLAGKREDGPCNQ-IEBWSBKVSA-N 1 1 430.936 3.034 20 0 IGADMO C[C@@H]1CCCN(C(=O)c2ccc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)nc2)C1 ZINC001164972751 722140138 /nfs/dbraw/zinc/14/01/38/722140138.db2.gz AKTAITRQUUCABO-QDSKXPNFSA-N 1 1 449.599 3.076 20 0 IGADMO CC1CCN(C(=O)c2cccnc2N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)CC1 ZINC001164982790 722140805 /nfs/dbraw/zinc/14/08/05/722140805.db2.gz SPPHWSJJNZNIOF-VWNXMTODSA-N 1 1 449.599 3.076 20 0 IGADMO COc1ccccc1-c1ccc(N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)nn1 ZINC001164985083 722141948 /nfs/dbraw/zinc/14/19/48/722141948.db2.gz ZELPULJERNHFIM-GBXCKJPGSA-N 1 1 431.540 3.275 20 0 IGADMO Cc1nc(-c2ccncc2)nc(N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)c1C ZINC001164975074 722148579 /nfs/dbraw/zinc/14/85/79/722148579.db2.gz DTSWLCUBFNIKTM-PKTZIBPZSA-N 1 1 430.556 3.278 20 0 IGADMO Cc1nc(C)c(-c2ccc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)nn2)s1 ZINC001164979719 722151176 /nfs/dbraw/zinc/15/11/76/722151176.db2.gz LVBNLTFZMDWOTH-FPOVZHCZSA-N 1 1 436.585 3.339 20 0 IGADMO Clc1cc(-c2ccncc2)nc(N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)n1 ZINC001164971612 722154130 /nfs/dbraw/zinc/15/41/30/722154130.db2.gz CFKWRGUNISGHFO-PZJWPPBQSA-N 1 1 436.947 3.314 20 0 IGADMO CC(C)NC(=O)c1ccc2c(c1)C1(CCN(c3ccc(C[N@@H+](C)C4CC4)cn3)CC1)C(=O)N2 ZINC001164991516 722187932 /nfs/dbraw/zinc/18/79/32/722187932.db2.gz RSPMLABWFZUIEK-UHFFFAOYSA-N 1 1 447.583 3.304 20 0 IGADMO CCC[N@H+]1CCCC[C@@H]1c1ccc(N2CCCn3c(CNC(=O)C(C)C)nnc3C2)nc1 ZINC001164989441 722190335 /nfs/dbraw/zinc/19/03/35/722190335.db2.gz NLUAMTWRKSXXIG-HXUWFJFHSA-N 1 1 439.608 3.293 20 0 IGADMO C[NH+]1CCN(c2ncnc3c2CCN(c2nc(Cl)cc4cc(F)ccc42)CC3)CC1 ZINC001164998174 722229201 /nfs/dbraw/zinc/22/92/01/722229201.db2.gz ZDBOILTYOGULAS-UHFFFAOYSA-N 1 1 426.927 3.174 20 0 IGADMO C[NH+]1CCN(c2ncnc3c2CCN(c2ccc4c(Cl)ccc(F)c4n2)CC3)CC1 ZINC001165001052 722239396 /nfs/dbraw/zinc/23/93/96/722239396.db2.gz AETBFIUVLHWHEB-UHFFFAOYSA-N 1 1 426.927 3.174 20 0 IGADMO COC(=O)c1c[nH]c2nc(Cl)nc(N3CCC[C@@H]4C[N@@H+](Cc5ccccc5)C[C@@H]43)c12 ZINC001164631431 719095222 /nfs/dbraw/zinc/09/52/22/719095222.db2.gz YBPGWEWYMUXGOE-WBVHZDCISA-N 1 1 425.920 3.499 20 0 IGADMO CC1(C)NC(=O)N(Cc2ccc(N3CCC[C@H]4C[N@@H+](Cc5ccccc5)C[C@H]43)nc2)C1=O ZINC001164630413 719099033 /nfs/dbraw/zinc/09/90/33/719099033.db2.gz WEWLGCQUXFVYED-LEWJYISDSA-N 1 1 433.556 3.013 20 0 IGADMO O=C(c1cnc(N2CCC[C@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)c(Cl)c1)N1CCOCC1 ZINC001164629594 719099643 /nfs/dbraw/zinc/09/96/43/719099643.db2.gz STZUSANDUXOYBE-UGKGYDQZSA-N 1 1 440.975 3.308 20 0 IGADMO Cc1ccc(NC[C@@H]2CO[C@]3(C2)COCC[N@@H+](C(C)(C)c2ccnc(Cl)c2)C3)nn1 ZINC001164636775 719267023 /nfs/dbraw/zinc/26/70/23/719267023.db2.gz JZFAHVZIANLTBX-VGSWGCGISA-N 1 1 431.968 3.288 20 0 IGADMO Cc1ccc(NC[C@@H]2CO[C@]3(C2)COCC[N@H+](C(C)(C)c2ccnc(Cl)c2)C3)nn1 ZINC001164636775 719267024 /nfs/dbraw/zinc/26/70/24/719267024.db2.gz JZFAHVZIANLTBX-VGSWGCGISA-N 1 1 431.968 3.288 20 0 IGADMO COCCN1CC[N@H+](C)C2(CCN(c3cc(Cl)nc4cc(Cl)ccc43)CC2)C1=O ZINC001164636635 719272016 /nfs/dbraw/zinc/27/20/16/719272016.db2.gz VSWJVXJTOGSZSK-UHFFFAOYSA-N 1 1 437.371 3.301 20 0 IGADMO COCCN1CC[N@@H+](C)C2(CCN(c3cc(Cl)nc4cc(Cl)ccc43)CC2)C1=O ZINC001164636635 719272019 /nfs/dbraw/zinc/27/20/19/719272019.db2.gz VSWJVXJTOGSZSK-UHFFFAOYSA-N 1 1 437.371 3.301 20 0 IGADMO Clc1ccc(C[NH+]2CCCC2)c(N2CCCn3nnc(COc4cccnc4)c3C2)n1 ZINC001164654396 719327596 /nfs/dbraw/zinc/32/75/96/719327596.db2.gz KROIYYUKNPCSPC-UHFFFAOYSA-N 1 1 439.951 3.307 20 0 IGADMO CN(C)c1nccc(N2CCOC[C@]3(CCC[N@H+](C(C)(C)c4ccnc(Cl)c4)C3)C2)n1 ZINC001164664626 719357729 /nfs/dbraw/zinc/35/77/29/719357729.db2.gz PTDNFBVYKDPOJE-HSZRJFAPSA-N 1 1 445.011 3.445 20 0 IGADMO CNC(=O)C[N@H+]1CCCC12CCN(C(F)(F)c1nc(Cl)c3cccc(F)c3n1)CC2 ZINC001164684324 719706665 /nfs/dbraw/zinc/70/66/65/719706665.db2.gz OXVHPMZRHOUKSD-UHFFFAOYSA-N 1 1 441.885 3.148 20 0 IGADMO CNC(=O)C[N@H+]1CCCC12CCN(C(F)(F)c1nc(Cl)c3cc(F)ccc3n1)CC2 ZINC001164685446 719714724 /nfs/dbraw/zinc/71/47/24/719714724.db2.gz LBULSVDCZUZPFX-UHFFFAOYSA-N 1 1 441.885 3.148 20 0 IGADMO CNC(=O)C[N@H+]1CCCC12CCN(c1cc(Oc3ccc(SC)cc3)ncn1)CC2 ZINC001164685422 719733710 /nfs/dbraw/zinc/73/37/10/719733710.db2.gz KORICTZGLMFOST-UHFFFAOYSA-N 1 1 427.574 3.172 20 0 IGADMO COC(=O)[C@@]1(C)C[C@H]([NH+]2CCOCC2)CCN1c1ncc(OC)c2ccc(Cl)cc21 ZINC001164701372 719854616 /nfs/dbraw/zinc/85/46/16/719854616.db2.gz KIKWUCJFCMQGQG-OPAMFIHVSA-N 1 1 433.936 3.130 20 0 IGADMO CN(C)C(=O)c1cnc(N2CCC3(CC2)C[N@@H+](Cc2cccs2)CCO3)c(Cl)c1 ZINC001164707567 719898874 /nfs/dbraw/zinc/89/88/74/719898874.db2.gz UHXOZGKDNGYACV-UHFFFAOYSA-N 1 1 434.993 3.370 20 0 IGADMO COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1c[nH]c3ncnc(Cl)c13)CC2 ZINC001164710649 720101120 /nfs/dbraw/zinc/10/11/20/720101120.db2.gz KLQICLUPSIGICZ-KRWDZBQOSA-N 1 1 426.952 3.465 20 0 IGADMO COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1cc(Cl)cc(C(=O)OC)n1)CC2 ZINC001164712555 720104913 /nfs/dbraw/zinc/10/49/13/720104913.db2.gz XASPRVBWAZAUBT-IBGZPJMESA-N 1 1 444.963 3.424 20 0 IGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1nc(C)nc3cc(OC)c(OC)cc31)C2 ZINC001164808169 720117108 /nfs/dbraw/zinc/11/71/08/720117108.db2.gz DURJFPRZDCWLOY-HOYKHHGWSA-N 1 1 426.561 3.140 20 0 IGADMO COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1cc(N3CCCCC3)ncn1)CC2 ZINC001164713599 720140360 /nfs/dbraw/zinc/14/03/60/720140360.db2.gz SNJFJWQQZAOIHS-JOCHJYFZSA-N 1 1 436.604 3.369 20 0 IGADMO COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1cncc(OCC(C)C)n1)CC2 ZINC001164712265 720145833 /nfs/dbraw/zinc/14/58/33/720145833.db2.gz MDJAVWRKVXCWPC-OAQYLSRUSA-N 1 1 425.577 3.414 20 0 IGADMO COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1nc(C(N)=O)cc3ccccc31)CC2 ZINC001164712533 720147091 /nfs/dbraw/zinc/14/70/91/720147091.db2.gz NFAKADHIHYRVBT-OAQYLSRUSA-N 1 1 445.567 3.236 20 0 IGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1ccc(C(=O)N3CCC[C@H](C)C3)cn1)C2 ZINC001164816378 720165025 /nfs/dbraw/zinc/16/50/25/720165025.db2.gz LDMPYAJUYVHOND-KIVTUJJHSA-N 1 1 426.605 3.138 20 0 IGADMO CC(C)[N@@H+](C)Cc1cc(=O)n2c(n1)CN(C(F)(F)c1ccnc(Cl)c1F)CCC2 ZINC001164811444 720210459 /nfs/dbraw/zinc/21/04/59/720210459.db2.gz HZLKXOLBOOTUFK-UHFFFAOYSA-N 1 1 429.874 3.226 20 0 IGADMO CSc1nc2ccsc2c(N2CCCn3c(=O)cc(C[N@@H+](C)C(C)C)nc3C2)n1 ZINC001164813454 720220238 /nfs/dbraw/zinc/22/02/38/720220238.db2.gz MNYHKWDILPXAOG-UHFFFAOYSA-N 1 1 430.603 3.220 20 0 IGADMO CC(C)[N@@H+](C)Cc1cc(=O)n2c(n1)CN(c1nc(Cl)nc3c1CCCCC3)CCC2 ZINC001164811995 720220387 /nfs/dbraw/zinc/22/03/87/720220387.db2.gz CIFQDNJBCLQQIX-UHFFFAOYSA-N 1 1 430.984 3.206 20 0 IGADMO CC(C)[N@@H+](C)Cc1cc(=O)n2c(n1)CN(C(F)(F)c1cc(Cl)ncc1F)CCC2 ZINC001164813488 720222357 /nfs/dbraw/zinc/22/23/57/720222357.db2.gz MUJPZEURVTWJFO-UHFFFAOYSA-N 1 1 429.874 3.226 20 0 IGADMO COc1ccc2nc(Cl)cc(N3CCCn4c(=O)cc(C[N@@H+](C)C(C)C)nc4C3)c2n1 ZINC001164812099 720224866 /nfs/dbraw/zinc/22/48/66/720224866.db2.gz DLNJAECAVQWTHL-UHFFFAOYSA-N 1 1 442.951 3.099 20 0 IGADMO CC(C)[N@@H+](C)Cc1cc(=O)n2c(n1)CN(c1nccc(Oc3cccc(F)c3)n1)CCC2 ZINC001164813468 720231953 /nfs/dbraw/zinc/23/19/53/720231953.db2.gz OPQRBFAXIDTOJD-UHFFFAOYSA-N 1 1 438.507 3.215 20 0 IGADMO CCOC(=O)c1cnc(C(F)(F)N2CC[C@H]3[C@@H]2CC[N@@H+]3Cc2cccnc2)nc1Cl ZINC001164724935 720335764 /nfs/dbraw/zinc/33/57/64/720335764.db2.gz LVFHTXSDGUFFIE-HOTGVXAUSA-N 1 1 437.878 3.100 20 0 IGADMO CCOC(=O)c1cnc(C(F)(F)N2CC[C@H]3[C@@H]2CC[N@H+]3Cc2cccnc2)nc1Cl ZINC001164724935 720335771 /nfs/dbraw/zinc/33/57/71/720335771.db2.gz LVFHTXSDGUFFIE-HOTGVXAUSA-N 1 1 437.878 3.100 20 0 IGADMO COc1cc2ncc(N3CC[C@@H]4[C@H](C[C@H](Cn5cccn5)[N@H+]4C(C)C)C3)nc2cc1OC ZINC001164841435 720538227 /nfs/dbraw/zinc/53/82/27/720538227.db2.gz VUBRADZCXYRKDM-DBXWQHBBSA-N 1 1 436.560 3.221 20 0 IGADMO CCOC(=O)c1c(C)cc(N2CC[C@@H]3[C@H](C[C@@H](Cn4cccn4)[N@H+]3C(C)C)C2)nc1C ZINC001164841405 720559972 /nfs/dbraw/zinc/55/99/72/720559972.db2.gz UYFGIQPXUSSKHK-QHAWAJNXSA-N 1 1 425.577 3.449 20 0 IGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@@H]2CN(c3nccc(C(=O)OC(C)(C)C)n3)CC[C@@H]21 ZINC001164840122 720560451 /nfs/dbraw/zinc/56/04/51/720560451.db2.gz RLRQHEGOQWLMDI-HBFSDRIKSA-N 1 1 426.565 3.006 20 0 IGADMO COC(=O)c1c(Cl)cnc(N2CC[C@@H]3[C@@H](C[C@H](Cn4cccn4)[N@H+]3C(C)C)C2)c1OC ZINC001164843104 720588603 /nfs/dbraw/zinc/58/86/03/720588603.db2.gz WJAXPIIAZGRQGW-LZLYRXPVSA-N 1 1 447.967 3.105 20 0 IGADMO CC(C)[N@@H+]1[C@@H]2CCN(C(F)(F)COc3ccc(Cl)nn3)C[C@@H]2C[C@H]1Cn1cccn1 ZINC001164836642 720602236 /nfs/dbraw/zinc/60/22/36/720602236.db2.gz GAPJYQGVTRLKES-YESZJQIVSA-N 1 1 440.926 3.172 20 0 IGADMO Fc1ccc(-c2nc(Cl)cc(N3CC[N@H+]4C[C@@H](Oc5cncnc5)C[C@H]4C3)n2)cc1 ZINC001164738903 720775855 /nfs/dbraw/zinc/77/58/55/720775855.db2.gz GYEXXMRSCRMSRJ-IRXDYDNUSA-N 1 1 426.883 3.068 20 0 IGADMO Fc1ccc(-c2ccc(Cl)nn2)c(N2CC[N@H+]3C[C@H](Oc4cncnc4)C[C@@H]3C2)c1 ZINC001164741872 720780452 /nfs/dbraw/zinc/78/04/52/720780452.db2.gz NGAYRIOUFHXUAL-HZPDHXFCSA-N 1 1 426.883 3.068 20 0 IGADMO Fc1ccc(-c2ccc(Cl)nn2)c(N2CC[N@H+]3C[C@@H](Oc4cncnc4)C[C@H]3C2)c1 ZINC001164741869 720781486 /nfs/dbraw/zinc/78/14/86/720781486.db2.gz NGAYRIOUFHXUAL-HOTGVXAUSA-N 1 1 426.883 3.068 20 0 IGADMO Cc1ccccc1Oc1nc(Cl)ncc1N1CC[N@H+]2C[C@H](Oc3cncnc3)C[C@@H]2C1 ZINC001164740707 720802768 /nfs/dbraw/zinc/80/27/68/720802768.db2.gz AFIBAXAIGFCHRT-IAGOWNOFSA-N 1 1 438.919 3.363 20 0 IGADMO COc1cc2c(cc1F)cc(Cl)nc2N1CC[N@H+]2C[C@H](Oc3cncnc3)C[C@@H]2C1 ZINC001164748234 720807193 /nfs/dbraw/zinc/80/71/93/720807193.db2.gz QCFMPXVWWZCYEM-HUUCEWRRSA-N 1 1 429.883 3.168 20 0 IGADMO c1ncn(C[C@@H]2C[C@@H]3CN(c4nccc(Oc5ccccc5)n4)CC[C@H]3[N@H+]2CC2CC2)n1 ZINC001164745051 720818951 /nfs/dbraw/zinc/81/89/51/720818951.db2.gz VZLLTZYJMNJOAJ-RZUBCFFCSA-N 1 1 431.544 3.240 20 0 IGADMO c1ncn(C[C@@H]2C[C@H]3CN(c4nccc(Oc5ccccc5)n4)CC[C@H]3[N@H+]2CC2CC2)n1 ZINC001164745047 720819310 /nfs/dbraw/zinc/81/93/10/720819310.db2.gz VZLLTZYJMNJOAJ-JAXLGGSGSA-N 1 1 431.544 3.240 20 0 IGADMO CSc1nc2ccsc2c(N2CC[C@@H]3[C@H](C[C@@H](Cn4cncn4)[N@H+]3CC3CC3)C2)n1 ZINC001164737728 720825535 /nfs/dbraw/zinc/82/55/35/720825535.db2.gz CGZKWWYJLBKMCQ-SOLBZPMBSA-N 1 1 441.630 3.384 20 0 IGADMO Clc1nc2c(c(N3CC[C@@H]4[C@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)n1)CCCCC2 ZINC001164740781 720825981 /nfs/dbraw/zinc/82/59/81/720825981.db2.gz LGELSFSYUGWWOD-LVCYWYKZSA-N 1 1 442.011 3.370 20 0 IGADMO Cc1nc2c(nc(Cl)nc2N2CC[C@@H]3[C@@H](C[C@@H](Cn4cncn4)[N@H+]3CC3CC3)C2)s1 ZINC001164743555 720832609 /nfs/dbraw/zinc/83/26/09/720832609.db2.gz JBXDWQQNDOPPPL-HRCADAONSA-N 1 1 444.996 3.019 20 0 IGADMO COc1ccccc1-c1ccnc(N2CC[C@@H]3[C@H](C[C@@H](Cn4cncn4)[N@H+]3CC3CC3)C2)n1 ZINC001164749722 720849688 /nfs/dbraw/zinc/84/96/88/720849688.db2.gz WPWLLXBHILOBLQ-ZRCGQRJVSA-N 1 1 445.571 3.123 20 0 IGADMO COc1ccc(-c2cc(N3CC[C@@H]4[C@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)ncn2)cc1 ZINC001164750332 720850330 /nfs/dbraw/zinc/85/03/30/720850330.db2.gz XGVDMKIUFPIZFA-ZFGGDYGUSA-N 1 1 445.571 3.123 20 0 IGADMO c1ncn(C[C@H]2C[C@H]3CN(c4ccnc(Cc5ccccc5)n4)CC[C@H]3[N@H+]2CC2CC2)n1 ZINC001164753107 720851395 /nfs/dbraw/zinc/85/13/95/720851395.db2.gz WUCOBMGAVCESSG-YTFSRNRJSA-N 1 1 429.572 3.038 20 0 IGADMO Fc1ccc(Oc2ccnc(N3CC[C@@H]4[C@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)n2)cc1 ZINC001164749339 720851547 /nfs/dbraw/zinc/85/15/47/720851547.db2.gz NBGHPEXFUSPUJI-KAGYGMCKSA-N 1 1 449.534 3.379 20 0 IGADMO COCC[N@H+]1CCO[C@@H]2CN(c3cc(Oc4ccc(SC)cc4)ncn3)CC[C@H]2C1 ZINC001164862125 720869354 /nfs/dbraw/zinc/86/93/54/720869354.db2.gz ZCVUTNMAZBQOOS-FXAWDEMLSA-N 1 1 430.574 3.164 20 0 IGADMO CCOC(=O)c1c(Cl)c2ccccc2nc1N1CC[C@H]2C[N@@H+](CCOC)CCO[C@@H]2C1 ZINC001164855154 720874472 /nfs/dbraw/zinc/87/44/72/720874472.db2.gz GKEGQYCJBZZVBM-QFBILLFUSA-N 1 1 447.963 3.238 20 0 IGADMO COCC[N@H+]1CCO[C@@H]2CN(c3nc4ccccc4nc3N3CCCC[C@H]3C)CC[C@H]2C1 ZINC001164855363 720874860 /nfs/dbraw/zinc/87/48/60/720874860.db2.gz HASOPPJCEJJRGE-ZRCGQRJVSA-N 1 1 439.604 3.182 20 0 IGADMO COCC[N@H+]1CCO[C@@H]2CN(c3nc4ccccc4nc3N3CCCC[C@H]3C)CC[C@@H]2C1 ZINC001164855359 720875022 /nfs/dbraw/zinc/87/50/22/720875022.db2.gz HASOPPJCEJJRGE-TXTKFYIRSA-N 1 1 439.604 3.182 20 0 IGADMO COCC[N@H+]1CCO[C@H]2CN(c3ccc(C(=O)Nc4cccc(Cl)c4)cn3)CC[C@@H]2C1 ZINC001164859220 720876359 /nfs/dbraw/zinc/87/63/59/720876359.db2.gz MAZLXCQGHKRDFO-NQIIRXRSSA-N 1 1 444.963 3.161 20 0 IGADMO c1cncc(COC[C@@H]2C[N@@H+](CC3CC3)C[C@]23CCN(c2cnc4cccnc4n2)C3)c1 ZINC001164753472 720885441 /nfs/dbraw/zinc/88/54/41/720885441.db2.gz HBJSNGZKZIARSY-OFVILXPXSA-N 1 1 430.556 3.175 20 0 IGADMO COCC[N@H+]1CCO[C@@H]2CN(C(F)(F)c3ccc(Cl)nc3C(F)(F)F)CC[C@H]2C1 ZINC001164855831 720886012 /nfs/dbraw/zinc/88/60/12/720886012.db2.gz HZITWNDELJANFS-GXTWGEPZSA-N 1 1 443.844 3.472 20 0 IGADMO COCC[N@H+]1CCO[C@@H]2CN(c3cnc(Cl)nc3Oc3ccccc3F)CC[C@H]2C1 ZINC001164854394 720888784 /nfs/dbraw/zinc/88/87/84/720888784.db2.gz FFBXIEAUNXWMMM-HNAYVOBHSA-N 1 1 436.915 3.235 20 0 IGADMO Fc1cc(Cl)nnc1N1CC[C@]2(C1)C[N@@H+](CC1CC1)C[C@@H]2COCc1cccnc1 ZINC001164749991 720890266 /nfs/dbraw/zinc/89/02/66/720890266.db2.gz BGPFFUGNMVIFBQ-XMSQKQJNSA-N 1 1 431.943 3.419 20 0 IGADMO CSc1cnc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COCc2cccnc2)nc1 ZINC001164754541 720895435 /nfs/dbraw/zinc/89/54/35/720895435.db2.gz JHIIJWLLJASIOK-NZQKXSOJSA-N 1 1 425.602 3.349 20 0 IGADMO COc1ccc2nc(Cl)nc(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@@H]4C3)c2c1 ZINC001164870641 721042453 /nfs/dbraw/zinc/04/24/53/721042453.db2.gz WNMZATPDQAMCCH-AEFFLSMTSA-N 1 1 425.920 3.167 20 0 IGADMO CCOC(=O)c1c(Cl)cc(C)nc1N1CC[N@H+]2C[C@@H](OCc3cccnc3)C[C@H]2C1 ZINC001164869914 721050431 /nfs/dbraw/zinc/05/04/31/721050431.db2.gz UICNZFCOLOSGFS-ROUUACIJSA-N 1 1 430.936 3.095 20 0 IGADMO O=C(NC1CCCCC1)c1cccnc1N1CC[N@H+]2C[C@H](OCc3cccnc3)C[C@@H]2C1 ZINC001164866218 721052553 /nfs/dbraw/zinc/05/25/53/721052553.db2.gz CVTOXZKWBMMVCV-FGZHOGPDSA-N 1 1 435.572 3.019 20 0 IGADMO c1cncc(CO[C@H]2C[C@H]3CN(c4nccnc4C4SCCCS4)CC[N@H+]3C2)c1 ZINC001164868218 721070759 /nfs/dbraw/zinc/07/07/59/721070759.db2.gz NQSXLJHQJUYLRQ-ROUUACIJSA-N 1 1 429.615 3.220 20 0 IGADMO c1[nH]c2ccccc2c1-c1ccnc(N2CC[N@H+]3C[C@@H](OCc4cccnc4)C[C@H]3C2)n1 ZINC001164866914 721083086 /nfs/dbraw/zinc/08/30/86/721083086.db2.gz UZZDQJOTUCTPKS-PMACEKPBSA-N 1 1 426.524 3.500 20 0 IGADMO CCOC(=O)c1cnc(Cl)c(C)c1N1CC[N@H+]2C[C@@H](OCc3cccnc3)C[C@@H]2C1 ZINC001164862855 721098751 /nfs/dbraw/zinc/09/87/51/721098751.db2.gz BGLUOQUMWXBJKJ-MSOLQXFVSA-N 1 1 430.936 3.095 20 0 IGADMO CC(C)(C)NC(=O)c1ccc(Cl)nc1N1CC[N@H+]2C[C@H](OCc3cccnc3)C[C@@H]2C1 ZINC001164865208 721099832 /nfs/dbraw/zinc/09/98/32/721099832.db2.gz JMUAJKDVTSKVLA-QZTJIDSGSA-N 1 1 443.979 3.138 20 0 IGADMO CC(C)(C)NC(=O)c1ccc(Cl)nc1N1CC[N@H+]2C[C@@H](OCc3cccnc3)C[C@@H]2C1 ZINC001164865205 721100050 /nfs/dbraw/zinc/10/00/50/721100050.db2.gz JMUAJKDVTSKVLA-MSOLQXFVSA-N 1 1 443.979 3.138 20 0 IGADMO FC(F)(c1cnc2c(Cl)ncnc2c1)N1CC[N@H+]2C[C@H](OCc3cccnc3)C[C@H]2C1 ZINC001164870372 721126928 /nfs/dbraw/zinc/12/69/28/721126928.db2.gz CROLJLXBKFCXJS-DLBZAZTESA-N 1 1 446.889 3.098 20 0 IGADMO CCOc1cc2ncnc(N3C[C@@H]4C[N@H+](Cc5cnn(C)c5)CC[C@@H]4C3)c2cc1OCC ZINC001164763387 721135321 /nfs/dbraw/zinc/13/53/21/721135321.db2.gz FLKCUZKMUOKLTO-MOPGFXCFSA-N 1 1 436.560 3.119 20 0 IGADMO FC(F)(c1c2c(nnc1Cl)CCC2)N1CC[N@H+]2C[C@H](OCc3cccnc3)C[C@H]2C1 ZINC001164881194 721149373 /nfs/dbraw/zinc/14/93/73/721149373.db2.gz ZRENJIWJKVWUGD-JKSUJKDBSA-N 1 1 435.906 3.038 20 0 IGADMO Cc1ccc(-c2nc3c(ncnc3N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@H]4C3)o2)cc1 ZINC001164871089 721152839 /nfs/dbraw/zinc/15/28/39/721152839.db2.gz DMUKKINMCNSPOD-LEWJYISDSA-N 1 1 442.523 3.468 20 0 IGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4nc(Cl)nc(Oc5cccc(F)c5)n4)C[C@@H]3C2)cn1 ZINC001164762099 721164150 /nfs/dbraw/zinc/16/41/50/721164150.db2.gz BXKQILDPTGODJA-HOTGVXAUSA-N 1 1 443.914 3.148 20 0 IGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(C(F)(F)Oc4ccc5c(Cl)ncnc5c4)C[C@H]3C2)cn1 ZINC001164774428 721173016 /nfs/dbraw/zinc/17/30/16/721173016.db2.gz ZCJIVRWNSSCUKQ-HZPDHXFCSA-N 1 1 448.905 3.400 20 0 IGADMO COc1ccc(Oc2cc(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@@H]4C3)nc(C)n2)cc1 ZINC001164873576 721174710 /nfs/dbraw/zinc/17/47/10/721174710.db2.gz IQXCCFYJYOWXGA-OFNKIYASSA-N 1 1 447.539 3.461 20 0 IGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4nc(-c5cccnc5)nc5ccccc54)C[C@@H]3C2)cn1 ZINC001164772332 721194110 /nfs/dbraw/zinc/19/41/10/721194110.db2.gz SGOMHSSNJWNIGO-RTWAWAEBSA-N 1 1 425.540 3.384 20 0 IGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4nc(-c5ccncc5)nc5sccc54)C[C@@H]3C2)cn1 ZINC001164759472 721229836 /nfs/dbraw/zinc/22/98/36/721229836.db2.gz AMYJORRNUAPNIJ-OALUTQOASA-N 1 1 431.569 3.445 20 0 IGADMO Cc1cccc2cc(Cl)nc(N3CCC4(CC3)COCC[N@H+](CC(=O)N(C)C)C4)c12 ZINC001164877848 721291940 /nfs/dbraw/zinc/29/19/40/721291940.db2.gz PDBXCSVFCFEHFK-UHFFFAOYSA-N 1 1 430.980 3.204 20 0 IGADMO O=C(c1ccccc1)N1CCO[C@@H]2CN(c3nc(Cl)ccc3C[NH+]3CCCC3)C[C@@H]2C1 ZINC001164885847 721349954 /nfs/dbraw/zinc/34/99/54/721349954.db2.gz QMYZPBHWNQZSNO-LEWJYISDSA-N 1 1 440.975 3.308 20 0 IGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@]2(CCCN(c3nccc(N4CCCCC4)n3)C2)C1 ZINC001164780316 721357547 /nfs/dbraw/zinc/35/75/47/721357547.db2.gz GAWBZURKAMBYBR-XMMPIXPASA-N 1 1 440.592 3.191 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@]2(CCCN(c3nccc(N4CCCCC4)n3)C2)C1 ZINC001164780316 721357552 /nfs/dbraw/zinc/35/75/52/721357552.db2.gz GAWBZURKAMBYBR-XMMPIXPASA-N 1 1 440.592 3.191 20 0 IGADMO CCN(CC)c1cncc(N2CCC[C@@]3(C2)COCC[N@H+](Cc2c(C)noc2C)C3)n1 ZINC001164782931 721358406 /nfs/dbraw/zinc/35/84/06/721358406.db2.gz NRTYKKOHEBDRDM-HSZRJFAPSA-N 1 1 428.581 3.047 20 0 IGADMO CCN(CC)c1cncc(N2CCC[C@@]3(C2)COCC[N@@H+](Cc2c(C)noc2C)C3)n1 ZINC001164782931 721358411 /nfs/dbraw/zinc/35/84/11/721358411.db2.gz NRTYKKOHEBDRDM-HSZRJFAPSA-N 1 1 428.581 3.047 20 0 IGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@]2(CCCN(c3ncc4cc(F)ccc4n3)C2)C1 ZINC001164784318 721360280 /nfs/dbraw/zinc/36/02/80/721360280.db2.gz RHCUTIDIPBILBG-HSZRJFAPSA-N 1 1 425.508 3.493 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@]2(CCCN(c3ncc4cc(F)ccc4n3)C2)C1 ZINC001164784318 721360283 /nfs/dbraw/zinc/36/02/83/721360283.db2.gz RHCUTIDIPBILBG-HSZRJFAPSA-N 1 1 425.508 3.493 20 0 IGADMO C[NH+]1CCN(C[C@@H]2CCC[C@]3(CCN(c4nc(Cl)nc5ccc(F)cc54)C3)O2)CC1 ZINC001164891854 721388771 /nfs/dbraw/zinc/38/87/71/721388771.db2.gz QXUMQXJEQZZDFM-HTAPYJJXSA-N 1 1 433.959 3.188 20 0 IGADMO C[NH+]1CCN(C[C@@H]2CCC[C@]3(CCN(c4nccnc4C4SCCCS4)C3)O2)CC1 ZINC001164889365 721399515 /nfs/dbraw/zinc/39/95/15/721399515.db2.gz LUIOJXRFPGPVSK-PGRDOPGGSA-N 1 1 449.690 3.111 20 0 IGADMO CCOC(=O)c1cnc(-c2cccs2)nc1N1C[C@@H]2C[NH+](Cc3nccs3)C[C@H]2C1 ZINC001164786852 721405494 /nfs/dbraw/zinc/40/54/94/721405494.db2.gz PHVGTXJGAUQNIZ-GJZGRUSLSA-N 1 1 441.582 3.407 20 0 IGADMO Cc1ccc2c(c1)nc(Cl)nc2N1CC[C@@]2(C1)CCC[C@H](CN1CC[NH+](C)CC1)O2 ZINC001164885214 721413025 /nfs/dbraw/zinc/41/30/25/721413025.db2.gz GGJDVIQXUDTYFW-WZONZLPQSA-N 1 1 429.996 3.357 20 0 IGADMO Fc1ccccc1Cn1cnc2c1ncnc2N1C[C@@H]2C[N@@H+](Cc3nccs3)C[C@@H]2C1 ZINC001164780602 721416070 /nfs/dbraw/zinc/41/60/70/721416070.db2.gz BNOOGCAMLYJCIE-CALCHBBNSA-N 1 1 435.532 3.038 20 0 IGADMO Fc1ccccc1Cn1cnc2c1ncnc2N1C[C@@H]2C[N@H+](Cc3nccs3)C[C@@H]2C1 ZINC001164780602 721416073 /nfs/dbraw/zinc/41/60/73/721416073.db2.gz BNOOGCAMLYJCIE-CALCHBBNSA-N 1 1 435.532 3.038 20 0 IGADMO C[NH+]1CCN(C[C@H]2CCC[C@@]3(CCN(c4ncc5c(n4)-c4ccccc4CC5)C3)O2)CC1 ZINC001164895378 721427909 /nfs/dbraw/zinc/42/79/09/721427909.db2.gz OCSXWBGXRZTSCG-GJZUVCINSA-N 1 1 433.600 3.008 20 0 IGADMO C[NH+]1CCN(C[C@H]2CCC[C@@]3(CCN(c4ccc(-c5c(F)cccc5F)nn4)C3)O2)CC1 ZINC001164893657 721441521 /nfs/dbraw/zinc/44/15/21/721441521.db2.gz JVPKPPYTZNVGRD-KOSHJBKYSA-N 1 1 443.542 3.187 20 0 IGADMO Cc1cnc(N2CC[C@]3(C2)CCC[C@@H](CN2CC[NH+](C)CC2)O3)nc1-c1ccccc1F ZINC001164887150 721448494 /nfs/dbraw/zinc/44/84/94/721448494.db2.gz IXZAXXADMONGFJ-CPJSRVTESA-N 1 1 439.579 3.357 20 0 IGADMO C[NH+]1CCN(C[C@@H]2CCC[C@@]3(CCN(c4ncnc5[nH]c6cc(F)ccc6c54)C3)O2)CC1 ZINC001164887135 721452915 /nfs/dbraw/zinc/45/29/15/721452915.db2.gz IVOFKRXSAXCCJV-UUOWRZLLSA-N 1 1 438.551 3.016 20 0 IGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1nc(Cl)nc3cccnc31)CC2 ZINC001164790558 721454836 /nfs/dbraw/zinc/45/48/36/721454836.db2.gz ZENWMENNDCLGFG-GOSISDBHSA-N 1 1 445.995 3.412 20 0 IGADMO CCOC(=O)c1cc(N2CCC3(C[C@H](COCC4CC4)[N@@H+](CCOC)C3)CC2)ncc1C ZINC001164782355 721460813 /nfs/dbraw/zinc/46/08/13/721460813.db2.gz AIDUBVJCWBPWCN-OAQYLSRUSA-N 1 1 445.604 3.301 20 0 IGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1ccnc(-c3cccnc3)n1)CC2 ZINC001164782774 721461955 /nfs/dbraw/zinc/46/19/55/721461955.db2.gz BSOWQOYLONIZAI-JOCHJYFZSA-N 1 1 437.588 3.273 20 0 IGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1nc3ccccc3c(OC)n1)CC2 ZINC001164785736 721462109 /nfs/dbraw/zinc/46/21/09/721462109.db2.gz NGAAMHPHNLSLBT-FQEVSTJZSA-N 1 1 440.588 3.372 20 0 IGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1ncc(C)cc1C(OC)OC)CC2 ZINC001164782802 721464108 /nfs/dbraw/zinc/46/41/08/721464108.db2.gz CJYUPXZBTQCDJX-NRFANRHFSA-N 1 1 447.620 3.415 20 0 IGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1c(F)nc(F)nc1Cl)CC2 ZINC001164787184 721465260 /nfs/dbraw/zinc/46/52/60/721465260.db2.gz DCOHGMAAEGQECB-OAHLLOKOSA-N 1 1 430.927 3.142 20 0 IGADMO CCC[N@H+]1CCCC[C@@H]1c1ccc(N2C[C@H]3COC[C@]3(CC(=O)NCC3CC3)C2)nc1 ZINC001164893902 721484695 /nfs/dbraw/zinc/48/46/95/721484695.db2.gz FSNOIGKSPCOGNF-FBLLAGFSSA-N 1 1 426.605 3.388 20 0 IGADMO O=C1NC2(C[C@@H]1c1ccncc1)CCN(c1nc(Cl)ccc1C[NH+]1CCCC1)CC2 ZINC001164899677 721504302 /nfs/dbraw/zinc/50/43/02/721504302.db2.gz ZVPHGLFLGNGFTL-LJQANCHMSA-N 1 1 425.964 3.369 20 0 IGADMO CN(C)c1cc(Cl)nc(C(F)(F)N2CC[N@H+]3C[C@@H](Oc4cccc(F)c4)C[C@H]3C2)n1 ZINC001164901454 721518439 /nfs/dbraw/zinc/51/84/39/721518439.db2.gz XPALCKOYFMMGOB-HOCLYGCPSA-N 1 1 441.885 3.222 20 0 IGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2nnc(Cl)cc2-c2ccncc2)[C@@H]2CCCO[C@H]12 ZINC001164807802 721534979 /nfs/dbraw/zinc/53/49/79/721534979.db2.gz RJFACWKGVZZSSE-SJBKTWHCSA-N 1 1 436.947 3.455 20 0 IGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2nnc(Cl)cc2-c2ccncc2)[C@@H]2CCCO[C@H]12 ZINC001164807802 721534982 /nfs/dbraw/zinc/53/49/82/721534982.db2.gz RJFACWKGVZZSSE-SJBKTWHCSA-N 1 1 436.947 3.455 20 0 IGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2nc(Cl)nc3c2CSCC3)[C@H]2CCCO[C@H]12 ZINC001164809412 721535309 /nfs/dbraw/zinc/53/53/09/721535309.db2.gz UMRVMIZKAYIKHJ-OTWHNJEPSA-N 1 1 431.993 3.183 20 0 IGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2nc(Cl)nc3c2CSCC3)[C@H]2CCCO[C@H]12 ZINC001164809412 721535313 /nfs/dbraw/zinc/53/53/13/721535313.db2.gz UMRVMIZKAYIKHJ-OTWHNJEPSA-N 1 1 431.993 3.183 20 0 IGADMO COC(=O)c1ccc2c(ccnc2N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@H]3OCCC[C@@H]32)c1 ZINC001164806646 721547712 /nfs/dbraw/zinc/54/77/12/721547712.db2.gz PPKMAKVOXOOVRH-VABKMULXSA-N 1 1 432.524 3.285 20 0 IGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(C(F)(F)COc2ccnc(Cl)c2)[C@@H]2CCCO[C@H]12 ZINC001164802991 721552018 /nfs/dbraw/zinc/55/20/18/721552018.db2.gz HCHHOIXRIZRVKH-GGPKGHCWSA-N 1 1 438.906 3.465 20 0 IGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(C(F)(F)COc2ccnc(Cl)c2)[C@@H]2CCCO[C@H]12 ZINC001164802991 721552023 /nfs/dbraw/zinc/55/20/23/721552023.db2.gz HCHHOIXRIZRVKH-GGPKGHCWSA-N 1 1 438.906 3.465 20 0 IGADMO C[C@@H]1CCCN(C(=O)c2ccc(N3CC[N@H+]4C[C@H](Oc5cccc(F)c5)C[C@@H]4C3)nc2)C1 ZINC001164910303 721552673 /nfs/dbraw/zinc/55/26/73/721552673.db2.gz WGAUQBGVDGXOCR-JMUQELJHSA-N 1 1 438.547 3.435 20 0 IGADMO CCOC(=O)c1ccc2ncnc(N3C[C@H]([N@H+](C)Cc4cccnc4)[C@H]4OCCC[C@H]43)c2c1 ZINC001164805718 721555108 /nfs/dbraw/zinc/55/51/08/721555108.db2.gz OOYYFZHMUJZOEX-VJBWXMMDSA-N 1 1 447.539 3.070 20 0 IGADMO CCOC(=O)c1ccc2ncnc(N3C[C@H]([N@@H+](C)Cc4cccnc4)[C@H]4OCCC[C@H]43)c2c1 ZINC001164805718 721555110 /nfs/dbraw/zinc/55/51/10/721555110.db2.gz OOYYFZHMUJZOEX-VJBWXMMDSA-N 1 1 447.539 3.070 20 0 IGADMO COC(=O)c1cc2ccccc2nc1N1C[C@H]([N@H+](C)Cc2cccnc2)[C@@H]2OCCC[C@H]21 ZINC001164799626 721566446 /nfs/dbraw/zinc/56/64/46/721566446.db2.gz CZCDELOUOUIJJK-XPWALMASSA-N 1 1 432.524 3.285 20 0 IGADMO COC(=O)c1cc2ccccc2nc1N1C[C@H]([N@@H+](C)Cc2cccnc2)[C@@H]2OCCC[C@H]21 ZINC001164799626 721566448 /nfs/dbraw/zinc/56/64/48/721566448.db2.gz CZCDELOUOUIJJK-XPWALMASSA-N 1 1 432.524 3.285 20 0 IGADMO COc1cccc(-c2ccnc(N3C[C@H]([N@H+](C)Cc4cccnc4)[C@H]4OCCC[C@H]43)n2)c1 ZINC001164807343 721567695 /nfs/dbraw/zinc/56/76/95/721567695.db2.gz SSKGZPFDNNJZMP-SGNDLWITSA-N 1 1 431.540 3.415 20 0 IGADMO COc1cccc(-c2ccnc(N3C[C@H]([N@@H+](C)Cc4cccnc4)[C@H]4OCCC[C@H]43)n2)c1 ZINC001164807343 721567697 /nfs/dbraw/zinc/56/76/97/721567697.db2.gz SSKGZPFDNNJZMP-SGNDLWITSA-N 1 1 431.540 3.415 20 0 IGADMO NC(=S)c1cnc(N2CC[N@H+]3C[C@@H](Oc4cccc(F)c4)C[C@H]3C2)c2sccc21 ZINC001164907584 721567959 /nfs/dbraw/zinc/56/79/59/721567959.db2.gz OSBUIESZPXKNND-HOCLYGCPSA-N 1 1 428.558 3.412 20 0 IGADMO CCOC(=O)c1cnc2cc(N3C[C@H]([N@@H+](C)Cc4cccnc4)[C@@H]4OCCC[C@H]43)[nH]cc1-2 ZINC001164801182 721573822 /nfs/dbraw/zinc/57/38/22/721573822.db2.gz GJQIXASIRQKTNE-FUPPJEDESA-N 1 1 435.528 3.003 20 0 IGADMO CCOC[C@@H]1c2c(cnn2CC2CCOCC2)CCN1c1ccc(C[N@@H+](C)C2CC2)cn1 ZINC001164903048 721578504 /nfs/dbraw/zinc/57/85/04/721578504.db2.gz KNDVAUGLZBWBLA-HSZRJFAPSA-N 1 1 439.604 3.439 20 0 IGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(C(F)(F)c2nc3ccc(Cl)nc3[nH]2)[C@H]2CCCO[C@H]12 ZINC001164808344 721582191 /nfs/dbraw/zinc/58/21/91/721582191.db2.gz QUKZNNMJIXEXST-JZXOWHBKSA-N 1 1 448.905 3.419 20 0 IGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(C(F)(F)c2nc3ccc(Cl)nc3[nH]2)[C@H]2CCCO[C@H]12 ZINC001164808344 721582195 /nfs/dbraw/zinc/58/21/95/721582195.db2.gz QUKZNNMJIXEXST-JZXOWHBKSA-N 1 1 448.905 3.419 20 0 IGADMO O=C(c1cccnc1N1CCC(F)(F)[C@@]2(CC[N@@H+](Cc3ccccn3)C2)C1)N1CCCC1 ZINC001164901767 721583488 /nfs/dbraw/zinc/58/34/88/721583488.db2.gz AKZFAHHBGGWQRL-HSZRJFAPSA-N 1 1 441.526 3.450 20 0 IGADMO COC(=O)c1cnc(Cl)nc1N1CCC(F)(F)[C@@]2(CC[N@@H+](Cc3ccccn3)C2)C1 ZINC001164903765 721584923 /nfs/dbraw/zinc/58/49/23/721584923.db2.gz CEFIISSNTYJODP-LJQANCHMSA-N 1 1 437.878 3.049 20 0 IGADMO c1nc(COCC2CC2)c2n1CCN(c1ncnc3c1CC[N@H+](Cc1ccccc1)C3)C2 ZINC001164799619 721599860 /nfs/dbraw/zinc/59/98/60/721599860.db2.gz IWZDWFXEWUUKMO-UHFFFAOYSA-N 1 1 430.556 3.178 20 0 IGADMO c1nc(COCC2CC2)c2n1CCN(c1ncnc3c1CC[N@@H+](Cc1ccccc1)C3)C2 ZINC001164799619 721599862 /nfs/dbraw/zinc/59/98/62/721599862.db2.gz IWZDWFXEWUUKMO-UHFFFAOYSA-N 1 1 430.556 3.178 20 0 IGADMO CN(C)C(=O)C[NH+]1CCC2(CCCN2C(F)(F)c2c[nH]c3nc(Cl)ccc23)CC1 ZINC001165010673 721737544 /nfs/dbraw/zinc/73/75/44/721737544.db2.gz JXVLFQGLXPAJNV-UHFFFAOYSA-N 1 1 425.911 3.284 20 0 IGADMO CC(C)(c1ccnc(Cl)c1)[N@H+]1CC[C@@H]2OCC[C@H](C(=O)NCCc3ccncc3)[C@@H]2C1 ZINC001165012577 721754197 /nfs/dbraw/zinc/75/41/97/721754197.db2.gz FDORHSNZGJZMCD-ACRUOGEOSA-N 1 1 442.991 3.451 20 0 IGADMO C[N@H+](Cc1ccco1)Cc1cncc2c1CCN(c1c(Cl)nc(Cl)nc1C(N)=O)C2 ZINC001164910827 721756279 /nfs/dbraw/zinc/75/62/79/721756279.db2.gz SHBWZWQRMUIOES-UHFFFAOYSA-N 1 1 447.326 3.065 20 0 IGADMO C[N@@H+](Cc1ccco1)Cc1cncc2c1CCN(c1c(Cl)nc(Cl)nc1C(N)=O)C2 ZINC001164910827 721756285 /nfs/dbraw/zinc/75/62/85/721756285.db2.gz SHBWZWQRMUIOES-UHFFFAOYSA-N 1 1 447.326 3.065 20 0 IGADMO COc1ccc2c(C)cc(N3CCO[C@]4(C3)COCCN(Cc3cccnc3)C4)[nH+]c2c1 ZINC001164915996 721788625 /nfs/dbraw/zinc/78/86/25/721788625.db2.gz NCZYHTQUELWBDU-RUZDIDTESA-N 1 1 434.540 3.055 20 0 IGADMO CCOC(=O)c1nnc(Cl)cc1N1C[C@@H]2CCC[C@@H]([N@@H+](C)Cc3ccccn3)[C@@H]2C1 ZINC001165025948 721810104 /nfs/dbraw/zinc/81/01/04/721810104.db2.gz OLEGZMDCSFFREG-CGTJXYLNSA-N 1 1 429.952 3.439 20 0 IGADMO C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@H]2CN(c3ccc(Cn4ccccc4=O)cn3)C[C@H]21 ZINC001165019883 721825396 /nfs/dbraw/zinc/82/53/96/721825396.db2.gz CJAFJIPQLSLKJF-QPTUXGOLSA-N 1 1 429.568 3.424 20 0 IGADMO C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@@H]2CN(c3ccc(Cn4ccccc4=O)cn3)C[C@@H]21 ZINC001165019887 721825454 /nfs/dbraw/zinc/82/54/54/721825454.db2.gz CJAFJIPQLSLKJF-YFNKSVMNSA-N 1 1 429.568 3.424 20 0 IGADMO Clc1ccc(C[NH+]2CCCC2)c(N2C[C@H]3COC[C@]3(COCc3ccccn3)C2)n1 ZINC001164921778 721839244 /nfs/dbraw/zinc/83/92/44/721839244.db2.gz FWBSGUVUGNMNSC-CVDCTZTESA-N 1 1 428.964 3.395 20 0 IGADMO CN1C(=O)CC[C@@H]2[C@H]1CCN2c1nc(C[NH+]2CCCCC2)nc2sc3c(c21)CCC3 ZINC001164934356 721893371 /nfs/dbraw/zinc/89/33/71/721893371.db2.gz PTNSBWDVWJUYOS-IAGOWNOFSA-N 1 1 425.602 3.365 20 0 IGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2CC[C@@]3(C[C@H](OCC(=O)N4CCCC4)CO3)C2)nc1 ZINC001164937299 721919345 /nfs/dbraw/zinc/91/93/45/721919345.db2.gz BEPKSTIBEXEZSW-SGIRGMQISA-N 1 1 442.604 3.005 20 0 IGADMO CC[N@H+]1CCCC[C@H]1c1ccc(N2CCN(C(=O)[C@@H]3COc4ccccc4O3)CC2)nc1 ZINC001165049878 721981867 /nfs/dbraw/zinc/98/18/67/721981867.db2.gz NEKBDVYFPMXMPS-REWPJTCUSA-N 1 1 436.556 3.117 20 0 IGADMO C=Cc1nc(Cl)nc(N2CCC3(CC2)COCC[N@@H+](Cc2ccncc2)C3)c1OC ZINC001164962337 722059206 /nfs/dbraw/zinc/05/92/06/722059206.db2.gz RCVQWQQGTMZBEQ-UHFFFAOYSA-N 1 1 429.952 3.296 20 0 IGADMO CC(=O)N1[C@@H]2CCN(c3nc(Cl)ccc3C[NH+]3CCCC3)C[C@@H]2C[C@H]1Cn1cccn1 ZINC001164969528 722080499 /nfs/dbraw/zinc/08/04/99/722080499.db2.gz LERXATSQCUYIQO-PCCBWWKXSA-N 1 1 442.995 3.043 20 0 IGADMO FC(F)(c1cnc(Cl)nc1Cl)N1CC[C@H]2C[N@@H+](Cc3cccnc3)CCO[C@H]2C1 ZINC001164986403 722101088 /nfs/dbraw/zinc/10/10/88/722101088.db2.gz YXVROGVEOCTUSO-HOCLYGCPSA-N 1 1 444.313 3.451 20 0 IGADMO COC(=O)c1ccc2c(ccnc2N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)c1 ZINC001164981124 722111204 /nfs/dbraw/zinc/11/12/04/722111204.db2.gz SXGURVZVSKBJSJ-FYYLOGMGSA-N 1 1 432.524 3.144 20 0 IGADMO O=C(Nc1ccccc1)c1ccnc(N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)c1 ZINC001164979781 722119840 /nfs/dbraw/zinc/11/98/40/722119840.db2.gz PYAGGKIQONQCRN-LADGPHEKSA-N 1 1 443.551 3.456 20 0 IGADMO CCOC(=O)c1cnc(N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)c(Cl)c1 ZINC001164973068 722120309 /nfs/dbraw/zinc/12/03/09/722120309.db2.gz GHEQXCDNIQWTSE-PXNSSMCTSA-N 1 1 430.936 3.034 20 0 IGADMO CCOC(=O)c1cnc(Cl)c(C)c1N1CC[C@H]2C[N@@H+](Cc3cccnc3)CCO[C@@H]2C1 ZINC001164973840 722124015 /nfs/dbraw/zinc/12/40/15/722124015.db2.gz HLWQNXRALPMNJY-AZUAARDMSA-N 1 1 444.963 3.342 20 0 IGADMO COc1cccc(Oc2cncc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)n2)c1 ZINC001164977104 722131698 /nfs/dbraw/zinc/13/16/98/722131698.db2.gz ITAUVXURQIRPFN-REWPJTCUSA-N 1 1 447.539 3.400 20 0 IGADMO c1ccc2c(c1)CCc1cnc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)nc1-2 ZINC001164982285 722133952 /nfs/dbraw/zinc/13/39/52/722133952.db2.gz RNVYZQOSMSFYAI-LADGPHEKSA-N 1 1 427.552 3.365 20 0 IGADMO FC(F)(c1cc(Cl)nc(=S)[nH]1)N1CC[C@H]2C[N@@H+](Cc3cccnc3)CCO[C@H]2C1 ZINC001164982017 722134957 /nfs/dbraw/zinc/13/49/57/722134957.db2.gz QROAWYYNYMTUFP-GJZGRUSLSA-N 1 1 441.935 3.086 20 0 IGADMO Clc1nc2c(Cl)nccc2c(N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)n1 ZINC001164979681 722137597 /nfs/dbraw/zinc/13/75/97/722137597.db2.gz LSYCPITZRFFEAF-NVXWUHKLSA-N 1 1 445.354 3.454 20 0 IGADMO CC1CCN(C(=O)c2cccnc2N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)CC1 ZINC001164982788 722140509 /nfs/dbraw/zinc/14/05/09/722140509.db2.gz SPPHWSJJNZNIOF-LADGPHEKSA-N 1 1 449.599 3.076 20 0 IGADMO NC(=S)c1cnc(N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)c2sccc21 ZINC001164972235 722157856 /nfs/dbraw/zinc/15/78/56/722157856.db2.gz HLJREFZNFKBFIU-QFBILLFUSA-N 1 1 439.610 3.053 20 0 IGADMO CCOC(=O)N1CCc2nnc(N3CCC[C@@]4(CC[N@H+]4Cc4cccc(F)c4)C3)cc2C1 ZINC001164997197 722208199 /nfs/dbraw/zinc/20/81/99/722208199.db2.gz WZXXYYMQUXJCPD-XMMPIXPASA-N 1 1 439.535 3.375 20 0 IGADMO C[NH+]1CCN(c2ncnc3c2CCN(c2cc4nc(Cl)cnc4cc2Cl)CC3)CC1 ZINC001164996832 722232765 /nfs/dbraw/zinc/23/27/65/722232765.db2.gz KGEIMPLJFRDAMH-UHFFFAOYSA-N 1 1 444.370 3.084 20 0 IGADMO C[NH+]1CCN(c2ncnc3c2CCN(c2nnc(Cl)c4ccc(Cl)cc42)CC3)CC1 ZINC001165001952 722239299 /nfs/dbraw/zinc/23/92/99/722239299.db2.gz PKGYXCMCSSJAGY-UHFFFAOYSA-N 1 1 444.370 3.084 20 0 IGADMO CC[C@H](C)c1nc(Cl)c(C)c(N2CCc3ncnc(N4CC[NH+](C)CC4)c3CC2)n1 ZINC001165001084 722239428 /nfs/dbraw/zinc/23/94/28/722239428.db2.gz BRJMBLIWMREPPK-HNNXBMFYSA-N 1 1 430.000 3.099 20 0 IGADMO C[NH+]1CCN(c2ncnc3c2CCN(C(F)(F)C2(c4ccnc(Cl)c4)CC2)CC3)CC1 ZINC001165004345 722240069 /nfs/dbraw/zinc/24/00/69/722240069.db2.gz OAMTYANIQOPQNP-UHFFFAOYSA-N 1 1 448.949 3.002 20 0 IGADMO CN1CCN(c2cccc(N(c3cccc(F)c3)[C@@H]3CO[C@]4(C3)CCC[NH2+]C4)n2)CC1 ZINC001164646336 719297024 /nfs/dbraw/zinc/29/70/24/719297024.db2.gz AJTMALHGVZLCFJ-URXFXBBRSA-N 1 1 425.552 3.022 20 0 IGADMO COC(=O)c1ccc(C(F)(F)N2CCc3c(C[NH+](C)C)nn(C(C)C)c3C2)nc1Cl ZINC001164647413 719308793 /nfs/dbraw/zinc/30/87/93/719308793.db2.gz LYJOUYIIWAAHLS-UHFFFAOYSA-N 1 1 441.910 3.468 20 0 IGADMO COC(=O)c1nc(Cl)ccc1C(F)(F)N1CCc2c(C[NH+](C)C)nn(C(C)C)c2C1 ZINC001164648176 719310481 /nfs/dbraw/zinc/31/04/81/719310481.db2.gz FYGAKSXOWKVDTL-UHFFFAOYSA-N 1 1 441.910 3.468 20 0 IGADMO CCOC[C@@H]1CN(c2cc(OC3CC[NH+](C)CC3)ccn2)Cc2nn(CC3CC3)cc21 ZINC001164663239 719364295 /nfs/dbraw/zinc/36/42/95/719364295.db2.gz IHKGCQXWYPWFRA-IBGZPJMESA-N 1 1 425.577 3.301 20 0 IGADMO CNC(=O)C[N@H+]1CCCC12CCN(c1ncc(OCc3ccccc3)cc1Cl)CC2 ZINC001164683621 719733641 /nfs/dbraw/zinc/73/36/41/719733641.db2.gz BDTVAHWRRBPAJZ-UHFFFAOYSA-N 1 1 428.964 3.495 20 0 IGADMO CNC(=O)C[N@H+]1CCCC12CCN(c1ccc(-c3ccc(C(=O)OC)cc3)c(C)n1)CC2 ZINC001164689888 719737896 /nfs/dbraw/zinc/73/78/96/719737896.db2.gz NSZSLBKGADHYIN-UHFFFAOYSA-N 1 1 436.556 3.024 20 0 IGADMO CNC(=O)C[N@H+]1CCCC12CCN(c1nc(C)nc3sc4c(c31)CCCCC4)CC2 ZINC001164689298 719741894 /nfs/dbraw/zinc/74/18/94/719741894.db2.gz ABMYURRMTZLGGJ-UHFFFAOYSA-N 1 1 427.618 3.449 20 0 IGADMO COC(=O)[C@]1(C)C[C@H]([NH+]2CCOCC2)CCN1c1nc(Cl)nc2ccc(Cl)cc21 ZINC001164697336 719838897 /nfs/dbraw/zinc/83/88/97/719838897.db2.gz CRFJQMHNZXNNBM-VLIAUNLRSA-N 1 1 439.343 3.169 20 0 IGADMO COC(=O)[C@]1(C)C[C@H]([NH+]2CCOCC2)CCN1c1ncnc2sc3c(c21)CC[C@@H](C)C3 ZINC001164701446 719853746 /nfs/dbraw/zinc/85/37/46/719853746.db2.gz KNSIPFDIFWRTRZ-LNPFQXMTSA-N 1 1 444.601 3.049 20 0 IGADMO COC(=O)[C@]1(C)C[C@H]([NH+]2CCOCC2)CCN1c1nnc(Cl)c2ccc(Cl)cc21 ZINC001164708219 719874515 /nfs/dbraw/zinc/87/45/15/719874515.db2.gz YRKPOTVUNWVLHW-VLIAUNLRSA-N 1 1 439.343 3.169 20 0 IGADMO COC(=O)c1cccc2nc(N3CCC4(CC3)C[N@H+](Cc3cccs3)CCO4)ncc21 ZINC001164695018 719889715 /nfs/dbraw/zinc/88/97/15/719889715.db2.gz JGNPRRJJDIUDJG-UHFFFAOYSA-N 1 1 438.553 3.349 20 0 IGADMO COC(=O)c1cccc2nc(N3CCC4(CC3)C[N@@H+](Cc3cccs3)CCO4)ncc21 ZINC001164695018 719889716 /nfs/dbraw/zinc/88/97/16/719889716.db2.gz JGNPRRJJDIUDJG-UHFFFAOYSA-N 1 1 438.553 3.349 20 0 IGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1nc3cc(C(=O)OC)ccc3nc1Cl)C2 ZINC001164810415 720078833 /nfs/dbraw/zinc/07/88/33/720078833.db2.gz LSSCXCQMXSQZIR-SBUREZEXSA-N 1 1 444.963 3.255 20 0 IGADMO COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1cc(Cl)nc(N(C)C)n1)CC2 ZINC001164712700 720094425 /nfs/dbraw/zinc/09/44/25/720094425.db2.gz YGHOWUMMGOZHDW-GOSISDBHSA-N 1 1 430.984 3.099 20 0 IGADMO CCOC(=O)Cc1ccc(N2CCC3(C[C@H](COC)[N@@H+](Cc4ccccn4)C3)CC2)nc1 ZINC001164718998 720119502 /nfs/dbraw/zinc/11/95/02/720119502.db2.gz UPGIWPVNVRWSDS-JOCHJYFZSA-N 1 1 438.572 3.090 20 0 IGADMO CCOc1c(Cl)ncnc1N1CCC2(C[C@H](COC)[N@@H+](Cc3ccccn3)C2)CC1 ZINC001164716876 720122083 /nfs/dbraw/zinc/12/20/83/720122083.db2.gz LEAIKSVBTGZANF-GOSISDBHSA-N 1 1 431.968 3.431 20 0 IGADMO COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1nc[nH]c3nc(=S)sc1-3)CC2 ZINC001164712232 720136398 /nfs/dbraw/zinc/13/63/98/720136398.db2.gz LJZVWYFVEIDESN-INIZCTEOSA-N 1 1 442.614 3.278 20 0 IGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1ncccc1C(=O)N1CCC(C)CC1)C2 ZINC001164820266 720167163 /nfs/dbraw/zinc/16/71/63/720167163.db2.gz ZWBPIVUNYPJRPD-OFVILXPXSA-N 1 1 426.605 3.138 20 0 IGADMO Cc1cnc(N2CCCn3c(=O)cc(C[N@H+](C)C(C)C)nc3C2)nc1-c1ccccc1F ZINC001164817650 720246041 /nfs/dbraw/zinc/24/60/41/720246041.db2.gz RVLCSAKAVGLFMJ-UHFFFAOYSA-N 1 1 436.535 3.398 20 0 IGADMO CNC(=O)C[N@@H+]1CCOC[C@@]2(CCCN(c3c(Cl)ccc4ccc(Cl)nc43)C2)C1 ZINC001164721012 720305054 /nfs/dbraw/zinc/30/50/54/720305054.db2.gz CPXTYZMEVINOAC-NRFANRHFSA-N 1 1 437.371 3.206 20 0 IGADMO CNC(=O)C[N@H+]1CCOC[C@@]2(CCCN(c3c(Cl)ccc4ccc(Cl)nc43)C2)C1 ZINC001164721012 720305058 /nfs/dbraw/zinc/30/50/58/720305058.db2.gz CPXTYZMEVINOAC-NRFANRHFSA-N 1 1 437.371 3.206 20 0 IGADMO COc1cc2ccnc(N3CC[C@H]4[C@@H]3CCC(=O)N4CC3CC[NH+](C)CC3)c2cc1OC ZINC001164831926 720321963 /nfs/dbraw/zinc/32/19/63/720321963.db2.gz SEBZQSXAPXPRRI-SFTDATJTSA-N 1 1 438.572 3.164 20 0 IGADMO Fc1ccccc1Cn1cnc2c1ncnc2N1CC[C@H]2[C@H]1CC[N@H+]2Cc1cccnc1 ZINC001164731011 720400609 /nfs/dbraw/zinc/40/06/09/720400609.db2.gz XZVDWJWULUJWRW-LEWJYISDSA-N 1 1 429.503 3.262 20 0 IGADMO CC(C)CNC(=O)c1ccc2c(c1)ncnc2N1CC[C@H]2[C@H]1CC[N@H+]2Cc1cccnc1 ZINC001164730938 720415276 /nfs/dbraw/zinc/41/52/76/720415276.db2.gz JWFICHANGJYQHD-XZOQPEGZSA-N 1 1 430.556 3.264 20 0 IGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@@H]2CN(c3ncc(C(=O)N(C)C)cc3Cl)CC[C@@H]21 ZINC001164839248 720611016 /nfs/dbraw/zinc/61/10/16/720611016.db2.gz MWFMJUANGCTMEV-HBFSDRIKSA-N 1 1 430.984 3.011 20 0 IGADMO CC(C)[N@@H+]1[C@@H]2CCN(c3ncc(C(=O)N(C)C)cc3Cl)C[C@H]2C[C@H]1Cn1cccn1 ZINC001164839249 720612060 /nfs/dbraw/zinc/61/20/60/720612060.db2.gz MWFMJUANGCTMEV-WSTZPKSXSA-N 1 1 430.984 3.011 20 0 IGADMO COC(=O)c1cnc(Cl)nc1N1CCC2(C[C@H]([N@@H+](C)Cc3ccccc3)CO2)CC1 ZINC001164838869 720661251 /nfs/dbraw/zinc/66/12/51/720661251.db2.gz IDNIXRYIIGVUMT-KRWDZBQOSA-N 1 1 430.936 3.177 20 0 IGADMO Fc1ccc(Oc2ccc(Cl)nn2)c(N2CC[N@H+]3C[C@H](Oc4cncnc4)C[C@H]3C2)c1 ZINC001164743404 720759393 /nfs/dbraw/zinc/75/93/93/720759393.db2.gz PVAYLBWCAHZENS-JKSUJKDBSA-N 1 1 442.882 3.193 20 0 IGADMO C[NH+]1CCC(Oc2ccnc(N3CC[C@@H]4O[C@@H](COCc5ccccn5)CC[C@H]43)c2)CC1 ZINC001164846189 720780064 /nfs/dbraw/zinc/78/00/64/720780064.db2.gz IDZPUTQDVDKQQK-SMIHKQSGSA-N 1 1 438.572 3.293 20 0 IGADMO COc1cc2c(cc1F)cc(Cl)nc2N1CC[N@H+]2C[C@@H](Oc3cncnc3)C[C@@H]2C1 ZINC001164748226 720807513 /nfs/dbraw/zinc/80/75/13/720807513.db2.gz QCFMPXVWWZCYEM-CABCVRRESA-N 1 1 429.883 3.168 20 0 IGADMO Clc1c[nH]c2nc(Cl)nc(N3CC[C@@H]4[C@@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)c12 ZINC001164747698 720810425 /nfs/dbraw/zinc/81/04/25/720810425.db2.gz PCPKBCLHNCVMMF-OFQRWUPVSA-N 1 1 447.374 3.236 20 0 IGADMO Fc1ccc(C(F)(F)N2CC[C@@H]3[C@@H](C[C@H](Cn4cncn4)[N@H+]3CC3CC3)C2)nc1Cl ZINC001164742699 720815221 /nfs/dbraw/zinc/81/52/21/720815221.db2.gz DAUWGZMMKYXFON-ZMSDIMECSA-N 1 1 440.901 3.390 20 0 IGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2C[C@H]3COC[C@]3(C(=O)NCCc3ccccc3)C2)nc1 ZINC001164848595 720817330 /nfs/dbraw/zinc/81/73/30/720817330.db2.gz DEZOGPFPGSSFRU-CLCZQPDDSA-N 1 1 448.611 3.440 20 0 IGADMO Clc1nc2c(c(N3CC[C@@H]4[C@@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)n1)CCCCC2 ZINC001164740783 720826334 /nfs/dbraw/zinc/82/63/34/720826334.db2.gz LGELSFSYUGWWOD-WAOWUJCRSA-N 1 1 442.011 3.370 20 0 IGADMO COc1cccc(-c2ccnc(N3CC[C@@H]4[C@@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)n2)c1 ZINC001164748320 720838703 /nfs/dbraw/zinc/83/87/03/720838703.db2.gz UEUQAUIYFAEHCN-AWRGLXIESA-N 1 1 445.571 3.123 20 0 IGADMO Fc1cccc(Oc2ccnc(N3CC[C@@H]4[C@@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)n2)c1 ZINC001164747473 720841839 /nfs/dbraw/zinc/84/18/39/720841839.db2.gz QQWVTJPNIUJRTN-CZTZKLFOSA-N 1 1 449.534 3.379 20 0 IGADMO COCC[N@H+]1CCO[C@H]2CN(C(F)(F)c3nc(Cl)c4cccc(F)c4n3)CC[C@@H]2C1 ZINC001164855925 720843147 /nfs/dbraw/zinc/84/31/47/720843147.db2.gz VONYTTZUJYEEGN-CJNGLKHVSA-N 1 1 444.885 3.141 20 0 IGADMO Cc1cccc(-c2ccc(N3CC[C@@H]4[C@@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)nn2)c1 ZINC001164740462 720847660 /nfs/dbraw/zinc/84/76/60/720847660.db2.gz BSZADPQNGOHZIE-WMTXJRDZSA-N 1 1 429.572 3.423 20 0 IGADMO Fc1ccc(Oc2ccnc(N3CC[C@@H]4[C@@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)n2)cc1 ZINC001164749333 720851555 /nfs/dbraw/zinc/85/15/55/720851555.db2.gz NBGHPEXFUSPUJI-CZTZKLFOSA-N 1 1 449.534 3.379 20 0 IGADMO Fc1ccc2c(Cl)ncnc2c1N1CC[C@@H]2[C@@H](C[C@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164746147 720860445 /nfs/dbraw/zinc/86/04/45/720860445.db2.gz GCODIIGMIWAUPX-FRQCXROJSA-N 1 1 441.942 3.393 20 0 IGADMO c1cc2c(nc(C3CCC3)nc2N2CC[C@@H]3[C@@H](C[C@@H](Cn4cncn4)[N@@H+]3CC3CC3)C2)[nH]1 ZINC001164744909 720861750 /nfs/dbraw/zinc/86/17/50/720861750.db2.gz CSYQTVURMQHIJN-IRFCIJBXSA-N 1 1 432.576 3.196 20 0 IGADMO c1cc2c(nc(C3CCC3)nc2N2CC[C@@H]3[C@H](C[C@@H](Cn4cncn4)[N@@H+]3CC3CC3)C2)[nH]1 ZINC001164745295 720861935 /nfs/dbraw/zinc/86/19/35/720861935.db2.gz CSYQTVURMQHIJN-SVFBPWRDSA-N 1 1 432.576 3.196 20 0 IGADMO COCC[N@H+]1CCO[C@@H]2CN(C(F)(F)c3ccc4cnc(Cl)nc4c3)CC[C@H]2C1 ZINC001164852371 720862979 /nfs/dbraw/zinc/86/29/79/720862979.db2.gz CNDIORRNWHWLEG-MAUKXSAKSA-N 1 1 426.895 3.002 20 0 IGADMO COC(=O)c1cccc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COCc2cccnc2)n1 ZINC001164754943 720871576 /nfs/dbraw/zinc/87/15/76/720871576.db2.gz UUIHVQWOKHYISX-PXDATVDWSA-N 1 1 436.556 3.018 20 0 IGADMO COc1nc(Cl)cc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COCc2cccnc2)n1 ZINC001164749079 720871713 /nfs/dbraw/zinc/87/17/13/720871713.db2.gz GRSDCPGACKHXTO-CVDCTZTESA-N 1 1 443.979 3.289 20 0 IGADMO COCC[N@H+]1CCO[C@H]2CN(c3ccc(-c4ccc(C(=O)OC)cc4)c(C)n3)CC[C@@H]2C1 ZINC001164855169 720871806 /nfs/dbraw/zinc/87/18/06/720871806.db2.gz GKIJYKAOPJARAD-GGAORHGYSA-N 1 1 439.556 3.017 20 0 IGADMO CSc1cc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COCc2cccnc2)ncn1 ZINC001164749047 720877071 /nfs/dbraw/zinc/87/70/71/720877071.db2.gz GLHUYNOLROZRGD-OFNKIYASSA-N 1 1 425.602 3.349 20 0 IGADMO c1cncc(COC[C@@H]2C[N@@H+](CC3CC3)C[C@@]23CCN(c2cnc4cccnc4n2)C3)c1 ZINC001164753477 720885782 /nfs/dbraw/zinc/88/57/82/720885782.db2.gz HBJSNGZKZIARSY-SQJMNOBHSA-N 1 1 430.556 3.175 20 0 IGADMO c1cncc(COC[C@H]2C[N@H+](CC3CC3)C[C@]23CCN(c2cc(OCC4CC4)ncn2)C3)c1 ZINC001164755711 720894990 /nfs/dbraw/zinc/89/49/90/720894990.db2.gz NBVWHMPNUFYNCC-BVAGGSTKSA-N 1 1 449.599 3.416 20 0 IGADMO c1cncc(COC[C@@H]2C[N@H+](CC3CC3)C[C@@]23CCN(c2cc(OCC4CC4)ncn2)C3)c1 ZINC001164755712 720895091 /nfs/dbraw/zinc/89/50/91/720895091.db2.gz NBVWHMPNUFYNCC-JYFHCDHNSA-N 1 1 449.599 3.416 20 0 IGADMO c1nc2cnc(N3CC[C@@]4(C3)C[N@H+](CC3CC3)C[C@@H]4COCc3cccnc3)nc2s1 ZINC001164755633 720896568 /nfs/dbraw/zinc/89/65/68/720896568.db2.gz MFKNDAIGNZVKCY-XXBNENTESA-N 1 1 436.585 3.236 20 0 IGADMO CC(=O)Nc1c(C)ccnc1N1CC[C@@]2(C1)C[N@@H+](CC1CC1)C[C@@H]2COCc1cccnc1 ZINC001164758175 720903093 /nfs/dbraw/zinc/90/30/93/720903093.db2.gz XKJOAINHZIDURE-BVAGGSTKSA-N 1 1 449.599 3.499 20 0 IGADMO Nc1cc(Cl)ncc1N1CC[C@]2(C1)C[N@@H+](CC1CC1)C[C@@H]2COCc1cccnc1 ZINC001164754685 720905752 /nfs/dbraw/zinc/90/57/52/720905752.db2.gz XIVAYKBSJFSSNQ-AUSIDOKSSA-N 1 1 427.980 3.467 20 0 IGADMO [O-][n+]1cc(Cl)ccc1N1CC[C@]2(C1)C[N@@H+](CC1CC1)C[C@@H]2COCc1cccnc1 ZINC001164750598 720906088 /nfs/dbraw/zinc/90/60/88/720906088.db2.gz JXOXNFCVFXUVJM-NFBKMPQASA-N 1 1 428.964 3.124 20 0 IGADMO [O-][n+]1cc(Cl)ccc1N1CC[C@]2(C1)C[N@@H+](CC1CC1)C[C@H]2COCc1cccnc1 ZINC001164750602 720906170 /nfs/dbraw/zinc/90/61/70/720906170.db2.gz JXOXNFCVFXUVJM-NZQKXSOJSA-N 1 1 428.964 3.124 20 0 IGADMO Nc1nc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COCc2cccnc2)ccc1Cl ZINC001164754675 720935923 /nfs/dbraw/zinc/93/59/23/720935923.db2.gz XFNJGHIXNXFNCL-WMZHIEFXSA-N 1 1 427.980 3.467 20 0 IGADMO c1ccc(C[N@H+]2CCc3nc(N4C[C@H](OCc5cccnc5)[C@@H]5COC[C@@H]54)ccc3C2)cc1 ZINC001164755539 721004149 /nfs/dbraw/zinc/00/41/49/721004149.db2.gz AFKWJOBLEFHKKE-AFESJLNVSA-N 1 1 442.563 3.455 20 0 IGADMO C[NH+]1CCC(Oc2ccnc(N3CCC[C@@]4(C[C@@H](OCc5ccccn5)CO4)C3)c2)CC1 ZINC001164761465 721031689 /nfs/dbraw/zinc/03/16/89/721031689.db2.gz GFHXQBYCYKVQON-ILBGXUMGSA-N 1 1 438.572 3.294 20 0 IGADMO O=C(NC1CCCCC1)c1cccnc1N1CC[N@H+]2C[C@@H](OCc3cccnc3)C[C@@H]2C1 ZINC001164866220 721052593 /nfs/dbraw/zinc/05/25/93/721052593.db2.gz CVTOXZKWBMMVCV-YADHBBJMSA-N 1 1 435.572 3.019 20 0 IGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2C[C@H](NC(=O)c3cccn3C)[C@H]3OCCC[C@@H]32)nc1 ZINC001164761032 721067325 /nfs/dbraw/zinc/06/73/25/721067325.db2.gz AKSJABBMDVVUAJ-SEDAZVQISA-N 1 1 437.588 3.133 20 0 IGADMO c1[nH]c2ccccc2c1-c1ccnc(N2CC[N@H+]3C[C@@H](OCc4cccnc4)C[C@@H]3C2)n1 ZINC001164866915 721083556 /nfs/dbraw/zinc/08/35/56/721083556.db2.gz UZZDQJOTUCTPKS-UXHICEINSA-N 1 1 426.524 3.500 20 0 IGADMO CCOC(=O)c1cc(N2CC[N@H+]3C[C@H](OCc4cccnc4)C[C@@H]3C2)nc2ccccc21 ZINC001164865633 721084165 /nfs/dbraw/zinc/08/41/65/721084165.db2.gz NSHABPHKAALRDO-WOJBJXKFSA-N 1 1 432.524 3.286 20 0 IGADMO COc1cccc2c1nc(Cl)nc2N1CC[N@H+]2C[C@@H](OCc3cccnc3)C[C@@H]2C1 ZINC001164863352 721085471 /nfs/dbraw/zinc/08/54/71/721085471.db2.gz CBQNYWWBGAXRHQ-SJORKVTESA-N 1 1 425.920 3.167 20 0 IGADMO COc1ccc2nc(Cl)cc(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@@H]4C3)c2n1 ZINC001164865179 721096457 /nfs/dbraw/zinc/09/64/57/721096457.db2.gz JKXSPCCIGPYUOI-IAGOWNOFSA-N 1 1 425.920 3.167 20 0 IGADMO Cc1cc(OCc2ccccc2)nc(N2CC[N@H+]3C[C@@H](OCc4cccnc4)C[C@@H]3C2)n1 ZINC001164880428 721173572 /nfs/dbraw/zinc/17/35/72/721173572.db2.gz WNJQVRHKFATDBB-PKTZIBPZSA-N 1 1 431.540 3.239 20 0 IGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4nc(-c5ccccn5)nc5ccccc54)C[C@@H]3C2)cn1 ZINC001164771846 721198240 /nfs/dbraw/zinc/19/82/40/721198240.db2.gz RGZRSQIOSGVLDC-PMACEKPBSA-N 1 1 425.540 3.384 20 0 IGADMO CCOc1ccc(NS(=O)(=O)c2cccnc2N2CC3(C2)CC[N@H+](CC2CC2)C3)cc1 ZINC001164771129 721295454 /nfs/dbraw/zinc/29/54/54/721295454.db2.gz XWMHRSCKKLEJSX-UHFFFAOYSA-N 1 1 442.585 3.203 20 0 IGADMO CCOc1ccc(NS(=O)(=O)c2cccnc2N2CC3(C2)CC[N@@H+](CC2CC2)C3)cc1 ZINC001164771129 721295461 /nfs/dbraw/zinc/29/54/61/721295461.db2.gz XWMHRSCKKLEJSX-UHFFFAOYSA-N 1 1 442.585 3.203 20 0 IGADMO O=C1CCC2(CCN(c3ncnc4c3CC[N@H+](Cc3ccccc3)C4)CC2)N1CC1CC1 ZINC001164774848 721306291 /nfs/dbraw/zinc/30/62/91/721306291.db2.gz JYSPFSIUPNCVIV-UHFFFAOYSA-N 1 1 431.584 3.406 20 0 IGADMO O=C1CCC2(CCN(c3ncnc4c3CC[N@@H+](Cc3ccccc3)C4)CC2)N1CC1CC1 ZINC001164774848 721306294 /nfs/dbraw/zinc/30/62/94/721306294.db2.gz JYSPFSIUPNCVIV-UHFFFAOYSA-N 1 1 431.584 3.406 20 0 IGADMO Cc1nc(COC[C@@H]2Cn3nccc3CN(c3ccc(C[N@H+](C)C4CC4)cn3)C2)cs1 ZINC001164876705 721332423 /nfs/dbraw/zinc/33/24/23/721332423.db2.gz PMHQPVDATGCYNI-IBGZPJMESA-N 1 1 438.601 3.490 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@@]2(CCCN(c3ncnc4nc(Cl)ccc43)C2)C1 ZINC001164778622 721337747 /nfs/dbraw/zinc/33/77/47/721337747.db2.gz XTRHINLBRGZJDM-QFIPXVFZSA-N 1 1 442.951 3.402 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@@]2(CCCN(c3ncnc4c(F)cccc43)C2)C1 ZINC001164776303 721347809 /nfs/dbraw/zinc/34/78/09/721347809.db2.gz APMWFTIULUWQAN-QHCPKHFHSA-N 1 1 425.508 3.493 20 0 IGADMO CCN(CC)c1cc(N2CCC[C@]3(C2)COCC[N@H+](Cc2c(C)noc2C)C3)ncn1 ZINC001164784088 721359348 /nfs/dbraw/zinc/35/93/48/721359348.db2.gz QIZNEWNVZWDYIS-QHCPKHFHSA-N 1 1 428.581 3.047 20 0 IGADMO CCN(CC)c1cc(N2CCC[C@]3(C2)COCC[N@@H+](Cc2c(C)noc2C)C3)ncn1 ZINC001164784088 721359351 /nfs/dbraw/zinc/35/93/51/721359351.db2.gz QIZNEWNVZWDYIS-QHCPKHFHSA-N 1 1 428.581 3.047 20 0 IGADMO COc1nnc(N2CCC[C@]3(C2)COCC[N@@H+](Cc2c(C)noc2C)C3)c2ccccc21 ZINC001164785140 721365333 /nfs/dbraw/zinc/36/53/33/721365333.db2.gz SCDNSNBBQIHLDQ-DEOSSOPVSA-N 1 1 437.544 3.362 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@]2(CCCN(c3ccnc(N4CCCCC4)n3)C2)C1 ZINC001164782274 721365884 /nfs/dbraw/zinc/36/58/84/721365884.db2.gz MDKAMBFTKOEEQH-XMMPIXPASA-N 1 1 440.592 3.191 20 0 IGADMO Cc1noc(-c2ccc(N3CCC[C@@]4(C3)COCC[N@H+](Cc3c(C)noc3C)C4)nc2)n1 ZINC001164785317 721367373 /nfs/dbraw/zinc/36/73/73/721367373.db2.gz UKRJRSAEBXAAJQ-HSZRJFAPSA-N 1 1 438.532 3.164 20 0 IGADMO Cc1noc(-c2ccc(N3CCC[C@@]4(C3)COCC[N@@H+](Cc3c(C)noc3C)C4)nc2)n1 ZINC001164785317 721367376 /nfs/dbraw/zinc/36/73/76/721367376.db2.gz UKRJRSAEBXAAJQ-HSZRJFAPSA-N 1 1 438.532 3.164 20 0 IGADMO C[NH+]1CCN(C[C@@H]2CCC[C@]3(CCN(C(F)(F)c4ccnc(Cl)c4F)C3)O2)CC1 ZINC001164887309 721385275 /nfs/dbraw/zinc/38/52/75/721385275.db2.gz HOJPHGIPCSLOEE-HNAYVOBHSA-N 1 1 432.918 3.184 20 0 IGADMO C[NH+]1CCN(C[C@@H]2CCC[C@@]3(CCN(c4nccc(-c5ccc(F)cc5)n4)C3)O2)CC1 ZINC001164888331 721408139 /nfs/dbraw/zinc/40/81/39/721408139.db2.gz OGGBPZBWCIMFAI-URXFXBBRSA-N 1 1 425.552 3.048 20 0 IGADMO COc1ccc(C(F)(F)N2CC[C@]3(C2)CCC[C@H](CN2CC[NH+](C)CC2)O3)nc1Cl ZINC001164887740 721418136 /nfs/dbraw/zinc/41/81/36/721418136.db2.gz MWDPGDXEWJYCPB-UZLBHIALSA-N 1 1 444.954 3.054 20 0 IGADMO COc1ccc(C(F)(F)N2CC[C@]3(C2)CCC[C@@H](CN2CC[NH+](C)CC2)O3)nc1Cl ZINC001164887735 721418297 /nfs/dbraw/zinc/41/82/97/721418297.db2.gz MWDPGDXEWJYCPB-JXFKEZNVSA-N 1 1 444.954 3.054 20 0 IGADMO C[NH+]1CCN(C[C@@H]2CCC[C@@]3(CCN(c4ncc5c(n4)-c4ccccc4CC5)C3)O2)CC1 ZINC001164895379 721427743 /nfs/dbraw/zinc/42/77/43/721427743.db2.gz OCSXWBGXRZTSCG-NVQXNPDNSA-N 1 1 433.600 3.008 20 0 IGADMO C[NH+]1CCN(C[C@@H]2CCC[C@@]3(CCN(c4nnc(Cl)c5ccc(F)cc54)C3)O2)CC1 ZINC001164899771 721443456 /nfs/dbraw/zinc/44/34/56/721443456.db2.gz YYYYHYSJIHJOBQ-JTSKRJEESA-N 1 1 433.959 3.188 20 0 IGADMO Cc1cc(-c2ccccc2F)nnc1N1CC[C@]2(C1)CCC[C@@H](CN1CC[NH+](C)CC1)O2 ZINC001164891320 721447428 /nfs/dbraw/zinc/44/74/28/721447428.db2.gz UILCLGJUKAKKHB-CPJSRVTESA-N 1 1 439.579 3.357 20 0 IGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1ncc(C)c(NCC3CC3)n1)CC2 ZINC001164783677 721447634 /nfs/dbraw/zinc/44/76/34/721447634.db2.gz CPABGGFRLPFGBU-JOCHJYFZSA-N 1 1 443.636 3.341 20 0 IGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1nc(Cl)nc3[nH]ccc31)CC2 ZINC001164787777 721448598 /nfs/dbraw/zinc/44/85/98/721448598.db2.gz QLMNGGFIUVLQJF-KRWDZBQOSA-N 1 1 433.984 3.345 20 0 IGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1nnc(Cl)c3cccnc31)CC2 ZINC001164784631 721459896 /nfs/dbraw/zinc/45/98/96/721459896.db2.gz IUHFFPKTFWQGKJ-SFHVURJKSA-N 1 1 445.995 3.412 20 0 IGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1nc[nH]c3nc(=S)sc1-3)CC2 ZINC001164787166 721465129 /nfs/dbraw/zinc/46/51/29/721465129.db2.gz CWKRREVNTLEUGY-MRXNPFEDSA-N 1 1 449.646 3.109 20 0 IGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2CC[C@@H]3OCC[C@H](C(=O)N4CCCO4)[C@@H]3C2)nc1 ZINC001164791896 721483218 /nfs/dbraw/zinc/48/32/18/721483218.db2.gz KLKUDNURTRSWKJ-KJJMTIBFSA-N 1 1 428.577 3.024 20 0 IGADMO COC(=O)Cc1c(Cl)ncnc1N1CCC2(CC([N@@H+](C)Cc3ccncc3)C2)CC1 ZINC001164792963 721493262 /nfs/dbraw/zinc/49/32/62/721493262.db2.gz WLDOHAYOKWQRRG-UHFFFAOYSA-N 1 1 429.952 3.122 20 0 IGADMO C[N@@H+](Cc1ccncc1)C1CC2(C1)CCN(c1c(Cl)nc(Cl)nc1C(N)=O)CC2 ZINC001164793009 721496538 /nfs/dbraw/zinc/49/65/38/721496538.db2.gz YXWYZFQMSHIDIS-UHFFFAOYSA-N 1 1 435.359 3.158 20 0 IGADMO CCOC(=O)[C@H]1CCc2nnc(N3CCC4(CC([N@@H+](C)Cc5ccncc5)C4)CC3)cc2C1 ZINC001164797069 721504542 /nfs/dbraw/zinc/50/45/42/721504542.db2.gz YNCDQBUVQARBHY-FQEVSTJZSA-N 1 1 449.599 3.421 20 0 IGADMO CCOC(=O)c1cnc(N2CC[N@H+]3C[C@H](Oc4cccc(F)c4)C[C@@H]3C2)cc1OCC ZINC001164911279 721531895 /nfs/dbraw/zinc/53/18/95/721531895.db2.gz VYHRSJYHRKNWLA-IEBWSBKVSA-N 1 1 429.492 3.138 20 0 IGADMO CCOC(=O)c1c(C)nc(Cl)cc1N1C[C@H]([N@@H+](C)Cc2cccnc2)[C@H]2OCCC[C@@H]21 ZINC001164809435 721543859 /nfs/dbraw/zinc/54/38/59/721543859.db2.gz UPMNUBOSRDLLCG-JLMWRMLUSA-N 1 1 444.963 3.483 20 0 IGADMO CC(C)(C)C(=O)Nc1ccc(CO)nc1N1CC[N@H+]2C[C@@H](Oc3cccc(F)c3)C[C@H]2C1 ZINC001164906370 721547104 /nfs/dbraw/zinc/54/71/04/721547104.db2.gz KFMIFALPYXHFNJ-ICSRJNTNSA-N 1 1 442.535 3.040 20 0 IGADMO COC(=O)c1ccc2ccnc(N3C[C@H]([N@@H+](C)Cc4cccnc4)[C@H]4OCCC[C@@H]43)c2c1 ZINC001164806614 721547973 /nfs/dbraw/zinc/54/79/73/721547973.db2.gz PGFIXVKIHXQOGR-VABKMULXSA-N 1 1 432.524 3.285 20 0 IGADMO Fc1cccc(O[C@H]2C[C@H]3CN(C(F)(F)c4cc(Cl)nc(=S)[nH]4)CC[N@H+]3C2)c1 ZINC001164904740 721548306 /nfs/dbraw/zinc/54/83/06/721548306.db2.gz GGJHHNVMVFHGRB-JSGCOSHPSA-N 1 1 430.883 3.445 20 0 IGADMO Fc1cccc(O[C@@H]2C[C@@H]3CN(C(F)(F)c4cc(Cl)nc(=S)[nH]4)CC[N@H+]3C2)c1 ZINC001164904745 721548800 /nfs/dbraw/zinc/54/88/00/721548800.db2.gz GGJHHNVMVFHGRB-TZMCWYRMSA-N 1 1 430.883 3.445 20 0 IGADMO COC(=O)c1c(Cl)cnc(N2CC[N@H+]3C[C@@H](Oc4cccc(F)c4)C[C@H]3C2)c1OC ZINC001164909355 721549515 /nfs/dbraw/zinc/54/95/15/721549515.db2.gz RQWZRFPKQKMYAX-HOCLYGCPSA-N 1 1 435.883 3.011 20 0 IGADMO COc1cccc(-c2ccnc(N3C[C@H]([N@H+](C)Cc4cccnc4)[C@@H]4OCCC[C@H]43)n2)c1 ZINC001164807345 721567313 /nfs/dbraw/zinc/56/73/13/721567313.db2.gz SSKGZPFDNNJZMP-TZRRMPRUSA-N 1 1 431.540 3.415 20 0 IGADMO COc1cccc(-c2ccnc(N3C[C@H]([N@@H+](C)Cc4cccnc4)[C@@H]4OCCC[C@H]43)n2)c1 ZINC001164807345 721567318 /nfs/dbraw/zinc/56/73/18/721567318.db2.gz SSKGZPFDNNJZMP-TZRRMPRUSA-N 1 1 431.540 3.415 20 0 IGADMO NC(=S)c1cnc(N2CC[N@H+]3C[C@H](Oc4cccc(F)c4)C[C@@H]3C2)c2sccc21 ZINC001164907582 721567706 /nfs/dbraw/zinc/56/77/06/721567706.db2.gz OSBUIESZPXKNND-GDBMZVCRSA-N 1 1 428.558 3.412 20 0 IGADMO COC(=O)c1cccc2nc(N3C[C@H]([N@@H+](C)Cc4cccnc4)[C@@H]4OCCC[C@@H]43)ccc21 ZINC001164801876 721585721 /nfs/dbraw/zinc/58/57/21/721585721.db2.gz GAHPIODUJJMENJ-WPFOTENUSA-N 1 1 432.524 3.285 20 0 IGADMO Cc1nc(C)c(-c2ccc(N3C[C@H]([N@H+](C)Cc4cccnc4)[C@H]4OCCC[C@H]43)nn2)s1 ZINC001164806241 721586388 /nfs/dbraw/zinc/58/63/88/721586388.db2.gz MOQSKMLTHRNYLR-URVUXULASA-N 1 1 436.585 3.480 20 0 IGADMO Cc1nc(C)c(-c2ccc(N3C[C@H]([N@@H+](C)Cc4cccnc4)[C@H]4OCCC[C@H]43)nn2)s1 ZINC001164806241 721586391 /nfs/dbraw/zinc/58/63/91/721586391.db2.gz MOQSKMLTHRNYLR-URVUXULASA-N 1 1 436.585 3.480 20 0 IGADMO Cc1nc(C)c(-c2ccc(N3C[C@H]([N@H+](C)Cc4cccnc4)[C@H]4OCCC[C@@H]43)nn2)s1 ZINC001164806237 721586548 /nfs/dbraw/zinc/58/65/48/721586548.db2.gz MOQSKMLTHRNYLR-ONTIZHBOSA-N 1 1 436.585 3.480 20 0 IGADMO Cc1nc(C)c(-c2ccc(N3C[C@H]([N@@H+](C)Cc4cccnc4)[C@H]4OCCC[C@@H]43)nn2)s1 ZINC001164806237 721586550 /nfs/dbraw/zinc/58/65/50/721586550.db2.gz MOQSKMLTHRNYLR-ONTIZHBOSA-N 1 1 436.585 3.480 20 0 IGADMO O=C(NC1CC1)c1ccc(N2CCC(F)(F)[C@@]3(CC[N@@H+](Cc4ccccn4)C3)C2)nc1 ZINC001164904902 721708445 /nfs/dbraw/zinc/70/84/45/721708445.db2.gz FKLKBRYEQCNXLM-JOCHJYFZSA-N 1 1 427.499 3.107 20 0 IGADMO FC1(F)CCN(c2ncnc3c2ncn3C2CC2)C[C@@]12CC[N@@H+](Cc1ccccn1)C2 ZINC001164912183 721725662 /nfs/dbraw/zinc/72/56/62/721725662.db2.gz MLMBUHAQHBFCHQ-NRFANRHFSA-N 1 1 425.487 3.294 20 0 IGADMO CNC(=O)c1nc(N2CCc3c(C[N@H+](C)Cc4ccco4)cncc3C2)ccc1Cl ZINC001164910844 721757138 /nfs/dbraw/zinc/75/71/38/721757138.db2.gz SPGUAZKFXFMAKR-UHFFFAOYSA-N 1 1 425.920 3.277 20 0 IGADMO CNC(=O)c1nc(N2CCc3c(C[N@@H+](C)Cc4ccco4)cncc3C2)ccc1Cl ZINC001164910844 721757139 /nfs/dbraw/zinc/75/71/39/721757139.db2.gz SPGUAZKFXFMAKR-UHFFFAOYSA-N 1 1 425.920 3.277 20 0 IGADMO CCOC(=O)c1cnc(CC)nc1N1CCc2c(C[N@H+](C)Cc3ccco3)cncc2C1 ZINC001164910525 721763322 /nfs/dbraw/zinc/76/33/22/721763322.db2.gz HLTWYRNSJBUSDY-UHFFFAOYSA-N 1 1 435.528 3.398 20 0 IGADMO CCOC(=O)c1cnc(CC)nc1N1CCc2c(C[N@@H+](C)Cc3ccco3)cncc2C1 ZINC001164910525 721763326 /nfs/dbraw/zinc/76/33/26/721763326.db2.gz HLTWYRNSJBUSDY-UHFFFAOYSA-N 1 1 435.528 3.398 20 0 IGADMO Clc1ccc(C[NH+]2CCCC2)c(N2CCO[C@@H]3[C@H](OCCCn4cccn4)CC[C@@H]32)n1 ZINC001165024553 721780880 /nfs/dbraw/zinc/78/08/80/721780880.db2.gz XWEWZBQZWYFWIX-VWPQPMDRSA-N 1 1 445.995 3.370 20 0 IGADMO COC(=O)CSc1cccc(N2C[C@@H]3CCC[C@@H]([N@@H+](C)Cc4ccccn4)[C@H]3C2)n1 ZINC001165022589 721820896 /nfs/dbraw/zinc/82/08/96/721820896.db2.gz FZESWOOTQVUSKG-YSIASYRMSA-N 1 1 426.586 3.479 20 0 IGADMO C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@H]2CN(c3ccc(C(=O)NC4CCCC4)nn3)C[C@@H]21 ZINC001165023122 721827215 /nfs/dbraw/zinc/82/72/15/721827215.db2.gz HSJDWKKMXIHFMT-AVCGJXAMSA-N 1 1 434.588 3.281 20 0 IGADMO CSc1nc2sccc2c(N2CCC3(CC2)C(=O)NCC[N@H+]3Cc2ccccc2)n1 ZINC001164946871 721969786 /nfs/dbraw/zinc/96/97/86/721969786.db2.gz YBSATMRYFFUBGZ-UHFFFAOYSA-N 1 1 439.610 3.384 20 0 IGADMO CSc1nc2sccc2c(N2CCC3(CC2)C(=O)NCC[N@@H+]3Cc2ccccc2)n1 ZINC001164946871 721969788 /nfs/dbraw/zinc/96/97/88/721969788.db2.gz YBSATMRYFFUBGZ-UHFFFAOYSA-N 1 1 439.610 3.384 20 0 IGADMO Cc1ccc2c([nH+]1)N(Cc1cccnc1)CCN(c1ccc(CN3CCOCC3)cn1)C2 ZINC001164954575 722005834 /nfs/dbraw/zinc/00/58/34/722005834.db2.gz YVBIRTSJKWIGNT-UHFFFAOYSA-N 1 1 430.556 3.039 20 0 IGADMO COC(=O)c1ccc(Cl)nc1N1CCC2(CC1)COCC[N@@H+](Cc1ccncc1)C2 ZINC001164961160 722051610 /nfs/dbraw/zinc/05/16/10/722051610.db2.gz SWGVCEXODOBFAI-UHFFFAOYSA-N 1 1 430.936 3.036 20 0 IGADMO CCOC(=O)/C=C/c1cccnc1N1CCC2(CC1)COCC[N@@H+](Cc1ccncc1)C2 ZINC001164959748 722052211 /nfs/dbraw/zinc/05/22/11/722052211.db2.gz NSUJXDJYECWXHR-AATRIKPKSA-N 1 1 436.556 3.172 20 0 IGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2CC[C@@H]3[C@@H](C[C@@H](Cn4cccn4)N3C(C)=O)C2)nc1 ZINC001164968972 722081153 /nfs/dbraw/zinc/08/11/53/722081153.db2.gz GVKJPSOITKGCJC-CJRSTVEYSA-N 1 1 436.604 3.341 20 0 IGADMO CS(=O)(=O)N1C[C@H]2CN(c3nc(Cl)ccc3C[NH+]3CCCC3)C[C@@H]2c2ccccc21 ZINC001164972376 722090198 /nfs/dbraw/zinc/09/01/98/722090198.db2.gz GTPRYIIVLWMATK-MJGOQNOKSA-N 1 1 447.004 3.330 20 0 IGADMO c1ccc(COc2cncc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)n2)cc1 ZINC001164983917 722106182 /nfs/dbraw/zinc/10/61/82/722106182.db2.gz RCFRUVJMDXURQO-DHIUTWEWSA-N 1 1 431.540 3.178 20 0 IGADMO CCOC(=O)c1c(C)nc(Cl)cc1N1CC[C@@H]2C[N@@H+](Cc3cccnc3)CCO[C@@H]2C1 ZINC001164983105 722108982 /nfs/dbraw/zinc/10/89/82/722108982.db2.gz YHCFXUZTSKJBQY-UYAOXDASSA-N 1 1 444.963 3.342 20 0 IGADMO c1cncc(C[N@H+]2CCO[C@@H]3CN(c4nccnc4C4SCCCS4)CC[C@H]3C2)c1 ZINC001164979770 722109355 /nfs/dbraw/zinc/10/93/55/722109355.db2.gz PVJBUINXICLJEC-RBUKOAKNSA-N 1 1 443.642 3.468 20 0 IGADMO COC(=O)c1ccc2ccnc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)c2c1 ZINC001164979253 722111106 /nfs/dbraw/zinc/11/11/06/722111106.db2.gz PQWABNJBLSFCFN-GMAHTHKFSA-N 1 1 432.524 3.144 20 0 IGADMO CSc1nc2c(c(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)n1)CCCC2 ZINC001164981848 722113594 /nfs/dbraw/zinc/11/35/94/722113594.db2.gz VIJOXCFJQBTWQP-WIYYLYMNSA-N 1 1 425.602 3.200 20 0 IGADMO CCOC(=O)c1cnc(N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)c(Cl)c1 ZINC001164973069 722120851 /nfs/dbraw/zinc/12/08/51/722120851.db2.gz GHEQXCDNIQWTSE-XLIONFOSSA-N 1 1 430.936 3.034 20 0 IGADMO Cc1nc(C(F)(F)N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)nc(Cl)c1C ZINC001164981020 722127959 /nfs/dbraw/zinc/12/79/59/722127959.db2.gz SAZYRORUYQZEPN-ZWKOTPCHSA-N 1 1 437.922 3.414 20 0 IGADMO FC(F)(COc1cccc(Cl)n1)N1CC[C@H]2C[N@@H+](Cc3cccnc3)CCO[C@@H]2C1 ZINC001164983080 722128241 /nfs/dbraw/zinc/12/82/41/722128241.db2.gz YAQCVSMLGBUYHE-ZWKOTPCHSA-N 1 1 438.906 3.325 20 0 IGADMO CN(C)c1ccc(-c2ccnc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)n2)cc1 ZINC001164978030 722134277 /nfs/dbraw/zinc/13/42/77/722134277.db2.gz JDUPJUAAZYHQRJ-WIOPSUGQSA-N 1 1 444.583 3.332 20 0 IGADMO FC(F)(c1nc2ccc(Cl)nc2[nH]1)N1CC[C@H]2C[N@@H+](Cc3cccnc3)CCO[C@H]2C1 ZINC001164980897 722145926 /nfs/dbraw/zinc/14/59/26/722145926.db2.gz NKHITMSFERZDRT-RDJZCZTQSA-N 1 1 448.905 3.279 20 0 IGADMO COC(=O)c1cccc2nc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)ccc21 ZINC001164977096 722149586 /nfs/dbraw/zinc/14/95/86/722149586.db2.gz ISHDQROOVMDSNJ-CVDCTZTESA-N 1 1 432.524 3.144 20 0 IGADMO Cc1nc(C)c(-c2ccc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)nn2)s1 ZINC001164979711 722151079 /nfs/dbraw/zinc/15/10/79/722151079.db2.gz LVBNLTFZMDWOTH-CTNGQTDRSA-N 1 1 436.585 3.339 20 0 IGADMO Fc1cnc(N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)nc1-c1ccsc1 ZINC001164977203 722154668 /nfs/dbraw/zinc/15/46/68/722154668.db2.gz YGACMOUUOZXGBT-PXNSSMCTSA-N 1 1 425.533 3.467 20 0 IGADMO Cc1nc(CN2CCO[C@@H]3CCN(c4nc(NCC5CC5)c(C)c[nH+]4)CC[C@H]32)cs1 ZINC001164988421 722173709 /nfs/dbraw/zinc/17/37/09/722173709.db2.gz QVUGMDHECNEGSN-WOJBJXKFSA-N 1 1 428.606 3.242 20 0 IGADMO Cc1nc(CN2CCO[C@@H]3CCN(c4nc(NCC5CC5)c(C)c[nH+]4)CC[C@@H]32)cs1 ZINC001164988420 722173784 /nfs/dbraw/zinc/17/37/84/722173784.db2.gz QVUGMDHECNEGSN-VQTJNVASSA-N 1 1 428.606 3.242 20 0 IGADMO O=S(=O)(c1cccnc1N1CCC[C@@]2(CC[N@H+]2Cc2cccc(F)c2)C1)N1CCCC1 ZINC001164995616 722204598 /nfs/dbraw/zinc/20/45/98/722204598.db2.gz OQMAZQXANRRXBN-HSZRJFAPSA-N 1 1 444.576 3.250 20 0 IGADMO O=S(=O)(c1cccnc1N1CCC[C@@]2(CC[N@@H+]2Cc2cccc(F)c2)C1)N1CCCC1 ZINC001164995616 722204601 /nfs/dbraw/zinc/20/46/01/722204601.db2.gz OQMAZQXANRRXBN-HSZRJFAPSA-N 1 1 444.576 3.250 20 0 IGADMO O=S(=O)(c1ccnc(N2CCC[C@@]3(CC[N@@H+]3Cc3cccc(F)c3)C2)c1)N1CCCC1 ZINC001164994777 722211034 /nfs/dbraw/zinc/21/10/34/722211034.db2.gz DGURGTGHSSOKME-HSZRJFAPSA-N 1 1 444.576 3.250 20 0 IGADMO CC(C)NC(=O)[C@@H]1C[C@H]2OCCN(c3ccc4c(n3)CC[N@H+](Cc3ccccc3)C4)[C@H]2C1 ZINC001164994311 722214600 /nfs/dbraw/zinc/21/46/00/722214600.db2.gz ALRJLLFZQVSDIU-OEMFJLHTSA-N 1 1 434.584 3.148 20 0 IGADMO C[NH+]1CCN(c2ncnc3c2CCN(c2cc(Cl)nc4c(F)cccc24)CC3)CC1 ZINC001165001474 722239822 /nfs/dbraw/zinc/23/98/22/722239822.db2.gz GGKYAWJIQNMGID-UHFFFAOYSA-N 1 1 426.927 3.174 20 0 IGADMO CCOC(=O)[C@]12CCO[C@@H]1CCN(c1nc(C[NH+]3CCCC3)nc3sc(C)c(C)c31)C2 ZINC001164434705 718978668 /nfs/dbraw/zinc/97/86/68/718978668.db2.gz VEDUAHXUIGKJFI-HXOBKFHXSA-N 1 1 444.601 3.452 20 0 IGADMO O=S(=O)(c1cccnc1N1CCC[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]21)N1CCCCC1 ZINC001164628110 719102934 /nfs/dbraw/zinc/10/29/34/719102934.db2.gz MCFWMJVSEIZAET-FCHUYYIVSA-N 1 1 440.613 3.357 20 0 IGADMO COC(=O)c1nc(N2CCc3c(C[NH+](C)C)nn(C(C)C)c3C2)c2ccccc2c1OC ZINC001164651357 719316637 /nfs/dbraw/zinc/31/66/37/719316637.db2.gz JPVPKDFBLZKUEV-UHFFFAOYSA-N 1 1 437.544 3.432 20 0 IGADMO CCn1nnc2c1[C@@H](COC)CN(c1nc(C[NH+]3CCCC3)nc3sc(C)c(C)c31)C2 ZINC001164665939 719361596 /nfs/dbraw/zinc/36/15/96/719361596.db2.gz ZOBSVKJCICLGEC-MRXNPFEDSA-N 1 1 441.605 3.266 20 0 IGADMO Cc1nc2c(cc(-c3nc(N4C[C@@H]5[C@H](C4)OCC[N@H+]5C)ncc3F)cc2F)n1C(C)C ZINC001164670236 719394063 /nfs/dbraw/zinc/39/40/63/719394063.db2.gz WIDSUCVLAKHECG-MOPGFXCFSA-N 1 1 428.487 3.180 20 0 IGADMO Cc1nc2nc(Cl)nc(N3CCC4(CC3)COCC[N@@H+]4Cc3ccc(F)cc3)c2[nH]1 ZINC001164673775 719503045 /nfs/dbraw/zinc/50/30/45/719503045.db2.gz ROQSMQHMIYOLSH-UHFFFAOYSA-N 1 1 430.915 3.325 20 0 IGADMO Cc1nc2nc(Cl)nc(N3CCC4(CC3)COCC[N@H+]4Cc3ccc(F)cc3)c2[nH]1 ZINC001164673775 719503052 /nfs/dbraw/zinc/50/30/52/719503052.db2.gz ROQSMQHMIYOLSH-UHFFFAOYSA-N 1 1 430.915 3.325 20 0 IGADMO CC[N@H+]1CCCC[C@H]1c1ccc(N2CCc3nnc(COc4ccccn4)n3CC2)nc1 ZINC001164688248 719686665 /nfs/dbraw/zinc/68/66/65/719686665.db2.gz YUDXIOJKJXZWSY-FQEVSTJZSA-N 1 1 433.560 3.257 20 0 IGADMO CNC(=O)C[N@H+]1CCCC12CCN(c1cnc(Cl)nc1Oc1cccc(C)c1)CC2 ZINC001164690038 719752118 /nfs/dbraw/zinc/75/21/18/719752118.db2.gz QKEFKPHBJZVVFC-UHFFFAOYSA-N 1 1 429.952 3.412 20 0 IGADMO COC(=O)[C@@]1(C)C[C@H]([NH+]2CCOCC2)CCN1c1cc(Cl)nc2c(OC)cccc12 ZINC001164702602 719838176 /nfs/dbraw/zinc/83/81/76/719838176.db2.gz OEWWVBORUQXJPY-IVZQSRNASA-N 1 1 433.936 3.130 20 0 IGADMO COC(=O)[C@@]1(C)C[C@H]([NH+]2CCOCC2)CCN1c1ncnc2cc(C(C)(C)C)sc21 ZINC001164700827 719846571 /nfs/dbraw/zinc/84/65/71/719846571.db2.gz KYGONJJZFSVCRO-IVZQSRNASA-N 1 1 432.590 3.222 20 0 IGADMO COC(=O)[C@]1(C)C[C@@H]([NH+]2CCOCC2)CCN1c1nc(Cl)nc2c(Cl)cccc21 ZINC001164703097 719851177 /nfs/dbraw/zinc/85/11/77/719851177.db2.gz OPOKWJXWFHDUGW-RBZFPXEDSA-N 1 1 439.343 3.169 20 0 IGADMO COC(=O)[C@@]1(C)C[C@H]([NH+]2CCOCC2)CCN1c1cc(Cl)nnc1-c1ccccc1 ZINC001164701933 719855195 /nfs/dbraw/zinc/85/51/95/719855195.db2.gz MCBVIQGKWPQHGE-VGOFRKELSA-N 1 1 430.936 3.030 20 0 IGADMO COC(=O)[C@]1(C)C[C@H]([NH+]2CCOCC2)CCN1c1nc(Cl)ncc1-c1ccccc1 ZINC001164705616 719855530 /nfs/dbraw/zinc/85/55/30/719855530.db2.gz UUQGDXBOUDXTCZ-VGSWGCGISA-N 1 1 430.936 3.030 20 0 IGADMO COC(=O)[C@@]1(C)C[C@H]([NH+]2CCOCC2)CCN1c1ncc(Cl)nc1-c1ccccc1 ZINC001164701677 719871665 /nfs/dbraw/zinc/87/16/65/719871665.db2.gz GQFSAZCXFCUPOL-VGOFRKELSA-N 1 1 430.936 3.030 20 0 IGADMO COC(=O)c1ccc2c(c1)ncnc2N1CCC2(CC1)C[N@@H+](Cc1cccs1)CCO2 ZINC001164695742 719888254 /nfs/dbraw/zinc/88/82/54/719888254.db2.gz UKCFBPBLTMJGRY-UHFFFAOYSA-N 1 1 438.553 3.349 20 0 IGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2CCOC[C@]3(CC[C@H](Cn4cccn4)O3)C2)nc1 ZINC001164804523 720051973 /nfs/dbraw/zinc/05/19/73/720051973.db2.gz LLXHHQOMDYWQAK-AKFKNWHVSA-N 1 1 425.577 3.280 20 0 IGADMO CC[NH+](CC)Cc1nc2sc(C)c(C)c2c(N2C[C@@H]3COC[C@@]3(c3nc(C)no3)C2)n1 ZINC001164801027 720060665 /nfs/dbraw/zinc/06/06/65/720060665.db2.gz FMBZGGBERPEHDS-ZHRRBRCNSA-N 1 1 442.589 3.246 20 0 IGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1nc3cc(C(=O)OC)ccc3nc1Cl)C2 ZINC001164810414 720078045 /nfs/dbraw/zinc/07/80/45/720078045.db2.gz LSSCXCQMXSQZIR-HXOBKFHXSA-N 1 1 444.963 3.255 20 0 IGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(C(F)(F)c1ccc(C(=O)OC)c(Cl)n1)C2 ZINC001164813073 720091616 /nfs/dbraw/zinc/09/16/16/720091616.db2.gz SDKYRFXAKYIHJY-FOIQADDNSA-N 1 1 443.922 3.251 20 0 IGADMO COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1cc(C(=O)OC)cc(Cl)n1)CC2 ZINC001164711512 720097706 /nfs/dbraw/zinc/09/77/06/720097706.db2.gz QGRNHTSTNIBKAO-IBGZPJMESA-N 1 1 444.963 3.424 20 0 IGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1cc(C(=O)NC(C)(C)C)cc(Cl)n1)C2 ZINC001164807302 720128178 /nfs/dbraw/zinc/12/81/78/720128178.db2.gz BUKVIKPJHBRAQX-MBSDFSHPSA-N 1 1 435.012 3.448 20 0 IGADMO CCOC(=O)c1nc(Cl)nc(Cl)c1N1CC[C@]2(C1)C[N@@H+](CC1CC1)C[C@@H]2COC ZINC001164808675 720128334 /nfs/dbraw/zinc/12/83/34/720128334.db2.gz GBLRPQWGWKEDNE-JLTOFOAXSA-N 1 1 443.375 3.145 20 0 IGADMO COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1ccc(-c3nc(C)no3)cn1)CC2 ZINC001164710501 720144970 /nfs/dbraw/zinc/14/49/70/720144970.db2.gz CAYIHCYUGPYTMH-NRFANRHFSA-N 1 1 434.544 3.343 20 0 IGADMO COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1cc(-c3ccncc3)ncn1)CC2 ZINC001164714115 720145738 /nfs/dbraw/zinc/14/57/38/720145738.db2.gz WGQNTCXDLNIRDZ-QFIPXVFZSA-N 1 1 430.556 3.441 20 0 IGADMO COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN([C@H](F)Oc1cncc(Cl)n1)CC2 ZINC001164713093 720153231 /nfs/dbraw/zinc/15/32/31/720153231.db2.gz QOUSCMRQVQUXDI-XLIONFOSSA-N 1 1 435.931 3.160 20 0 IGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(C(F)(F)c1nc3ccc(Cl)nc3[nH]1)C2 ZINC001164820153 720176522 /nfs/dbraw/zinc/17/65/22/720176522.db2.gz ZSDOTNPMOGHTNK-IFXJQAMLSA-N 1 1 425.911 3.341 20 0 IGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1ccc(-c3ccc(OC)cc3OC)nn1)C2 ZINC001164817376 720182185 /nfs/dbraw/zinc/18/21/85/720182185.db2.gz PDWRPKORYSMPPU-CLOONOSVSA-N 1 1 438.572 3.346 20 0 IGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1nc(C(=O)OC)c(OC)c3ccccc31)C2 ZINC001164818346 720183375 /nfs/dbraw/zinc/18/33/75/720183375.db2.gz SKIRQTPZBVCNSA-CJAUYULYSA-N 1 1 439.556 3.215 20 0 IGADMO CC(C)[N@@H+](C)Cc1cc(=O)n2c(n1)CN(c1nc(Cl)nc3ccc(F)cc31)CCC2 ZINC001164811527 720212653 /nfs/dbraw/zinc/21/26/53/720212653.db2.gz JIGULTOEBSHDLW-UHFFFAOYSA-N 1 1 430.915 3.230 20 0 IGADMO CCOC(=O)c1cc(Cl)nc(N2CCCn3c(=O)cc(C[N@@H+](C)C(C)C)nc3C2)c1C ZINC001164811981 720221898 /nfs/dbraw/zinc/22/18/98/720221898.db2.gz BTVNBOLJMPLCNL-UHFFFAOYSA-N 1 1 447.967 3.027 20 0 IGADMO Cc1cc(-c2ccccc2F)nnc1N1CCCn2c(=O)cc(C[N@H+](C)C(C)C)nc2C1 ZINC001164816392 720244128 /nfs/dbraw/zinc/24/41/28/720244128.db2.gz IRPRUEDQNAWZAJ-UHFFFAOYSA-N 1 1 436.535 3.398 20 0 IGADMO CCC[N@H+]1CCCC[C@@H]1c1ccc(N2Cc3ccnn3C[C@H](C(=O)N3CCCC3)C2)nc1 ZINC001164820227 720268541 /nfs/dbraw/zinc/26/85/41/720268541.db2.gz VETZKWLZNMOMGH-FYYLOGMGSA-N 1 1 436.604 3.474 20 0 IGADMO CCC[N@H+]1CCCC[C@H]1c1ccc(N2Cc3ccnn3C[C@H](C(=O)N3CCCC3)C2)nc1 ZINC001164820230 720268709 /nfs/dbraw/zinc/26/87/09/720268709.db2.gz VETZKWLZNMOMGH-GGAORHGYSA-N 1 1 436.604 3.474 20 0 IGADMO CNC(=O)C[N@@H+]1CCOC[C@]2(CCCN(c3cc(SCc4ccccc4)ccn3)C2)C1 ZINC001164720763 720293936 /nfs/dbraw/zinc/29/39/36/720293936.db2.gz DGOHYWLDFLGYRQ-XMMPIXPASA-N 1 1 440.613 3.039 20 0 IGADMO CNC(=O)C[N@H+]1CCOC[C@]2(CCCN(c3cc(SCc4ccccc4)ccn3)C2)C1 ZINC001164720763 720293942 /nfs/dbraw/zinc/29/39/42/720293942.db2.gz DGOHYWLDFLGYRQ-XMMPIXPASA-N 1 1 440.613 3.039 20 0 IGADMO CCC[N@H+]1CCCC[C@@H]1c1ccc(N2CC[C@@H]3O[C@@H](COCC(=O)N(C)C)CC[C@H]32)nc1 ZINC001164727242 720324733 /nfs/dbraw/zinc/32/47/33/720324733.db2.gz RVYGVSBIMASUNU-ODAXIHTASA-N 1 1 444.620 3.250 20 0 IGADMO c1ccc(N2CCN(c3ccc(N4CC[C@H]5[C@@H]4CC[N@@H+]5Cc4cccnc4)nn3)CC2)cc1 ZINC001164729305 720441379 /nfs/dbraw/zinc/44/13/79/720441379.db2.gz GVDHVYHXWRZGIG-ZEQRLZLVSA-N 1 1 441.583 3.051 20 0 IGADMO c1cncc(C[N@H+]2CC[C@@H]3[C@@H]2CCN3c2ccc(-c3ccc(N4CCOCC4)cc3)nn2)c1 ZINC001164723072 720466732 /nfs/dbraw/zinc/46/67/32/720466732.db2.gz BTWCYJWQWVPZAL-LOSJGSFVSA-N 1 1 442.567 3.228 20 0 IGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@@H]2CN(c3cc(NC(=O)OC(C)(C)C)ncn3)CC[C@@H]21 ZINC001164834592 720519057 /nfs/dbraw/zinc/51/90/57/720519057.db2.gz GPGVQAGBWXKNST-QYZOEREBSA-N 1 1 441.580 3.398 20 0 IGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@@H]2CN(c3ccnc(NC(=O)OC(C)(C)C)n3)CC[C@@H]21 ZINC001164838469 720527391 /nfs/dbraw/zinc/52/73/91/720527391.db2.gz RHZJSMIPJOCKGX-QYZOEREBSA-N 1 1 441.580 3.398 20 0 IGADMO CCOC(=O)c1cc2ccnc(N3CC[C@@H]4[C@H](C[C@H](Cn5cccn5)[N@H+]4C(C)C)C3)c2[nH]1 ZINC001164836791 720531656 /nfs/dbraw/zinc/53/16/56/720531656.db2.gz KXDUGLAXWZFBCM-SFHLNBCPSA-N 1 1 436.560 3.314 20 0 IGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@H]2CN(c3nccc(C(=O)OC(C)(C)C)n3)CC[C@@H]21 ZINC001164840118 720558599 /nfs/dbraw/zinc/55/85/99/720558599.db2.gz RLRQHEGOQWLMDI-BJLQDIEVSA-N 1 1 426.565 3.006 20 0 IGADMO COc1nc(-c2ccccc2)nc(N2CC[C@@H]3[C@H](C[C@H](Cn4cccn4)[N@H+]3C(C)C)C2)n1 ZINC001164838604 720561030 /nfs/dbraw/zinc/56/10/30/720561030.db2.gz OSXLIQNHOISZCZ-NJDAHSKKSA-N 1 1 433.560 3.122 20 0 IGADMO COc1cc(C(F)(F)N2CC[C@@H]3[C@@H](C[C@H](Cn4cccn4)[N@H+]3C(C)C)C2)nc(Cl)n1 ZINC001164843770 720648009 /nfs/dbraw/zinc/64/80/09/720648009.db2.gz YEQTVMCMWCRGGD-ARFHVFGLSA-N 1 1 440.926 3.258 20 0 IGADMO FC(F)(c1nc2ccsc2c(Cl)n1)N1CC[N@@H+]2C[C@@H](Oc3cncnc3)C[C@@H]2C1 ZINC001164743635 720650137 /nfs/dbraw/zinc/65/01/37/720650137.db2.gz PUOFHDAGMGZACF-NEPJUHHUSA-N 1 1 438.891 3.022 20 0 IGADMO FC(F)(c1nc2ccsc2c(Cl)n1)N1CC[N@H+]2C[C@@H](Oc3cncnc3)C[C@@H]2C1 ZINC001164743635 720650147 /nfs/dbraw/zinc/65/01/47/720650147.db2.gz PUOFHDAGMGZACF-NEPJUHHUSA-N 1 1 438.891 3.022 20 0 IGADMO C[N@@H+](Cc1ccccc1)[C@@H]1COC2(C1)CCN(c1ccc(CN3CCOCC3)cn1)CC2 ZINC001164839135 720663934 /nfs/dbraw/zinc/66/39/34/720663934.db2.gz ITBFGTONJZWSKE-DEOSSOPVSA-N 1 1 436.600 3.174 20 0 IGADMO C[N@@H+](Cc1ccccc1)[C@@H]1COC2(C1)CCN(c1nc(Cl)c(F)cc1C(N)=O)CC2 ZINC001164837607 720677538 /nfs/dbraw/zinc/67/75/38/720677538.db2.gz DJSHKHDPTAYJDI-INIZCTEOSA-N 1 1 432.927 3.233 20 0 IGADMO Cn1cnc2c1nc(Cl)nc2N1CCC2(C[C@H]([N@@H+](C)Cc3ccccc3)CO2)CC1 ZINC001164839856 720681349 /nfs/dbraw/zinc/68/13/49/720681349.db2.gz CDRZGORXNQYYRC-KRWDZBQOSA-N 1 1 426.952 3.277 20 0 IGADMO Cc1nc2sc3c(c2c(N2CC[N@H+]4C[C@@H](Oc5cncnc5)C[C@H]4C2)n1)CCCCC3 ZINC001164737456 720764947 /nfs/dbraw/zinc/76/49/47/720764947.db2.gz BTNAOIVIGFNBPN-IRXDYDNUSA-N 1 1 436.585 3.401 20 0 IGADMO Fc1ccc(Oc2nc(Cl)ncc2N2CC[N@H+]3C[C@@H](Oc4cncnc4)C[C@H]3C2)cc1 ZINC001164739928 720767198 /nfs/dbraw/zinc/76/71/98/720767198.db2.gz JUYRRRQUQSVPDB-RDJZCZTQSA-N 1 1 442.882 3.193 20 0 IGADMO Cc1ccccc1Oc1nc(Cl)ncc1N1CC[N@H+]2C[C@H](Oc3cncnc3)C[C@H]2C1 ZINC001164740705 720803182 /nfs/dbraw/zinc/80/31/82/720803182.db2.gz AFIBAXAIGFCHRT-DLBZAZTESA-N 1 1 438.919 3.363 20 0 IGADMO Fc1ccccc1Oc1nc(Cl)ncc1N1CC[N@H+]2C[C@H](Oc3cncnc3)C[C@H]2C1 ZINC001164741605 720803240 /nfs/dbraw/zinc/80/32/40/720803240.db2.gz BKIQDPCCVLCVKQ-LSDHHAIUSA-N 1 1 442.882 3.193 20 0 IGADMO c1ncn(C[C@H]2C[C@@H]3CN(c4cc(Oc5ccccc5)ncn4)CC[C@H]3[N@H+]2CC2CC2)n1 ZINC001164741304 720817012 /nfs/dbraw/zinc/81/70/12/720817012.db2.gz NJZKLTPKYAVKNJ-KCZVDYSFSA-N 1 1 431.544 3.240 20 0 IGADMO Fc1ccc(Cl)nc1C(F)(F)N1CC[C@@H]2[C@@H](C[C@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164737389 720827334 /nfs/dbraw/zinc/82/73/34/720827334.db2.gz ASACVSKRXLHMBE-ZMSDIMECSA-N 1 1 440.901 3.390 20 0 IGADMO Fc1ccc(Cl)nc1C(F)(F)N1CC[C@@H]2[C@H](C[C@@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164737387 720827493 /nfs/dbraw/zinc/82/74/93/720827493.db2.gz ASACVSKRXLHMBE-HLLBOEOZSA-N 1 1 440.901 3.390 20 0 IGADMO CCc1c(Cl)nnc(N2CC[C@@H]3[C@@H](C[C@@H](Cn4cncn4)[N@H+]3CC3CC3)C2)c1CC ZINC001164743290 720830163 /nfs/dbraw/zinc/83/01/63/720830163.db2.gz RYAOIVSEEREMPN-ABSDTBQOSA-N 1 1 430.000 3.226 20 0 IGADMO c1ncn(C[C@@H]2C[C@H]3CN(c4cc(OCc5ccccc5)cnn4)CC[C@H]3[N@@H+]2CC2CC2)n1 ZINC001164751001 720834854 /nfs/dbraw/zinc/83/48/54/720834854.db2.gz XOOUABRHCFDCFD-WPFOTENUSA-N 1 1 445.571 3.027 20 0 IGADMO CCCN(CCC)c1cc(N2CC[C@@H]3[C@@H](C[C@@H](Cn4cncn4)[N@H+]3CC3CC3)C2)ncn1 ZINC001164745148 720838901 /nfs/dbraw/zinc/83/89/01/720838901.db2.gz LPZCGPISDCCOBH-FDFHNCONSA-N 1 1 438.624 3.074 20 0 IGADMO CCCN(CCC)c1cc(N2CC[C@@H]3[C@H](C[C@@H](Cn4cncn4)[N@H+]3CC3CC3)C2)ncn1 ZINC001164745147 720839049 /nfs/dbraw/zinc/83/90/49/720839049.db2.gz LPZCGPISDCCOBH-BHIFYINESA-N 1 1 438.624 3.074 20 0 IGADMO COc1cccc(-c2ccnc(N3CC[C@@H]4[C@@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)n2)c1 ZINC001164748325 720839107 /nfs/dbraw/zinc/83/91/07/720839107.db2.gz UEUQAUIYFAEHCN-YZUZCNPQSA-N 1 1 445.571 3.123 20 0 IGADMO c1ncn(C[C@@H]2C[C@H]3CN(c4cnc(OCc5ccccc5)cn4)CC[C@H]3[N@@H+]2CC2CC2)n1 ZINC001164741260 720841341 /nfs/dbraw/zinc/84/13/41/720841341.db2.gz DWERNKSWSQKXSD-RJGXRXQPSA-N 1 1 445.571 3.027 20 0 IGADMO Fc1cccc(Oc2ccnc(N3CC[C@@H]4[C@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)n2)c1 ZINC001164747480 720841918 /nfs/dbraw/zinc/84/19/18/720841918.db2.gz QQWVTJPNIUJRTN-SYYKKAFVSA-N 1 1 449.534 3.379 20 0 IGADMO CC(C)(C)c1nc2[nH]ccc2c(N2CC[C@@H]3[C@H](C[C@H](Cn4cncn4)[N@H+]3CC3CC3)C2)n1 ZINC001164741731 720842346 /nfs/dbraw/zinc/84/23/46/720842346.db2.gz FODSEMPPCVREES-QWFCFKBJSA-N 1 1 434.592 3.226 20 0 IGADMO c1ncn(C[C@@H]2C[C@H]3CN(c4ncnc5sc6c(c54)CCC6)CC[C@H]3[N@H+]2CC2CC2)n1 ZINC001164740527 720845835 /nfs/dbraw/zinc/84/58/35/720845835.db2.gz CHRWTJXHYAPTIM-JENIJYKNSA-N 1 1 435.601 3.151 20 0 IGADMO c1ncn(C[C@@H]2C[C@@H]3CN(c4ccnc(Cc5ccccc5)n4)CC[C@H]3[N@H+]2CC2CC2)n1 ZINC001164753106 720851683 /nfs/dbraw/zinc/85/16/83/720851683.db2.gz WUCOBMGAVCESSG-XPWALMASSA-N 1 1 429.572 3.038 20 0 IGADMO c1ncn(C[C@@H]2C[C@H]3CN(c4cncc(OCC5CCCC5)n4)CC[C@H]3[N@@H+]2CC2CC2)n1 ZINC001164752006 720858195 /nfs/dbraw/zinc/85/81/95/720858195.db2.gz SHZPGRJICZKWTM-FDFHNCONSA-N 1 1 437.592 3.017 20 0 IGADMO Fc1ccc2c(c1)[nH]c1ncnc(N3CC[C@@H]4[C@@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)c21 ZINC001164746224 720860981 /nfs/dbraw/zinc/86/09/81/720860981.db2.gz GMFWGWGROLKNLM-YRISNDGFSA-N 1 1 446.534 3.221 20 0 IGADMO Fc1ccc2c(c1)[nH]c1ncnc(N3CC[C@@H]4[C@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)c21 ZINC001164746220 720861081 /nfs/dbraw/zinc/86/10/81/720861081.db2.gz GMFWGWGROLKNLM-PLMTUMEDSA-N 1 1 446.534 3.221 20 0 IGADMO COCC[N@H+]1CCO[C@H]2CN(C(F)(F)c3nc4ccccc4nc3Cl)CC[C@H]2C1 ZINC001164853112 720863680 /nfs/dbraw/zinc/86/36/80/720863680.db2.gz GMPCIVLKUQMPGW-YOEHRIQHSA-N 1 1 426.895 3.002 20 0 IGADMO Cc1c[nH]c2ncnc(N3CC[C@]4(C3)C[N@@H+](CC3CC3)C[C@@H]4COCc3cccnc3)c12 ZINC001164753433 720868088 /nfs/dbraw/zinc/86/80/88/720868088.db2.gz PMUOJZHWFVZNOO-PXDATVDWSA-N 1 1 432.572 3.416 20 0 IGADMO COc1nc(Cl)cc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COCc2cccnc2)n1 ZINC001164749083 720871658 /nfs/dbraw/zinc/87/16/58/720871658.db2.gz GRSDCPGACKHXTO-XXBNENTESA-N 1 1 443.979 3.289 20 0 IGADMO Cc1nc(N(C)C)cc(N2CC[C@@]3(C2)C[N@H+](CC2CC2)C[C@@H]3COCc2cccnc2)n1 ZINC001164755900 720874197 /nfs/dbraw/zinc/87/41/97/720874197.db2.gz ZSPCCOGSXQLGMT-RDGATRHJSA-N 1 1 436.604 3.001 20 0 IGADMO Cc1nc(N(C)C)cc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COCc2cccnc2)n1 ZINC001164755900 720874200 /nfs/dbraw/zinc/87/42/00/720874200.db2.gz ZSPCCOGSXQLGMT-RDGATRHJSA-N 1 1 436.604 3.001 20 0 IGADMO COCC[N@H+]1CCO[C@@H]2CN(c3cc(F)ccc3Oc3ccc(Cl)nn3)CC[C@H]2C1 ZINC001164854458 720875079 /nfs/dbraw/zinc/87/50/79/720875079.db2.gz FGLRLPCMSJULCS-HNAYVOBHSA-N 1 1 436.915 3.235 20 0 IGADMO Cn1cnc2c1ccnc2N1CC[C@@]2(C1)C[N@@H+](CC1CC1)C[C@@H]2COCc1cccnc1 ZINC001164752439 720877105 /nfs/dbraw/zinc/87/71/05/720877105.db2.gz NAFZGNSUEITDMN-BWKNWUBXSA-N 1 1 432.572 3.118 20 0 IGADMO c1cncc(COC[C@H]2C[N@@H+](CC3CC3)C[C@@]23CCN(c2ncnc4cnccc42)C3)c1 ZINC001164750137 720877834 /nfs/dbraw/zinc/87/78/34/720877834.db2.gz JAVCCWCBGHHMGC-PXDATVDWSA-N 1 1 430.556 3.175 20 0 IGADMO Clc1nc(Cl)nc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COCc2cccnc2)n1 ZINC001164752895 720881354 /nfs/dbraw/zinc/88/13/54/720881354.db2.gz NIPYBWPAYOZTRO-UTKZUKDTSA-N 1 1 449.386 3.329 20 0 IGADMO Nc1cc(Cl)nc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COCc2cccnc2)c1 ZINC001164758449 720884407 /nfs/dbraw/zinc/88/44/07/720884407.db2.gz YDQRKWJHJRSPIU-WMZHIEFXSA-N 1 1 427.980 3.467 20 0 IGADMO COCC[N@H+]1CCO[C@H]2CN(c3cnc(Cl)nc3Oc3cccc(F)c3)CC[C@@H]2C1 ZINC001164858519 720888865 /nfs/dbraw/zinc/88/88/65/720888865.db2.gz KZYHCYGPVIYJFF-BEFAXECRSA-N 1 1 436.915 3.235 20 0 IGADMO COCC[N@H+]1CCO[C@H]2CN(c3cnc(Cl)nc3Oc3ccccc3OC)CC[C@H]2C1 ZINC001164865026 720890179 /nfs/dbraw/zinc/89/01/79/720890179.db2.gz XZXUGOGBDFVXOK-JXFKEZNVSA-N 1 1 448.951 3.104 20 0 IGADMO Cc1nc2c(c(N3CC[C@]4(C3)C[N@@H+](CC3CC3)C[C@H]4COCc3cccnc3)n1)CCC2 ZINC001164758164 720901953 /nfs/dbraw/zinc/90/19/53/720901953.db2.gz XIFHYUVPSDUEEK-BKMJKUGQSA-N 1 1 433.600 3.424 20 0 IGADMO Nc1cc(Cl)ncc1N1CC[C@]2(C1)C[N@@H+](CC1CC1)C[C@H]2COCc1cccnc1 ZINC001164754687 720905488 /nfs/dbraw/zinc/90/54/88/720905488.db2.gz XIVAYKBSJFSSNQ-WMZHIEFXSA-N 1 1 427.980 3.467 20 0 IGADMO [O-][n+]1cc(Cl)ccc1N1CC[C@@]2(C1)C[N@@H+](CC1CC1)C[C@H]2COCc1cccnc1 ZINC001164750612 720905793 /nfs/dbraw/zinc/90/57/93/720905793.db2.gz JXOXNFCVFXUVJM-REWPJTCUSA-N 1 1 428.964 3.124 20 0 IGADMO c1ccc2nc(N3CC[C@]4(C3)C[N@H+](CC3CC3)C[C@H]4COCc3cccnc3)nnc2c1 ZINC001164754628 720918239 /nfs/dbraw/zinc/91/82/39/720918239.db2.gz WKUFAHHTFRQKRI-SQJMNOBHSA-N 1 1 430.556 3.175 20 0 IGADMO CC(C)[N@@H+](C)Cc1cnc2n1CCN(c1nc(CO)ccc1NC(=O)C(C)(C)C)[C@H]2C ZINC001164859682 720986200 /nfs/dbraw/zinc/98/62/00/720986200.db2.gz LHXMDXSOYUAUKD-INIZCTEOSA-N 1 1 428.581 3.176 20 0 IGADMO FC(F)(c1cc(-c2ccco2)nnc1Cl)N1CCc2[nH+]cc(Cn3cccn3)n2CC1 ZINC001164861443 721033869 /nfs/dbraw/zinc/03/38/69/721033869.db2.gz HNLWQZCZKVKWBS-UHFFFAOYSA-N 1 1 445.861 3.439 20 0 IGADMO FC(F)(c1nc(Cl)cc(Cl)n1)N1CC[N@H+]2C[C@@H](OCc3cccnc3)C[C@H]2C1 ZINC001164868015 721054918 /nfs/dbraw/zinc/05/49/18/721054918.db2.gz MBXXXJZPRYAICV-KBPBESRZSA-N 1 1 430.286 3.203 20 0 IGADMO COc1ccc2nc(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@H]4C3)c(Cl)nc2c1 ZINC001164866411 721076758 /nfs/dbraw/zinc/07/67/58/721076758.db2.gz TZTUXJGCKKYALN-WMZOPIPTSA-N 1 1 425.920 3.167 20 0 IGADMO CCOC(=O)c1cnc(Cl)c(N2C[C@@H]3CC[N@@H+](Cc4cnn(C)c4)C[C@H]3C2)c1Cl ZINC001164768283 721097312 /nfs/dbraw/zinc/09/73/12/721097312.db2.gz MTIQFUPMFRMEKS-GJZGRUSLSA-N 1 1 438.359 3.257 20 0 IGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4ncnc5c4ccn5Cc4cccc(F)c4)C[C@@H]3C2)cn1 ZINC001164762685 721144848 /nfs/dbraw/zinc/14/48/48/721144848.db2.gz DECTXKAMWMSLSX-RTWAWAEBSA-N 1 1 445.546 3.311 20 0 IGADMO FC(F)(c1c2c(nnc1Cl)CCC2)N1CC[N@H+]2C[C@@H](OCc3cccnc3)C[C@H]2C1 ZINC001164881192 721150549 /nfs/dbraw/zinc/15/05/49/721150549.db2.gz ZRENJIWJKVWUGD-HOTGVXAUSA-N 1 1 435.906 3.038 20 0 IGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4ncc(C(=O)N5CCCCC5)cc4Cl)C[C@H]3C2)cn1 ZINC001164761973 721207460 /nfs/dbraw/zinc/20/74/60/721207460.db2.gz BGYNKDUXRFZCDW-UYAOXDASSA-N 1 1 442.995 3.053 20 0 IGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4ccc(C(=O)OCc5ccccc5)cn4)C[C@H]3C2)cn1 ZINC001164762540 721212412 /nfs/dbraw/zinc/21/24/12/721212412.db2.gz CRYWEGVCCFVROO-XZOQPEGZSA-N 1 1 431.540 3.130 20 0 IGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4nc(-c5ccncc5)nc5sccc54)C[C@H]3C2)cn1 ZINC001164759476 721229131 /nfs/dbraw/zinc/22/91/31/721229131.db2.gz AMYJORRNUAPNIJ-RTBURBONSA-N 1 1 431.569 3.445 20 0 IGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4cncc(OCc5cccc(Cl)c5)n4)C[C@@H]3C2)cn1 ZINC001164767898 721237624 /nfs/dbraw/zinc/23/76/24/721237624.db2.gz WYOCBRJFWYPFBV-UXHICEINSA-N 1 1 438.963 3.401 20 0 IGADMO COC(=O)c1cc(Cl)cc(N2CCC[C@]3(C2)COCC[N@H+](Cc2c(C)noc2C)C3)n1 ZINC001164777317 721340231 /nfs/dbraw/zinc/34/02/31/721340231.db2.gz FZZVJZBCWUFYTP-QFIPXVFZSA-N 1 1 448.951 3.245 20 0 IGADMO COC(=O)c1cc(Cl)cc(N2CCC[C@]3(C2)COCC[N@@H+](Cc2c(C)noc2C)C3)n1 ZINC001164777317 721340236 /nfs/dbraw/zinc/34/02/36/721340236.db2.gz FZZVJZBCWUFYTP-QFIPXVFZSA-N 1 1 448.951 3.245 20 0 IGADMO O=C(c1ccccc1)N1CCO[C@H]2CN(c3nc(Cl)ccc3C[NH+]3CCCC3)C[C@H]2C1 ZINC001164885855 721350065 /nfs/dbraw/zinc/35/00/65/721350065.db2.gz QMYZPBHWNQZSNO-RTWAWAEBSA-N 1 1 440.975 3.308 20 0 IGADMO CCOC(=O)c1cc(C)cnc1N1CCC[C@]2(C1)COCC[N@H+](Cc1c(C)noc1C)C2 ZINC001164779404 721350401 /nfs/dbraw/zinc/35/04/01/721350401.db2.gz SYHCRTRRUIYDJK-DEOSSOPVSA-N 1 1 442.560 3.291 20 0 IGADMO CCOC(=O)c1cc(C)cnc1N1CCC[C@]2(C1)COCC[N@@H+](Cc1c(C)noc1C)C2 ZINC001164779404 721350404 /nfs/dbraw/zinc/35/04/04/721350404.db2.gz SYHCRTRRUIYDJK-DEOSSOPVSA-N 1 1 442.560 3.291 20 0 IGADMO CCOC(=O)c1cc(N2CCC[C@]3(C2)COCC[N@H+](Cc2c(C)noc2C)C3)ncc1C ZINC001164777870 721353606 /nfs/dbraw/zinc/35/36/06/721353606.db2.gz JUGATGIJJLTXIB-DEOSSOPVSA-N 1 1 442.560 3.291 20 0 IGADMO CCOC(=O)c1cc(N2CCC[C@]3(C2)COCC[N@@H+](Cc2c(C)noc2C)C3)ncc1C ZINC001164777870 721353610 /nfs/dbraw/zinc/35/36/10/721353610.db2.gz JUGATGIJJLTXIB-DEOSSOPVSA-N 1 1 442.560 3.291 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@@]2(CCCN(c3ncnc4cc(Cl)cnc43)C2)C1 ZINC001164780037 721354497 /nfs/dbraw/zinc/35/44/97/721354497.db2.gz CNJVOBWHCXGGTC-QFIPXVFZSA-N 1 1 442.951 3.402 20 0 IGADMO COc1cc2nc(Cl)nc(N3C[C@@H]4C[NH+](Cc5nccs5)C[C@H]4C3)c2cc1OC ZINC001164789896 721404044 /nfs/dbraw/zinc/40/40/44/721404044.db2.gz VBLMODRAPVUDES-STQMWFEESA-N 1 1 431.949 3.325 20 0 IGADMO c1csc(C[N@@H+]2C[C@H]3CN(c4ncnc5c4CCN(Cc4ccccc4)C5)C[C@H]3C2)n1 ZINC001164790755 721406155 /nfs/dbraw/zinc/40/61/55/721406155.db2.gz XXKGSOCSHZSLIY-BGYRXZFFSA-N 1 1 432.597 3.060 20 0 IGADMO c1csc(C[N@H+]2C[C@H]3CN(c4ncnc5c4CCN(Cc4ccccc4)C5)C[C@H]3C2)n1 ZINC001164790755 721406159 /nfs/dbraw/zinc/40/61/59/721406159.db2.gz XXKGSOCSHZSLIY-BGYRXZFFSA-N 1 1 432.597 3.060 20 0 IGADMO C[NH+]1CCN(C[C@@H]2CCC[C@]3(CCN(c4nccc(-c5ccc(F)cc5)n4)C3)O2)CC1 ZINC001164888332 721407993 /nfs/dbraw/zinc/40/79/93/721407993.db2.gz OGGBPZBWCIMFAI-XUZZJYLKSA-N 1 1 425.552 3.048 20 0 IGADMO CCOc1cc2ncnc(N3C[C@@H]4C[N@@H+](Cc5nccs5)C[C@@H]4C3)c2cc1OCC ZINC001164781149 721410554 /nfs/dbraw/zinc/41/05/54/721410554.db2.gz CBOLCFDGAVXYHS-IYBDPMFKSA-N 1 1 425.558 3.452 20 0 IGADMO CCOc1cc2ncnc(N3C[C@@H]4C[N@H+](Cc5nccs5)C[C@@H]4C3)c2cc1OCC ZINC001164781149 721410556 /nfs/dbraw/zinc/41/05/56/721410556.db2.gz CBOLCFDGAVXYHS-IYBDPMFKSA-N 1 1 425.558 3.452 20 0 IGADMO Fc1ccccc1Cn1cnc2c1ncnc2N1C[C@H]2C[NH+](Cc3nccs3)C[C@@H]2C1 ZINC001164780603 721416570 /nfs/dbraw/zinc/41/65/70/721416570.db2.gz BNOOGCAMLYJCIE-IAGOWNOFSA-N 1 1 435.532 3.038 20 0 IGADMO CSc1nc2ccccc2c(N2CC[C@]3(C2)CCC[C@@H](CN2CC[NH+](C)CC2)O3)n1 ZINC001164888996 721417066 /nfs/dbraw/zinc/41/70/66/721417066.db2.gz PZPQTCBVDYFHCO-MBSDFSHPSA-N 1 1 427.618 3.117 20 0 IGADMO C[NH+]1CCN(C[C@H]2CCC[C@]3(CCN(c4cncc(Oc5cccc(F)c5)n4)C3)O2)CC1 ZINC001164889604 721424708 /nfs/dbraw/zinc/42/47/08/721424708.db2.gz CFZOIDYCJVTVCU-ZJSXRUAMSA-N 1 1 441.551 3.173 20 0 IGADMO Cc1nc2sc3c(c2c(N2CC[C@@]4(C2)CCC[C@@H](CN2CC[NH+](C)CC2)O4)n1)CCC3 ZINC001164895802 721433122 /nfs/dbraw/zinc/43/31/22/721433122.db2.gz PQUGDGGQSABMLZ-MHECFPHRSA-N 1 1 441.645 3.254 20 0 IGADMO C[NH+]1CCN(C[C@H]2CCC[C@]3(CCN(c4nccc(Oc5ccc(F)cc5)n4)C3)O2)CC1 ZINC001164892224 721440478 /nfs/dbraw/zinc/44/04/78/721440478.db2.gz HTUVIXKXSRRAJV-ZJSXRUAMSA-N 1 1 441.551 3.173 20 0 IGADMO C[NH+]1CCN(C[C@@H]2CCC[C@]3(CCN(c4nc(C(F)F)nc5ccc(F)cc54)C3)O2)CC1 ZINC001164894329 721445439 /nfs/dbraw/zinc/44/54/39/721445439.db2.gz LSUKNKVQLYYNDO-GAJHUEQPSA-N 1 1 449.521 3.472 20 0 IGADMO Cc1c(Cl)nc(CC(C)C)nc1N1CC[C@@]2(C1)CCC[C@H](CN1CC[NH+](C)CC1)O2 ZINC001164896175 721446236 /nfs/dbraw/zinc/44/62/36/721446236.db2.gz QTXBWZYEIQAMNG-AUSIDOKSSA-N 1 1 436.044 3.402 20 0 IGADMO Cc1c(Cl)nc(CC(C)C)nc1N1CC[C@]2(C1)CCC[C@H](CN1CC[NH+](C)CC1)O2 ZINC001164896181 721446434 /nfs/dbraw/zinc/44/64/34/721446434.db2.gz QTXBWZYEIQAMNG-XXBNENTESA-N 1 1 436.044 3.402 20 0 IGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1ncc(C)c(NC(C)C)n1)CC2 ZINC001164790385 721447824 /nfs/dbraw/zinc/44/78/24/721447824.db2.gz YRDZMCJLAMBZBU-OAQYLSRUSA-N 1 1 431.625 3.339 20 0 IGADMO CCc1nc(Cl)nc(Cl)c1N1CC[C@@]2(C1)CCC[C@@H](CN1CC[NH+](C)CC1)O2 ZINC001164888485 721450491 /nfs/dbraw/zinc/45/04/91/721450491.db2.gz MPEKBBNRNDEVGF-MGPUTAFESA-N 1 1 428.408 3.111 20 0 IGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(C(F)(F)c1cnc(Cl)nc1)CC2 ZINC001164785206 721453770 /nfs/dbraw/zinc/45/37/70/721453770.db2.gz HFDUJGNUFCQVOY-SFHVURJKSA-N 1 1 444.954 3.409 20 0 IGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1nc3ncccc3nc1Cl)CC2 ZINC001164783858 721459625 /nfs/dbraw/zinc/45/96/25/721459625.db2.gz GDYUEWHLQYWYOS-SFHVURJKSA-N 1 1 445.995 3.412 20 0 IGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1ccc(-c3ccco3)nn1)CC2 ZINC001164791292 721468851 /nfs/dbraw/zinc/46/88/51/721468851.db2.gz WOEBALLTVFKWIX-HXUWFJFHSA-N 1 1 426.561 3.471 20 0 IGADMO CCOC(=O)c1cc(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@@H]32)ncc1Cl ZINC001164805504 721530703 /nfs/dbraw/zinc/53/07/03/721530703.db2.gz LYMMUGOBXKNGPX-IRFCIJBXSA-N 1 1 430.936 3.175 20 0 IGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2ncccc2C(=O)NC2CCCCC2)[C@@H]2CCCO[C@H]12 ZINC001164810524 721532235 /nfs/dbraw/zinc/53/22/35/721532235.db2.gz XFHRBYOCOWWQQI-SMIHKQSGSA-N 1 1 449.599 3.407 20 0 IGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2ncccc2C(=O)NC2CCCCC2)[C@@H]2CCCO[C@H]12 ZINC001164810524 721532237 /nfs/dbraw/zinc/53/22/37/721532237.db2.gz XFHRBYOCOWWQQI-SMIHKQSGSA-N 1 1 449.599 3.407 20 0 IGADMO Fc1cccc(O[C@H]2C[C@@H]3CN(C(F)(F)COc4ccc(Cl)nn4)CC[N@H+]3C2)c1 ZINC001164903550 721553613 /nfs/dbraw/zinc/55/36/13/721553613.db2.gz CFLPCBYLAUUYIP-ZBFHGGJFSA-N 1 1 428.842 3.078 20 0 IGADMO Cc1nc2c(nc(Cl)nc2N2C[C@H]([N@H+](C)Cc3cccnc3)[C@H]3OCCC[C@H]32)s1 ZINC001164798181 721559436 /nfs/dbraw/zinc/55/94/36/721559436.db2.gz ANRJESDIEJAJEC-VYDXJSESSA-N 1 1 430.965 3.311 20 0 IGADMO Cc1nc2c(nc(Cl)nc2N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@H]3OCCC[C@H]32)s1 ZINC001164798181 721559440 /nfs/dbraw/zinc/55/94/40/721559440.db2.gz ANRJESDIEJAJEC-VYDXJSESSA-N 1 1 430.965 3.311 20 0 IGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(C(F)(F)COc2cccc(Cl)n2)[C@@H]2CCCO[C@@H]12 ZINC001164809382 721564707 /nfs/dbraw/zinc/56/47/07/721564707.db2.gz WRSHHTBMCNONLW-MBOZVWFJSA-N 1 1 438.906 3.465 20 0 IGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(C(F)(F)COc2cccc(Cl)n2)[C@@H]2CCCO[C@@H]12 ZINC001164809382 721564711 /nfs/dbraw/zinc/56/47/11/721564711.db2.gz WRSHHTBMCNONLW-MBOZVWFJSA-N 1 1 438.906 3.465 20 0 IGADMO CSc1nc2ncnc(N3C[C@H]([N@H+](C)Cc4cccnc4)[C@H]4OCCC[C@H]43)c2s1 ZINC001164807280 721568354 /nfs/dbraw/zinc/56/83/54/721568354.db2.gz SGXJGCXLQSXHKR-PMPSAXMXSA-N 1 1 428.587 3.071 20 0 IGADMO CSc1nc2ncnc(N3C[C@H]([N@@H+](C)Cc4cccnc4)[C@H]4OCCC[C@H]43)c2s1 ZINC001164807280 721568359 /nfs/dbraw/zinc/56/83/59/721568359.db2.gz SGXJGCXLQSXHKR-PMPSAXMXSA-N 1 1 428.587 3.071 20 0 IGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(C(F)(F)c2c3c(nnc2Cl)CCC3)[C@H]2CCCO[C@H]12 ZINC001164807648 721580185 /nfs/dbraw/zinc/58/01/85/721580185.db2.gz PBSUMZRQPUKOEA-NSHGMRRFSA-N 1 1 449.933 3.427 20 0 IGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(C(F)(F)c2c3c(nnc2Cl)CCC3)[C@H]2CCCO[C@H]12 ZINC001164807648 721580188 /nfs/dbraw/zinc/58/01/88/721580188.db2.gz PBSUMZRQPUKOEA-NSHGMRRFSA-N 1 1 449.933 3.427 20 0 IGADMO COC(=O)c1cccc2nc(N3C[C@H]([N@@H+](C)Cc4cccnc4)[C@H]4OCCC[C@@H]43)ccc21 ZINC001164801872 721585707 /nfs/dbraw/zinc/58/57/07/721585707.db2.gz GAHPIODUJJMENJ-FIXSFTCYSA-N 1 1 432.524 3.285 20 0 IGADMO CSc1nc(Cl)nc(N2CCC(F)(F)[C@@]3(CC[N@@H+](Cc4ccccn4)C3)C2)n1 ZINC001164905608 721695409 /nfs/dbraw/zinc/69/54/09/721695409.db2.gz KBKQYZHSCHUORS-QGZVFWFLSA-N 1 1 426.924 3.380 20 0 IGADMO COC(=O)c1nc(Cl)cnc1N1CCC(F)(F)[C@]2(CC[N@@H+](Cc3ccccn3)C2)C1 ZINC001164907856 721706723 /nfs/dbraw/zinc/70/67/23/721706723.db2.gz UVTHUYYTWSNIPB-IBGZPJMESA-N 1 1 437.878 3.049 20 0 IGADMO C[C@H]1CC(=O)Nc2ncnc(N3CCC(F)(F)[C@@]4(CC[N@@H+](Cc5ccccn5)C4)C3)c21 ZINC001164906651 721707055 /nfs/dbraw/zinc/70/70/55/721707055.db2.gz NMYILNXCQSAXDL-YCRPNKLZSA-N 1 1 428.487 3.055 20 0 IGADMO FC1(F)CCN(c2nccc(C3CC[NH2+]CC3)n2)C[C@]12CCN(Cc1ccccn1)C2 ZINC001164908927 721716068 /nfs/dbraw/zinc/71/60/68/721716068.db2.gz ZNRQRQOZDOUTCE-JOCHJYFZSA-N 1 1 428.531 3.076 20 0 IGADMO FC1(F)CCN(c2nccc(C3CC[NH2+]CC3)n2)C[C@@]12CCN(Cc1ccccn1)C2 ZINC001164908929 721716402 /nfs/dbraw/zinc/71/64/02/721716402.db2.gz ZNRQRQOZDOUTCE-QFIPXVFZSA-N 1 1 428.531 3.076 20 0 IGADMO CCCNC(=O)c1cccnc1N1CCC(F)(F)[C@@]2(CC[N@@H+](Cc3ccccn3)C2)C1 ZINC001164907397 721724769 /nfs/dbraw/zinc/72/47/69/721724769.db2.gz ROIMJONTGUBQLA-JOCHJYFZSA-N 1 1 429.515 3.354 20 0 IGADMO NC(=O)c1cc2ccccc2c(N2CCC(F)(F)[C@]3(CC[N@@H+](Cc4ccccn4)C3)C2)n1 ZINC001164909878 721728568 /nfs/dbraw/zinc/72/85/68/721728568.db2.gz FGSJQUFZRVKTTC-QHCPKHFHSA-N 1 1 437.494 3.466 20 0 IGADMO Clc1cc(N2CCO[C@]3(C2)COCC[N@H+](Cc2cccnc2)C3)c2sccc2n1 ZINC001164911978 721778056 /nfs/dbraw/zinc/77/80/56/721778056.db2.gz IYUXSNJBPIKRFL-OAQYLSRUSA-N 1 1 430.961 3.453 20 0 IGADMO Clc1cc(N2CCO[C@]3(C2)COCC[N@@H+](Cc2cccnc2)C3)c2sccc2n1 ZINC001164911978 721778057 /nfs/dbraw/zinc/77/80/57/721778057.db2.gz IYUXSNJBPIKRFL-OAQYLSRUSA-N 1 1 430.961 3.453 20 0 IGADMO Clc1ccc(C[NH+]2CCCC2)c(N2CCO[C@@H]3[C@@H](OCCCn4cccn4)CC[C@@H]32)n1 ZINC001165024544 721780760 /nfs/dbraw/zinc/78/07/60/721780760.db2.gz XWEWZBQZWYFWIX-ONTIZHBOSA-N 1 1 445.995 3.370 20 0 IGADMO Cc1sc2nc(C)nc(N3CCO[C@]4(C3)COCC[N@H+](Cc3cccnc3)C4)c2c1C ZINC001164914866 721781869 /nfs/dbraw/zinc/78/18/69/721781869.db2.gz GPKSGWMBCBTCJL-HSZRJFAPSA-N 1 1 439.585 3.119 20 0 IGADMO Cc1sc2nc(C)nc(N3CCO[C@]4(C3)COCC[N@@H+](Cc3cccnc3)C4)c2c1C ZINC001164914866 721781871 /nfs/dbraw/zinc/78/18/71/721781871.db2.gz GPKSGWMBCBTCJL-HSZRJFAPSA-N 1 1 439.585 3.119 20 0 IGADMO C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@@H]2CN(c3nc(Cl)ccc3S(C)(=O)=O)C[C@@H]21 ZINC001165021434 721821823 /nfs/dbraw/zinc/82/18/23/721821823.db2.gz FPVJBFFPRCVBNW-BPQIPLTHSA-N 1 1 434.993 3.270 20 0 IGADMO Cc1nc2c(nc(Cl)nc2N2C[C@@H]3CCC[C@H]([N@@H+](C)Cc4ccccn4)[C@@H]3C2)n1C ZINC001165026024 721822617 /nfs/dbraw/zinc/82/26/17/721822617.db2.gz OBSGFTQWVBLHCY-JQHSSLGASA-N 1 1 425.968 3.457 20 0 IGADMO CCCNC(=O)c1cc(Cl)nc(N2C[C@@H]3CCC[C@@H]([N@@H+](C)Cc4ccccn4)[C@H]3C2)n1 ZINC001165021385 721832273 /nfs/dbraw/zinc/83/22/73/721832273.db2.gz FFMCCOGIJWUYJH-XKGZKEIXSA-N 1 1 442.995 3.402 20 0 IGADMO CCCNC(=O)c1cc(Cl)nc(N2C[C@@H]3CCC[C@H]([N@@H+](C)Cc4ccccn4)[C@H]3C2)n1 ZINC001165021381 721832333 /nfs/dbraw/zinc/83/23/33/721832333.db2.gz FFMCCOGIJWUYJH-QRFRQXIXSA-N 1 1 442.995 3.402 20 0 IGADMO CN1C(=O)CC[C@H]2[C@@H]1CCN2c1nc(C[NH+]2CCCCC2)nc2sc3c(c21)CCC3 ZINC001164934457 721893358 /nfs/dbraw/zinc/89/33/58/721893358.db2.gz PTNSBWDVWJUYOS-IRXDYDNUSA-N 1 1 425.602 3.365 20 0 IGADMO c1cc(C[N@H+]2C[C@H]3C[C@@H](C2)N(c2ccc(-c4ccc(N5CCOCC5)cc4)nn2)C3)co1 ZINC001164931624 721901648 /nfs/dbraw/zinc/90/16/48/721901648.db2.gz VSALBNHFAZONSE-OFNKIYASSA-N 1 1 431.540 3.284 20 0 IGADMO Cc1ccc(C[N@H+]2CCOC3(CCN(c4ncccc4C(=O)N4CCCC4)CC3)C2)cc1 ZINC001164937303 721920158 /nfs/dbraw/zinc/92/01/58/721920158.db2.gz BLDLUWWIOBMXCG-UHFFFAOYSA-N 1 1 434.584 3.497 20 0 IGADMO CCNC(=O)c1cc(Cl)nc(N2CCC3(CC2)C[N@@H+](Cc2ccc(C)cc2)CCO3)n1 ZINC001164939728 721933595 /nfs/dbraw/zinc/93/35/95/721933595.db2.gz ANCPQHRXPITXKA-UHFFFAOYSA-N 1 1 443.979 3.060 20 0 IGADMO CCOC(Cc1c(Cl)ncnc1N1CC[NH+](CCOc2ccccc2)CC1)OCC ZINC001165045383 721956390 /nfs/dbraw/zinc/95/63/90/721956390.db2.gz TUXMINKSJSYYDY-UHFFFAOYSA-N 1 1 434.968 3.273 20 0 IGADMO c1ccc(OCC[NH+]2CCN(c3cc(N4CCN(c5ccccc5)CC4)ncn3)CC2)cc1 ZINC001165044042 721961007 /nfs/dbraw/zinc/96/10/07/721961007.db2.gz DEKCRHBWLQOUQZ-UHFFFAOYSA-N 1 1 444.583 3.004 20 0 IGADMO CSc1nc2ccsc2c(N2CCC3(CC2)C(=O)NCC[N@H+]3Cc2ccccc2)n1 ZINC001164945104 721973274 /nfs/dbraw/zinc/97/32/74/721973274.db2.gz OYHRWRRZZUJRLE-UHFFFAOYSA-N 1 1 439.610 3.384 20 0 IGADMO CSc1nc2ccsc2c(N2CCC3(CC2)C(=O)NCC[N@@H+]3Cc2ccccc2)n1 ZINC001164945104 721973275 /nfs/dbraw/zinc/97/32/75/721973275.db2.gz OYHRWRRZZUJRLE-UHFFFAOYSA-N 1 1 439.610 3.384 20 0 IGADMO COC[C@]12COC[C@H]1CN(c1nc(C[NH+]3CCCCC3)nc3sc4c(c31)CCC4)C2 ZINC001164951532 721994236 /nfs/dbraw/zinc/99/42/36/721994236.db2.gz MLVIOTCVFMGERF-WAIKUNEKSA-N 1 1 428.602 3.265 20 0 IGADMO COC[C@@]12COC[C@@H]1CN(c1nc(C[NH+]3CCCCC3)nc3sc4c(c31)CCC4)C2 ZINC001164951529 721994651 /nfs/dbraw/zinc/99/46/51/721994651.db2.gz MLVIOTCVFMGERF-HJPURHCSSA-N 1 1 428.602 3.265 20 0 IGADMO COC[C@@]12COC[C@H]1CN(c1nc(C[NH+]3CCCC3)nc3sc4c(c31)CCCC4)C2 ZINC001164946954 721995076 /nfs/dbraw/zinc/99/50/76/721995076.db2.gz BGHYSDIZZSLIPE-MWTRTKDXSA-N 1 1 428.602 3.265 20 0 IGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2C[C@H](NC(=O)c3cscn3)[C@@H]3OCCC[C@@H]32)nc1 ZINC001164950326 722001574 /nfs/dbraw/zinc/00/15/74/722001574.db2.gz HQVHTVQJTWCNMI-UFGBVDADSA-N 1 1 441.601 3.251 20 0 IGADMO Clc1nc2c(c(N3CCC4(CC3)COCC[N@@H+](Cc3ccncc3)C4)n1)CSC2 ZINC001164963909 722054535 /nfs/dbraw/zinc/05/45/35/722054535.db2.gz POQDQNTYJDPDDI-UHFFFAOYSA-N 1 1 431.993 3.391 20 0 IGADMO CC(C)CNC(=O)c1nc2c(s1)CCN(c1cc(OC3CC[NH+](C)CC3)ccn1)CC2 ZINC001164965268 722066980 /nfs/dbraw/zinc/06/69/80/722066980.db2.gz HATCCPAAPXEHFK-UHFFFAOYSA-N 1 1 443.617 3.002 20 0 IGADMO FC(F)(c1cc(Cl)nc(Cl)n1)N1CC[C@H]2C[N@@H+](Cc3cccnc3)CCO[C@@H]2C1 ZINC001164984006 722101751 /nfs/dbraw/zinc/10/17/51/722101751.db2.gz RMQGEWAMBMGMQP-LSDHHAIUSA-N 1 1 444.313 3.451 20 0 IGADMO O=C(NC1CCCCC1)c1cccnc1N1CC[C@H]2C[N@@H+](Cc3cccnc3)CCO[C@H]2C1 ZINC001164986101 722103020 /nfs/dbraw/zinc/10/30/20/722103020.db2.gz YANBDNBJAFLNGK-URXFXBBRSA-N 1 1 449.599 3.266 20 0 IGADMO FC(F)(c1nc(Cl)cc(Cl)n1)N1CC[C@H]2C[N@@H+](Cc3cccnc3)CCO[C@@H]2C1 ZINC001164983982 722103537 /nfs/dbraw/zinc/10/35/37/722103537.db2.gz RJWUYDHBAYNCHI-LSDHHAIUSA-N 1 1 444.313 3.451 20 0 IGADMO c1ccc(COc2cncc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)n2)cc1 ZINC001164983925 722106186 /nfs/dbraw/zinc/10/61/86/722106186.db2.gz RCFRUVJMDXURQO-XZOQPEGZSA-N 1 1 431.540 3.178 20 0 IGADMO Clc1nc(-c2ccccc2)nc(N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)n1 ZINC001164971399 722109491 /nfs/dbraw/zinc/10/94/91/722109491.db2.gz BXXCITBALYPLQX-UXHICEINSA-N 1 1 436.947 3.314 20 0 IGADMO COC(=O)c1ccc2c(ccnc2N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)c1 ZINC001164981126 722111100 /nfs/dbraw/zinc/11/11/00/722111100.db2.gz SXGURVZVSKBJSJ-GGAORHGYSA-N 1 1 432.524 3.144 20 0 IGADMO CCOC(=O)c1cc(Cl)nc(N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)c1C ZINC001164971883 722116429 /nfs/dbraw/zinc/11/64/29/722116429.db2.gz CZGPKQCMLJTERK-ICSRJNTNSA-N 1 1 444.963 3.342 20 0 IGADMO CCOC(=O)c1cc(Cl)nc(N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)c1C ZINC001164971884 722116537 /nfs/dbraw/zinc/11/65/37/722116537.db2.gz CZGPKQCMLJTERK-QUCCMNQESA-N 1 1 444.963 3.342 20 0 IGADMO c1ccc(COc2ccnc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)n2)cc1 ZINC001164971362 722116668 /nfs/dbraw/zinc/11/66/68/722116668.db2.gz BITJKGSTIWNGHI-DHIUTWEWSA-N 1 1 431.540 3.178 20 0 IGADMO COC(=O)c1cc2ccccc2nc1N1CC[C@H]2C[N@@H+](Cc3cccnc3)CCO[C@@H]2C1 ZINC001164979565 722130085 /nfs/dbraw/zinc/13/00/85/722130085.db2.gz LFBSZILPCQVMNT-NZQKXSOJSA-N 1 1 432.524 3.144 20 0 IGADMO c1ccc2nc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)c(N3CCCC3)nc2c1 ZINC001164980881 722138071 /nfs/dbraw/zinc/13/80/71/722138071.db2.gz NHJLCAGAAIOKED-XUZZJYLKSA-N 1 1 444.583 3.352 20 0 IGADMO COC(=O)c1cc2ccccc2c(N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)n1 ZINC001164980256 722145257 /nfs/dbraw/zinc/14/52/57/722145257.db2.gz MFZYUVPKVRFQJX-NFBKMPQASA-N 1 1 432.524 3.144 20 0 IGADMO FC(F)(c1nc2ccc(Cl)nc2[nH]1)N1CC[C@@H]2C[N@@H+](Cc3cccnc3)CCO[C@H]2C1 ZINC001164980898 722145735 /nfs/dbraw/zinc/14/57/35/722145735.db2.gz NKHITMSFERZDRT-WBVHZDCISA-N 1 1 448.905 3.279 20 0 IGADMO Cc1nc(-c2ccncc2)nc(N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)c1C ZINC001164975025 722148691 /nfs/dbraw/zinc/14/86/91/722148691.db2.gz DTSWLCUBFNIKTM-DHIUTWEWSA-N 1 1 430.556 3.278 20 0 IGADMO CCCSc1ncnc(N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)c1OC ZINC001164971686 722156551 /nfs/dbraw/zinc/15/65/51/722156551.db2.gz CYQNMYVLXWQYHN-RBUKOAKNSA-N 1 1 429.590 3.110 20 0 IGADMO COC(=O)c1ccc(N2CCC[C@@]3(CC[N@H+]3Cc3cccc(F)c3)C2)nc1C(=O)OC ZINC001164993989 722193453 /nfs/dbraw/zinc/19/34/53/722193453.db2.gz KIOYXBMHIGFYNK-HSZRJFAPSA-N 1 1 427.476 3.039 20 0 IGADMO C[NH+]1CCN(c2ncnc3c2CCN(c2cc(Cl)nc4ccc(F)cc42)CC3)CC1 ZINC001164998061 722231303 /nfs/dbraw/zinc/23/13/03/722231303.db2.gz VVIBNZUXVBNNCE-UHFFFAOYSA-N 1 1 426.927 3.174 20 0 IGADMO CCOC(=O)[C@@]12CCO[C@H]1CCN(c1nc(C[NH+]3CCCC3)nc3sc(C)c(C)c31)C2 ZINC001164434702 718978795 /nfs/dbraw/zinc/97/87/95/718978795.db2.gz VEDUAHXUIGKJFI-GAJHUEQPSA-N 1 1 444.601 3.452 20 0 IGADMO O=C1NCCc2[nH]c(-c3ccnc(N4CCC[C@H]5C[N@@H+](Cc6ccccc6)C[C@H]54)c3)cc21 ZINC001164619920 719075915 /nfs/dbraw/zinc/07/59/15/719075915.db2.gz DCVZYTYUPBXMLZ-GBXCKJPGSA-N 1 1 427.552 3.463 20 0 IGADMO Cc1ccc(NC[C@@H]2CO[C@@]3(C2)COCC[N@@H+](C(C)(C)c2ccnc(Cl)c2)C3)nn1 ZINC001164636771 719266663 /nfs/dbraw/zinc/26/66/63/719266663.db2.gz JZFAHVZIANLTBX-VGOFRKELSA-N 1 1 431.968 3.288 20 0 IGADMO Cc1ccc(NC[C@@H]2CO[C@@]3(C2)COCC[N@H+](C(C)(C)c2ccnc(Cl)c2)C3)nn1 ZINC001164636771 719266664 /nfs/dbraw/zinc/26/66/64/719266664.db2.gz JZFAHVZIANLTBX-VGOFRKELSA-N 1 1 431.968 3.288 20 0 IGADMO CN(C)c1nc(N2CCOC[C@]3(CCCN([C@H](F)c4ccnc(Cl)c4)C3)C2)cc[nH+]1 ZINC001164663792 719357239 /nfs/dbraw/zinc/35/72/39/719357239.db2.gz HEKCVYBWNUSZCF-PZJWPPBQSA-N 1 1 434.947 3.178 20 0 IGADMO COCCn1ccc2c1ncnc2N1CCC2(CCC[N@H+]2Cc2csc(C)n2)CC1 ZINC001164694396 719809775 /nfs/dbraw/zinc/80/97/75/719809775.db2.gz WWZORPNJBNVZIZ-UHFFFAOYSA-N 1 1 426.590 3.478 20 0 IGADMO COC(=O)c1cc2cnc(N3CCC4(CCC[N@H+]4Cc4csc(C)n4)CC3)nc2n1C ZINC001164693861 719812458 /nfs/dbraw/zinc/81/24/58/719812458.db2.gz ZBPRVCCHZHMRQX-UHFFFAOYSA-N 1 1 440.573 3.155 20 0 IGADMO Cc1nc(C[N@@H+]2CCCC23CCN(c2ccc(S(=O)(=O)NC(C)C)cn2)CC3)cs1 ZINC001164691153 719813078 /nfs/dbraw/zinc/81/30/78/719813078.db2.gz ABBYZDSMYWHHRK-UHFFFAOYSA-N 1 1 449.646 3.168 20 0 IGADMO COC(=O)[C@]1(C)C[C@H]([NH+]2CCOCC2)CCN1c1nc(C)nc2sc3c(c21)CCCC3 ZINC001164701672 719866919 /nfs/dbraw/zinc/86/69/19/719866919.db2.gz GPBINTHBCRFQDD-MWTRTKDXSA-N 1 1 444.601 3.111 20 0 IGADMO COC(=O)[C@@]1(C)C[C@@H]([NH+]2CCOCC2)CCN1c1nc(N2CCCC2)cc2ccccc21 ZINC001164707613 719870821 /nfs/dbraw/zinc/87/08/21/719870821.db2.gz UKCDDEZOXQBLLI-NBGIEHNGSA-N 1 1 438.572 3.068 20 0 IGADMO CC(C)(C)OC(=O)c1ccnc(N2CCC3(CC2)C[N@H+](Cc2cccs2)CCO3)n1 ZINC001164698438 719894134 /nfs/dbraw/zinc/89/41/34/719894134.db2.gz SUFNBMZSRPVBQT-UHFFFAOYSA-N 1 1 430.574 3.365 20 0 IGADMO CC(C)(C)OC(=O)c1ccnc(N2CCC3(CC2)C[N@@H+](Cc2cccs2)CCO3)n1 ZINC001164698438 719894137 /nfs/dbraw/zinc/89/41/37/719894137.db2.gz SUFNBMZSRPVBQT-UHFFFAOYSA-N 1 1 430.574 3.365 20 0 IGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1ncnc3c1CN(Cc1ccccc1)CC3)C2 ZINC001164812337 720083165 /nfs/dbraw/zinc/08/31/65/720083165.db2.gz QPKQWOZEHXLTPE-YIXXDRMTSA-N 1 1 447.627 3.220 20 0 IGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(C(F)(F)c1ccc(Cl)nc1C(=O)OC)C2 ZINC001164814989 720108989 /nfs/dbraw/zinc/10/89/89/720108989.db2.gz VCAYXZNGYZXRJO-FOIQADDNSA-N 1 1 443.922 3.251 20 0 IGADMO COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1cc3nc(C(=O)OC)cc-3c[nH]1)CC2 ZINC001164710393 720134555 /nfs/dbraw/zinc/13/45/55/720134555.db2.gz ATYRGUISFZFGCS-HXUWFJFHSA-N 1 1 449.555 3.252 20 0 IGADMO COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1ccnc(N3CCCCC3)n1)CC2 ZINC001164711740 720139203 /nfs/dbraw/zinc/13/92/03/720139203.db2.gz JDKDWXVVNWAKHO-JOCHJYFZSA-N 1 1 436.604 3.369 20 0 IGADMO CC(C)[N@@H+](C)Cc1cc(=O)n2c(n1)CN(c1nc3cc(F)c(F)cc3nc1Cl)CCC2 ZINC001164814084 720220127 /nfs/dbraw/zinc/22/01/27/720220127.db2.gz SJQRGIKWSMXJRR-UHFFFAOYSA-N 1 1 448.905 3.369 20 0 IGADMO CCc1nc(Cl)c(N2CCCn3c(=O)cc(C[N@@H+](C)C(C)C)nc3C2)c(Cl)n1 ZINC001164814568 720239781 /nfs/dbraw/zinc/23/97/81/720239781.db2.gz ZBVUHSSOUMNAKL-UHFFFAOYSA-N 1 1 425.364 3.153 20 0 IGADMO CC(C)[N@@H+](C)Cc1cc(=O)n2c(n1)CN(c1ncc(F)c(-c3ccsc3)n1)CCC2 ZINC001164815103 720245867 /nfs/dbraw/zinc/24/58/67/720245867.db2.gz ADCYPIUTMUMEMB-UHFFFAOYSA-N 1 1 428.537 3.151 20 0 IGADMO CNC(=O)C[N@@H+]1CCOC[C@@]2(CCCN(c3cc(SCc4ccccc4)ccn3)C2)C1 ZINC001164720762 720295186 /nfs/dbraw/zinc/29/51/86/720295186.db2.gz DGOHYWLDFLGYRQ-DEOSSOPVSA-N 1 1 440.613 3.039 20 0 IGADMO CNC(=O)C[N@H+]1CCOC[C@@]2(CCCN(c3cc(SCc4ccccc4)ccn3)C2)C1 ZINC001164720762 720295192 /nfs/dbraw/zinc/29/51/92/720295192.db2.gz DGOHYWLDFLGYRQ-DEOSSOPVSA-N 1 1 440.613 3.039 20 0 IGADMO COc1cc2ccnc(N3CC[C@@H]4[C@@H]3CCC(=O)N4CC3CC[NH+](C)CC3)c2cc1OC ZINC001164831923 720321491 /nfs/dbraw/zinc/32/14/91/720321491.db2.gz SEBZQSXAPXPRRI-LEWJYISDSA-N 1 1 438.572 3.164 20 0 IGADMO CCOC(Cc1c(Cl)ncnc1N1CC[C@H]2[C@H]1CC[N@H+]2Cc1cccnc1)OCC ZINC001164723035 720385360 /nfs/dbraw/zinc/38/53/60/720385360.db2.gz FPFLMEIMZFZZSE-RBUKOAKNSA-N 1 1 431.968 3.320 20 0 IGADMO Cc1nc(CO[C@@H]2CN(c3cc(OC4CC[NH+](C)CC4)ccn3)[C@@H]3CCCO[C@@H]23)cs1 ZINC001164821767 720392788 /nfs/dbraw/zinc/39/27/88/720392788.db2.gz IMKQLUQPAIDVJQ-MQSCRBSSSA-N 1 1 444.601 3.273 20 0 IGADMO COC(=O)c1ccc(NC(=O)C(C)(C)C)c(N2CC[C@H]3[C@@H]2CC[N@H+]3Cc2cccnc2)n1 ZINC001164730967 720414960 /nfs/dbraw/zinc/41/49/60/720414960.db2.gz KNOFKPFZGGMFPS-PMACEKPBSA-N 1 1 437.544 3.101 20 0 IGADMO FC(F)[C@](F)(COc1cncc(Cl)n1)N1CC[C@@H]2[C@@H]1CC[N@@H+]2Cc1cccnc1 ZINC001164730167 720452197 /nfs/dbraw/zinc/45/21/97/720452197.db2.gz IDDHRZBATAYNOR-VCBZYWHSSA-N 1 1 427.858 3.184 20 0 IGADMO FC(F)[C@](F)(COc1cncc(Cl)n1)N1CC[C@@H]2[C@@H]1CC[N@H+]2Cc1cccnc1 ZINC001164730167 720452201 /nfs/dbraw/zinc/45/22/01/720452201.db2.gz IDDHRZBATAYNOR-VCBZYWHSSA-N 1 1 427.858 3.184 20 0 IGADMO O=C(Nc1cccnc1)[C@@]12CCO[C@H]1CCN(c1nc(Cl)ccc1C[NH+]1CCCC1)C2 ZINC001164725801 720501085 /nfs/dbraw/zinc/50/10/85/720501085.db2.gz KLJJHWNJTXDVQM-WMZHIEFXSA-N 1 1 441.963 3.350 20 0 IGADMO CCOC(=O)c1cnc(Cl)cc1N1CC[C@@H]2[C@H](C[C@H](Cn3cccn3)[N@H+]2C(C)C)C1 ZINC001164832400 720507440 /nfs/dbraw/zinc/50/74/40/720507440.db2.gz ANVCVBOONWODQO-ZHALLVOQSA-N 1 1 431.968 3.486 20 0 IGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@@H]2CN(c3nc(Cl)nc4c3CSCC4)CC[C@@H]21 ZINC001164841752 720517345 /nfs/dbraw/zinc/51/73/45/720517345.db2.gz ZZFCNGXFBHHNAD-GJYPPUQNSA-N 1 1 433.025 3.494 20 0 IGADMO Cc1cc(NC(=O)c2cccnc2N2CC[C@@H]3[C@@H](C[C@@H](Cn4cccn4)[N@@H+]3C(C)C)C2)no1 ZINC001164842732 720599334 /nfs/dbraw/zinc/59/93/34/720599334.db2.gz VIGRQBIJBIOLOP-IRFCIJBXSA-N 1 1 449.559 3.205 20 0 IGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@H]2CN(C(F)(F)Oc3cnc(Cl)cn3)CC[C@@H]21 ZINC001164842019 720647054 /nfs/dbraw/zinc/64/70/54/720647054.db2.gz RQBMZLWPDSKNMD-JYJNAYRXSA-N 1 1 426.899 3.129 20 0 IGADMO FC(F)(c1nc2ccsc2c(Cl)n1)N1CC[N@@H+]2C[C@H](Oc3cncnc3)C[C@H]2C1 ZINC001164743636 720650782 /nfs/dbraw/zinc/65/07/82/720650782.db2.gz PUOFHDAGMGZACF-NWDGAFQWSA-N 1 1 438.891 3.022 20 0 IGADMO FC(F)(c1nc2ccsc2c(Cl)n1)N1CC[N@H+]2C[C@H](Oc3cncnc3)C[C@H]2C1 ZINC001164743636 720650796 /nfs/dbraw/zinc/65/07/96/720650796.db2.gz PUOFHDAGMGZACF-NWDGAFQWSA-N 1 1 438.891 3.022 20 0 IGADMO COC(=O)c1nc2cnccc2c(N2CCC3(C[C@@H]([N@@H+](C)Cc4ccccc4)CO3)CC2)n1 ZINC001164842677 720697835 /nfs/dbraw/zinc/69/78/35/720697835.db2.gz MMLQYQULHRXGSR-LJQANCHMSA-N 1 1 447.539 3.071 20 0 IGADMO CCNC(=O)c1cc(Cl)nc(N2CCC3(C[C@H]([N@@H+](C)Cc4ccccc4)CO3)CC2)n1 ZINC001164836874 720729029 /nfs/dbraw/zinc/72/90/29/720729029.db2.gz HAVOJDNVBRUBCV-SFHVURJKSA-N 1 1 443.979 3.140 20 0 IGADMO C[C@@H]1CCCCN1c1nc2ccccc2nc1N1CC[N@H+]2C[C@H](Oc3cncnc3)C[C@@H]2C1 ZINC001164740452 720759502 /nfs/dbraw/zinc/75/95/02/720759502.db2.gz LERCUOKJVHZKBG-VAMGGRTRSA-N 1 1 445.571 3.141 20 0 IGADMO Cc1nc2sc3c(c2c(N2CC[N@H+]4C[C@@H](Oc5cncnc5)C[C@@H]4C2)n1)CCCCC3 ZINC001164737457 720764231 /nfs/dbraw/zinc/76/42/31/720764231.db2.gz BTNAOIVIGFNBPN-SJORKVTESA-N 1 1 436.585 3.401 20 0 IGADMO Fc1ccc(-c2nc(Cl)cc(N3CC[N@H+]4C[C@H](Oc5cncnc5)C[C@H]4C3)n2)cc1 ZINC001164738898 720775205 /nfs/dbraw/zinc/77/52/05/720775205.db2.gz GYEXXMRSCRMSRJ-DLBZAZTESA-N 1 1 426.883 3.068 20 0 IGADMO FC(F)c1nc2ccc(Cl)cc2c(N2CC[N@H+]3C[C@@H](Oc4cncnc4)C[C@H]3C2)n1 ZINC001164747678 720799421 /nfs/dbraw/zinc/79/94/21/720799421.db2.gz PAXMLSNWABZTBJ-KBPBESRZSA-N 1 1 432.862 3.353 20 0 IGADMO Fc1cccc2c1nc(Cl)nc2N1CC[C@@H]2[C@H](C[C@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164737971 720825249 /nfs/dbraw/zinc/82/52/49/720825249.db2.gz CTJYLAGEEANGOM-GPMSIDNRSA-N 1 1 441.942 3.393 20 0 IGADMO COCC[N@H+]1CCO[C@H]2CN(C(F)(F)c3nc(Cl)c4ccccc4n3)CC[C@H]2C1 ZINC001164852577 720835994 /nfs/dbraw/zinc/83/59/94/720835994.db2.gz KYQPOBLAJXJNIY-YOEHRIQHSA-N 1 1 426.895 3.002 20 0 IGADMO COCC[N@H+]1CCO[C@@H]2CN(C(F)(F)c3ccc4c(Cl)ncnc4c3)CC[C@H]2C1 ZINC001164857078 720840110 /nfs/dbraw/zinc/84/01/10/720840110.db2.gz XFCGGHHUSMBXHF-KBXCAEBGSA-N 1 1 426.895 3.002 20 0 IGADMO c1ncn(C[C@@H]2C[C@H]3CN(c4ncc5c(n4)-c4ccccc4CC5)CC[C@H]3[N@H+]2CC2CC2)n1 ZINC001164747435 720841975 /nfs/dbraw/zinc/84/19/75/720841975.db2.gz QMJZMEOCQYFPNN-WPFOTENUSA-N 1 1 441.583 3.213 20 0 IGADMO COCC[N@H+]1CCO[C@@H]2CN(C(F)(F)c3nc4ccsc4c(Cl)n3)CC[C@@H]2C1 ZINC001164853351 720843138 /nfs/dbraw/zinc/84/31/38/720843138.db2.gz OJFOAWNWFFNEQT-TZMCWYRMSA-N 1 1 432.924 3.063 20 0 IGADMO Cc1ccc(-c2ccc(N3CC[C@@H]4[C@@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)nn2)cc1 ZINC001164742484 720844927 /nfs/dbraw/zinc/84/49/27/720844927.db2.gz GSDYXLHRKXZCMS-WMTXJRDZSA-N 1 1 429.572 3.423 20 0 IGADMO COc1cc2cnc(N3CC[C@@H]4[C@@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)cc2cc1OC ZINC001164745842 720850224 /nfs/dbraw/zinc/85/02/24/720850224.db2.gz NRNAEIZNCDGWHK-BHDDXSALSA-N 1 1 448.571 3.223 20 0 IGADMO CCc1nc(Cl)c(N2CC[C@@H]3[C@H](C[C@H](Cn4cncn4)[N@H+]3CC3CC3)C2)c(Cl)n1 ZINC001164745191 720851167 /nfs/dbraw/zinc/85/11/67/720851167.db2.gz MNNQCNMYWZCKIM-BZUAXINKSA-N 1 1 436.391 3.317 20 0 IGADMO Fc1ccc(Oc2ccnc(N3CC[C@@H]4[C@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)n2)cc1 ZINC001164749352 720851725 /nfs/dbraw/zinc/85/17/25/720851725.db2.gz NBGHPEXFUSPUJI-SYYKKAFVSA-N 1 1 449.534 3.379 20 0 IGADMO COCC[N@H+]1CCO[C@H]2CN(C(F)(F)c3nc(Cl)c4cc(F)ccc4n3)CC[C@@H]2C1 ZINC001164854847 720853040 /nfs/dbraw/zinc/85/30/40/720853040.db2.gz LERXIRNZFRRYKW-DYVFJYSZSA-N 1 1 444.885 3.141 20 0 IGADMO FC(F)(Oc1ccnc(Cl)c1)N1CC[C@@H]2[C@H](C[C@@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164753901 720857454 /nfs/dbraw/zinc/85/74/54/720857454.db2.gz ZBDHCXBBKMZHEK-SOLBZPMBSA-N 1 1 438.910 3.131 20 0 IGADMO c1ncn(C[C@@H]2C[C@H]3CN(c4cncc(OCC5CCCC5)n4)CC[C@@H]3[N@@H+]2CC2CC2)n1 ZINC001164752008 720858243 /nfs/dbraw/zinc/85/82/43/720858243.db2.gz SHZPGRJICZKWTM-FKBYEOEOSA-N 1 1 437.592 3.017 20 0 IGADMO c1cncc(COC[C@@H]2C[N@@H+](CC3CC3)C[C@]23CCN(c2nccc(N4CCCC4)n2)C3)c1 ZINC001164747177 720867275 /nfs/dbraw/zinc/86/72/75/720867275.db2.gz AIBYVNLISMTSTQ-OZXSUGGESA-N 1 1 448.615 3.227 20 0 IGADMO CSc1nccc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COCc2cccnc2)n1 ZINC001164749708 720871017 /nfs/dbraw/zinc/87/10/17/720871017.db2.gz HUZGHMBLHBNIIP-NFBKMPQASA-N 1 1 425.602 3.349 20 0 IGADMO Cn1ccc2c1ncnc2N1CC[C@]2(C1)C[N@@H+](CC1CC1)C[C@@H]2COCc1cccnc1 ZINC001164754849 720877169 /nfs/dbraw/zinc/87/71/69/720877169.db2.gz TXUDFVWJEAHZJK-PXDATVDWSA-N 1 1 432.572 3.118 20 0 IGADMO COCC[N@H+]1CCO[C@H]2CN(c3cnc(Cl)nc3Oc3ccc(F)cc3)CC[C@H]2C1 ZINC001164864252 720878043 /nfs/dbraw/zinc/87/80/43/720878043.db2.gz VFQYKGDKMNYEKM-KXBFYZLASA-N 1 1 436.915 3.235 20 0 IGADMO COCC[N@H+]1CCO[C@H]2CN(C(F)(F)c3ccc(Cl)nc3C(F)(F)F)CC[C@@H]2C1 ZINC001164855842 720885924 /nfs/dbraw/zinc/88/59/24/720885924.db2.gz HZITWNDELJANFS-OCCSQVGLSA-N 1 1 443.844 3.472 20 0 IGADMO COCC[N@H+]1CCO[C@H]2CN(c3cnc(Cl)nc3Oc3ccccc3C)CC[C@H]2C1 ZINC001164858557 720888614 /nfs/dbraw/zinc/88/86/14/720888614.db2.gz LDKDBZLIAZRBQC-PXNSSMCTSA-N 1 1 432.952 3.404 20 0 IGADMO COCC[N@H+]1CCO[C@@H]2CN(c3cnc(Cl)nc3Oc3cccc(C)c3)CC[C@@H]2C1 ZINC001164865089 720888711 /nfs/dbraw/zinc/88/87/11/720888711.db2.gz YERVUBFAMHEJGU-YLJYHZDGSA-N 1 1 432.952 3.404 20 0 IGADMO Cc1cc2ncnc(N3CC[C@]4(C3)C[N@@H+](CC3CC3)C[C@H]4COCc3cccnc3)c2[nH]1 ZINC001164752528 720895234 /nfs/dbraw/zinc/89/52/34/720895234.db2.gz DWXMSMYUTQWUSC-SQJMNOBHSA-N 1 1 432.572 3.416 20 0 IGADMO CC(C)[N@@H+](C)Cc1cnc2n1CCN(c1nc3ccccc3nc1N1CCOCC1)[C@@H]2C ZINC001164862512 720957634 /nfs/dbraw/zinc/95/76/34/720957634.db2.gz VYDAOZWWYVCRSL-GOSISDBHSA-N 1 1 435.576 3.084 20 0 IGADMO CCOC(=O)c1ccnc(N2CCn3c(C[N@@H+](C)C(C)C)cnc3[C@@H]2C)c1C(=O)OCC ZINC001164861424 721022237 /nfs/dbraw/zinc/02/22/37/721022237.db2.gz OLNKNMCXFWJHPN-INIZCTEOSA-N 1 1 443.548 3.053 20 0 IGADMO Cc1cccc(CN2C(=O)C[C@H]3[C@@H]2CCN3c2nc(Cl)ccc2C[NH+]2CCCC2)n1 ZINC001164774174 721053362 /nfs/dbraw/zinc/05/33/62/721053362.db2.gz VINBKLAYYMFNKD-PMACEKPBSA-N 1 1 425.964 3.414 20 0 IGADMO CSc1nc(Cl)cc(C(F)(F)N2C[C@@H]3CC[N@@H+](Cc4cnn(C)c4)C[C@@H]3C2)n1 ZINC001164767390 721081144 /nfs/dbraw/zinc/08/11/44/721081144.db2.gz LPJXHAYWZWVAHU-UONOGXRCSA-N 1 1 428.940 3.089 20 0 IGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4ncnc5c4ccn5Cc4ccc(F)cc4)C[C@@H]3C2)cn1 ZINC001164763413 721149421 /nfs/dbraw/zinc/14/94/21/721149421.db2.gz FORHUWCEGOCSSD-SFTDATJTSA-N 1 1 445.546 3.311 20 0 IGADMO CCOC(=O)c1cc2c(N3C[C@@H]4CC[N@@H+](Cc5cnn(C)c5)C[C@H]4C3)[nH]c(C)c(C)c-2n1 ZINC001164773549 721158097 /nfs/dbraw/zinc/15/80/97/721158097.db2.gz YIPYZFWXMQGRNR-OALUTQOASA-N 1 1 436.560 3.048 20 0 IGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(C(Cl)(Cl)Oc4ccc(Cl)nc4)C[C@H]3C2)cn1 ZINC001164766894 721245258 /nfs/dbraw/zinc/24/52/58/721245258.db2.gz VSXGATDYVDOTEE-LSDHHAIUSA-N 1 1 430.767 3.390 20 0 IGADMO COC(=O)c1cc2c(nc1N1CCCC1)CCN(c1ccc(C[N@@H+](C)C3CC3)cn1)CC2 ZINC001164776788 721308429 /nfs/dbraw/zinc/30/84/29/721308429.db2.gz PNJLRZOEMJCXTQ-UHFFFAOYSA-N 1 1 435.572 3.063 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@@]2(CCCN(c3nc(Cl)nc4[nH]ccc43)C2)C1 ZINC001164776357 721332246 /nfs/dbraw/zinc/33/22/46/721332246.db2.gz DYNCMSRWOVYQPN-NRFANRHFSA-N 1 1 430.940 3.335 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@@]2(CCCN(c3c[nH]c4ncnc(Cl)c34)C2)C1 ZINC001164776250 721338388 /nfs/dbraw/zinc/33/83/88/721338388.db2.gz DIIDEQRSMJYQAA-NRFANRHFSA-N 1 1 430.940 3.287 20 0 IGADMO COc1nc2ccccc2nc1N1CCC[C@]2(C1)COCC[N@H+](Cc1c(C)noc1C)C2 ZINC001164776824 721341931 /nfs/dbraw/zinc/34/19/31/721341931.db2.gz DCGJAGCJPGRGLO-DEOSSOPVSA-N 1 1 437.544 3.362 20 0 IGADMO COc1nc2ccccc2nc1N1CCC[C@]2(C1)COCC[N@@H+](Cc1c(C)noc1C)C2 ZINC001164776824 721341934 /nfs/dbraw/zinc/34/19/34/721341934.db2.gz DCGJAGCJPGRGLO-DEOSSOPVSA-N 1 1 437.544 3.362 20 0 IGADMO COCc1cc(N2CCC[C@]3(C2)COCC[N@H+](Cc2c(C)noc2C)C3)nc(SC)n1 ZINC001164777691 721349386 /nfs/dbraw/zinc/34/93/86/721349386.db2.gz HNYPGOSROXNHGU-QFIPXVFZSA-N 1 1 447.605 3.069 20 0 IGADMO COCc1cc(N2CCC[C@]3(C2)COCC[N@@H+](Cc2c(C)noc2C)C3)nc(SC)n1 ZINC001164777691 721349390 /nfs/dbraw/zinc/34/93/90/721349390.db2.gz HNYPGOSROXNHGU-QFIPXVFZSA-N 1 1 447.605 3.069 20 0 IGADMO COc1ccc2ncc(N3CCC[C@@]4(C3)COCC[N@H+](Cc3c(C)noc3C)C4)nc2c1 ZINC001164777181 721351882 /nfs/dbraw/zinc/35/18/82/721351882.db2.gz DYKCMSZMEDPDDB-XMMPIXPASA-N 1 1 437.544 3.362 20 0 IGADMO COc1ccc2ncc(N3CCC[C@@]4(C3)COCC[N@@H+](Cc3c(C)noc3C)C4)nc2c1 ZINC001164777181 721351884 /nfs/dbraw/zinc/35/18/84/721351884.db2.gz DYKCMSZMEDPDDB-XMMPIXPASA-N 1 1 437.544 3.362 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@]2(CCCN(c3ncnc4cccc(F)c43)C2)C1 ZINC001164779795 721353332 /nfs/dbraw/zinc/35/33/32/721353332.db2.gz WRVQLWYUTTWBAV-HSZRJFAPSA-N 1 1 425.508 3.493 20 0 IGADMO CC(=O)Nc1c(C)ccnc1N1CCC[C@@]2(C1)COCC[N@H+](Cc1c(C)noc1C)C2 ZINC001164780259 721363201 /nfs/dbraw/zinc/36/32/01/721363201.db2.gz DWIABLDPEPMXOW-HSZRJFAPSA-N 1 1 427.549 3.072 20 0 IGADMO CC(=O)Nc1c(C)ccnc1N1CCC[C@@]2(C1)COCC[N@@H+](Cc1c(C)noc1C)C2 ZINC001164780259 721363207 /nfs/dbraw/zinc/36/32/07/721363207.db2.gz DWIABLDPEPMXOW-HSZRJFAPSA-N 1 1 427.549 3.072 20 0 IGADMO COc1cc(C(F)(F)N2CC[C@@]3(C2)CCC[C@H](CN2CC[NH+](C)CC2)O3)cc(Cl)n1 ZINC001164890472 721387897 /nfs/dbraw/zinc/38/78/97/721387897.db2.gz NMAFYGLASYLOQX-YLJYHZDGSA-N 1 1 444.954 3.054 20 0 IGADMO Clc1nc(Cl)c2nc(Cl)nc(N3C[C@@H]4C[N@@H+](Cc5nccs5)C[C@@H]4C3)c2n1 ZINC001164782848 721399890 /nfs/dbraw/zinc/39/98/90/721399890.db2.gz GBCZMKUZNPGUPW-DTORHVGOSA-N 1 1 442.763 3.405 20 0 IGADMO Clc1nc(Cl)c2nc(Cl)nc(N3C[C@@H]4C[N@H+](Cc5nccs5)C[C@@H]4C3)c2n1 ZINC001164782848 721399893 /nfs/dbraw/zinc/39/98/93/721399893.db2.gz GBCZMKUZNPGUPW-DTORHVGOSA-N 1 1 442.763 3.405 20 0 IGADMO C[NH+]1CCN(C[C@@H]2CCC[C@]3(CCN(c4nc(Cl)nc5c4CCCCC5)C3)O2)CC1 ZINC001164887746 721407979 /nfs/dbraw/zinc/40/79/79/721407979.db2.gz NEVMGADYTPBGCA-FDDCHVKYSA-N 1 1 434.028 3.164 20 0 IGADMO C[NH+]1CCN(C[C@@H]2CCC[C@]3(CCN(c4nccc(-c5c[nH]c6ccccc56)n4)C3)O2)CC1 ZINC001164888956 721408616 /nfs/dbraw/zinc/40/86/16/721408616.db2.gz PUVWHGDTTMWMDE-RXFWQSSRSA-N 1 1 446.599 3.390 20 0 IGADMO Clc1nc2c(ncn2[C@H]2CCCCO2)c(N2C[C@@H]3C[N@@H+](Cc4nccs4)C[C@@H]3C2)n1 ZINC001164786256 721409336 /nfs/dbraw/zinc/40/93/36/721409336.db2.gz OQHBSMJIVNGSIF-IJEWVQPXSA-N 1 1 445.980 3.204 20 0 IGADMO Clc1nc2c(ncn2[C@H]2CCCCO2)c(N2C[C@@H]3C[N@H+](Cc4nccs4)C[C@@H]3C2)n1 ZINC001164786256 721409338 /nfs/dbraw/zinc/40/93/38/721409338.db2.gz OQHBSMJIVNGSIF-IJEWVQPXSA-N 1 1 445.980 3.204 20 0 IGADMO COC(=O)c1ccc2c(c1)nc(Cl)nc2N1C[C@@H]2C[NH+](Cc3nccs3)C[C@H]2C1 ZINC001164781824 721411508 /nfs/dbraw/zinc/41/15/08/721411508.db2.gz FIXDTGBRPHKEIT-KBPBESRZSA-N 1 1 429.933 3.095 20 0 IGADMO COc1cc2nc(Cl)c(N3C[C@@H]4C[NH+](Cc5nccs5)C[C@H]4C3)nc2cc1OC ZINC001164781207 721411853 /nfs/dbraw/zinc/41/18/53/721411853.db2.gz CYXFVUSBSVWVIS-STQMWFEESA-N 1 1 431.949 3.325 20 0 IGADMO Cc1ccc2c(c1)nc(Cl)nc2N1CC[C@@]2(C1)CCC[C@@H](CN1CC[NH+](C)CC1)O2 ZINC001164885209 721412793 /nfs/dbraw/zinc/41/27/93/721412793.db2.gz GGJDVIQXUDTYFW-FDDCHVKYSA-N 1 1 429.996 3.357 20 0 IGADMO CC(C)CNC(=O)c1ccc2c(c1)ncnc2N1C[C@@H]2C[N@@H+](Cc3nccs3)C[C@@H]2C1 ZINC001164786350 721420389 /nfs/dbraw/zinc/42/03/89/721420389.db2.gz OVKOFKMSLLCOJY-HDICACEKSA-N 1 1 436.585 3.040 20 0 IGADMO CC(C)CNC(=O)c1ccc2c(c1)ncnc2N1C[C@@H]2C[N@H+](Cc3nccs3)C[C@@H]2C1 ZINC001164786350 721420391 /nfs/dbraw/zinc/42/03/91/721420391.db2.gz OVKOFKMSLLCOJY-HDICACEKSA-N 1 1 436.585 3.040 20 0 IGADMO CCOC(=O)c1ccc2nc(Cl)nc(N3C[C@@H]4C[N@@H+](Cc5nccs5)C[C@@H]4C3)c2c1 ZINC001164783534 721423683 /nfs/dbraw/zinc/42/36/83/721423683.db2.gz IYDOCCZHSWPNJH-GASCZTMLSA-N 1 1 443.960 3.485 20 0 IGADMO CCOC(=O)c1ccc2nc(Cl)nc(N3C[C@@H]4C[N@H+](Cc5nccs5)C[C@@H]4C3)c2c1 ZINC001164783534 721423686 /nfs/dbraw/zinc/42/36/86/721423686.db2.gz IYDOCCZHSWPNJH-GASCZTMLSA-N 1 1 443.960 3.485 20 0 IGADMO CC(C)n1ccc2c1nc(Cl)nc2N1CC[C@]2(C1)CCC[C@@H](CN1CC[NH+](C)CC1)O2 ZINC001164891505 721430277 /nfs/dbraw/zinc/43/02/77/721430277.db2.gz GTPINMJMFKOFDK-MBSDFSHPSA-N 1 1 447.027 3.431 20 0 IGADMO COc1ccc(CN(C)c2ccnc(N3C[C@@H]4C[NH+](Cc5nccs5)C[C@H]4C3)n2)cc1 ZINC001164783468 721434785 /nfs/dbraw/zinc/43/47/85/721434785.db2.gz IQQHPAMHQHVFBJ-OALUTQOASA-N 1 1 436.585 3.146 20 0 IGADMO FC(F)(Cc1nc2c(ncnc2Cl)s1)N1C[C@H]2C[NH+](Cc3nccs3)C[C@@H]2C1 ZINC001164784850 721439971 /nfs/dbraw/zinc/43/99/71/721439971.db2.gz QYQADHSFZMQORC-GHMZBOCLSA-N 1 1 442.948 3.395 20 0 IGADMO Cc1cc(N2CC[C@]3(C2)CCC[C@H](CN2CC[NH+](C)CC2)O3)nc(-c2cccs2)n1 ZINC001164899513 721440904 /nfs/dbraw/zinc/44/09/04/721440904.db2.gz YSNJLXWGWJSVJX-XXBNENTESA-N 1 1 427.618 3.279 20 0 IGADMO C[NH+]1CCN(C[C@H]2CCC[C@@]3(CCN(c4nnc(Cl)c5ccc(F)cc54)C3)O2)CC1 ZINC001164899775 721443412 /nfs/dbraw/zinc/44/34/12/721443412.db2.gz YYYYHYSJIHJOBQ-VGSWGCGISA-N 1 1 433.959 3.188 20 0 IGADMO CCc1nc(Cl)nc(Cl)c1N1CC[C@]2(C1)CCC[C@H](CN1CC[NH+](C)CC1)O2 ZINC001164888488 721450468 /nfs/dbraw/zinc/45/04/68/721450468.db2.gz MPEKBBNRNDEVGF-QRWLVFNGSA-N 1 1 428.408 3.111 20 0 IGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(C(F)(F)c1nccc(Cl)n1)CC2 ZINC001164783239 721452461 /nfs/dbraw/zinc/45/24/61/721452461.db2.gz AQNIVTMKQGLETF-QGZVFWFLSA-N 1 1 444.954 3.409 20 0 IGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1nc3ccccc3nc1OC)CC2 ZINC001164783537 721454795 /nfs/dbraw/zinc/45/47/95/721454795.db2.gz CGPXHBNRELYOCF-FQEVSTJZSA-N 1 1 440.588 3.372 20 0 IGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1nc(C)nc(Cl)c1OC)CC2 ZINC001164788644 721459474 /nfs/dbraw/zinc/45/94/74/721459474.db2.gz VBNNKBGGWGHLFX-SFHVURJKSA-N 1 1 439.000 3.181 20 0 IGADMO c1cnn(C[C@@H]2Cn3ccnc3CN(c3ccc4c(n3)CC[N@H+](Cc3ccccc3)C4)C2)c1 ZINC001164893838 721486416 /nfs/dbraw/zinc/48/64/16/721486416.db2.gz DNSVBLHDLQLYMA-JOCHJYFZSA-N 1 1 439.567 3.370 20 0 IGADMO O=C(NCc1ccccc1)c1cccnc1N1CC[N@H+]2C[C@H](Oc3cccc(F)c3)C[C@H]2C1 ZINC001164899980 721515580 /nfs/dbraw/zinc/51/55/80/721515580.db2.gz MWROAUDICTVMCC-JTHBVZDNSA-N 1 1 446.526 3.493 20 0 IGADMO CCOC(=O)c1nc2ccccc2c(N2C[C@H]([N@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@@H]32)n1 ZINC001164811178 721531601 /nfs/dbraw/zinc/53/16/01/721531601.db2.gz ZFOIWVLOUPMTAQ-FDFHNCONSA-N 1 1 447.539 3.070 20 0 IGADMO CCOC(=O)c1nc2ccccc2c(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@@H]32)n1 ZINC001164811178 721531602 /nfs/dbraw/zinc/53/16/02/721531602.db2.gz ZFOIWVLOUPMTAQ-FDFHNCONSA-N 1 1 447.539 3.070 20 0 IGADMO CCOC(=O)c1ccc2ncnc(N3CC[N@H+]4C[C@H](Oc5cccc(F)c5)C[C@H]4C3)c2c1 ZINC001164912056 721533882 /nfs/dbraw/zinc/53/38/82/721533882.db2.gz YMJHTHDGYPJDGZ-AZUAARDMSA-N 1 1 436.487 3.288 20 0 IGADMO COc1cc2nc(C)nc(N3CC[N@H+]4C[C@@H](Oc5cccc(F)c5)C[C@@H]4C3)c2cc1OC ZINC001164910343 721534900 /nfs/dbraw/zinc/53/49/00/721534900.db2.gz UJCVGGROCRGKCO-MJGOQNOKSA-N 1 1 438.503 3.436 20 0 IGADMO COC(=O)c1ccc2ccnc(N3C[C@H]([N@@H+](C)Cc4cccnc4)[C@H]4OCCC[C@H]43)c2c1 ZINC001164806615 721547469 /nfs/dbraw/zinc/54/74/69/721547469.db2.gz PGFIXVKIHXQOGR-VJBWXMMDSA-N 1 1 432.524 3.285 20 0 IGADMO CCOC(=O)c1ccc2ncnc(N3C[C@H]([N@H+](C)Cc4cccnc4)[C@@H]4OCCC[C@H]43)c2c1 ZINC001164805721 721554810 /nfs/dbraw/zinc/55/48/10/721554810.db2.gz OOYYFZHMUJZOEX-XPWALMASSA-N 1 1 447.539 3.070 20 0 IGADMO CCOC(=O)c1ccc2ncnc(N3C[C@H]([N@@H+](C)Cc4cccnc4)[C@@H]4OCCC[C@H]43)c2c1 ZINC001164805721 721554812 /nfs/dbraw/zinc/55/48/12/721554812.db2.gz OOYYFZHMUJZOEX-XPWALMASSA-N 1 1 447.539 3.070 20 0 IGADMO COc1cc(C(F)(F)N2CC[N@H+]3C[C@H](Oc4cccc(F)c4)C[C@H]3C2)nc(Cl)n1 ZINC001164908038 721566949 /nfs/dbraw/zinc/56/69/49/721566949.db2.gz PKKGLZFGBHZUMN-DZGCQCFKSA-N 1 1 428.842 3.165 20 0 IGADMO CCOC(=O)c1cc2ccc(N3C[C@H]([N@@H+](C)Cc4cccnc4)[C@@H]4OCCC[C@H]43)[nH]c-2n1 ZINC001164798131 721567346 /nfs/dbraw/zinc/56/73/46/721567346.db2.gz AIMXKWAUHHFEFM-RZUBCFFCSA-N 1 1 435.528 3.003 20 0 IGADMO CCOC(=O)c1cc2ccc(N3C[C@H]([N@H+](C)Cc4cccnc4)[C@@H]4OCCC[C@H]43)nc2[nH]1 ZINC001164798131 721567354 /nfs/dbraw/zinc/56/73/54/721567354.db2.gz AIMXKWAUHHFEFM-RZUBCFFCSA-N 1 1 435.528 3.003 20 0 IGADMO CCOC(=O)c1cc2ccc(N3C[C@H]([N@@H+](C)Cc4cccnc4)[C@@H]4OCCC[C@H]43)nc2[nH]1 ZINC001164798131 721567359 /nfs/dbraw/zinc/56/73/59/721567359.db2.gz AIMXKWAUHHFEFM-RZUBCFFCSA-N 1 1 435.528 3.003 20 0 IGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2ncnc3c2ncn3-c2ccccc2)[C@H]2CCCO[C@@H]12 ZINC001164799367 721587065 /nfs/dbraw/zinc/58/70/65/721587065.db2.gz AZNKUYQHPUAKAQ-QZNHQXDQSA-N 1 1 441.539 3.079 20 0 IGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2ncnc3c2ncn3-c2ccccc2)[C@H]2CCCO[C@@H]12 ZINC001164799367 721587068 /nfs/dbraw/zinc/58/70/68/721587068.db2.gz AZNKUYQHPUAKAQ-QZNHQXDQSA-N 1 1 441.539 3.079 20 0 IGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2nc(Cl)cc(-c3ccncc3)n2)[C@@H]2CCCO[C@H]21 ZINC001164802586 721589440 /nfs/dbraw/zinc/58/94/40/721589440.db2.gz GXMYOWHKODPVCN-KCZVDYSFSA-N 1 1 436.947 3.455 20 0 IGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2nc(Cl)cc(-c3ccncc3)n2)[C@@H]2CCCO[C@H]21 ZINC001164802586 721589442 /nfs/dbraw/zinc/58/94/42/721589442.db2.gz GXMYOWHKODPVCN-KCZVDYSFSA-N 1 1 436.947 3.455 20 0 IGADMO CCCSc1ncnc(N2C[C@H]([N@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@H]32)c1OC ZINC001164810811 721590369 /nfs/dbraw/zinc/59/03/69/721590369.db2.gz WGKVDRDBXXESOX-CEXWTWQISA-N 1 1 429.590 3.251 20 0 IGADMO CCCSc1ncnc(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@H]32)c1OC ZINC001164810811 721590372 /nfs/dbraw/zinc/59/03/72/721590372.db2.gz WGKVDRDBXXESOX-CEXWTWQISA-N 1 1 429.590 3.251 20 0 IGADMO COC(=O)c1c[nH]c2nc(N3CCC(F)(F)[C@@]4(CC[N@@H+](Cc5ccccn5)C4)C3)ccc12 ZINC001164904885 721696267 /nfs/dbraw/zinc/69/62/67/721696267.db2.gz HNDYSMCQDNYLBQ-JOCHJYFZSA-N 1 1 441.482 3.482 20 0 IGADMO COC(=O)c1cc(F)c(C)nc1N1CCC(F)(F)[C@]2(CC[N@@H+](Cc3ccccn3)C2)C1 ZINC001164905675 721705596 /nfs/dbraw/zinc/70/55/96/721705596.db2.gz IJCFBHSRZALZMP-NRFANRHFSA-N 1 1 434.462 3.448 20 0 IGADMO Cn1c(=O)ccc2ccc(N3CCC(F)(F)[C@]4(CC[N@@H+](Cc5ccccn5)C4)C3)nc21 ZINC001164907380 721706767 /nfs/dbraw/zinc/70/67/67/721706767.db2.gz RHVDDPJNXQUQSB-QFIPXVFZSA-N 1 1 425.483 3.066 20 0 IGADMO Cc1cccc2nc(Cl)nc(N3CCO[C@]4(C3)COCC[N@H+](Cc3cccnc3)C4)c12 ZINC001164914090 721790458 /nfs/dbraw/zinc/79/04/58/721790458.db2.gz BJBZSYQVLFVCDI-HSZRJFAPSA-N 1 1 439.947 3.094 20 0 IGADMO Cc1cccc2nc(Cl)nc(N3CCO[C@]4(C3)COCC[N@@H+](Cc3cccnc3)C4)c12 ZINC001164914090 721790461 /nfs/dbraw/zinc/79/04/61/721790461.db2.gz BJBZSYQVLFVCDI-HSZRJFAPSA-N 1 1 439.947 3.094 20 0 IGADMO C[NH+]1CCC(Oc2ccnc(N3CCC(F)(F)[C@]4(CCN(c5cnccn5)C4)C3)c2)CC1 ZINC001164915338 721802994 /nfs/dbraw/zinc/80/29/94/721802994.db2.gz ITPXBUGQXCPYQG-JOCHJYFZSA-N 1 1 444.530 3.087 20 0 IGADMO CCOC(=O)c1c[n-]c2nc[nH+]c(N3C[C@@H]4CCC[C@@H]([N@@H+](C)Cc5ccccn5)[C@@H]4C3)c12 ZINC001165024608 721805907 /nfs/dbraw/zinc/80/59/07/721805907.db2.gz MJOUEQHRNBVCJP-PWIZWCRZSA-N 1 1 434.544 3.267 20 0 IGADMO CCOC(=O)c1c[nH]c2ncnc(N3C[C@@H]4CCC[C@@H]([N@H+](C)Cc5ccccn5)[C@@H]4C3)c12 ZINC001165024608 721805911 /nfs/dbraw/zinc/80/59/11/721805911.db2.gz MJOUEQHRNBVCJP-PWIZWCRZSA-N 1 1 434.544 3.267 20 0 IGADMO CCOC(=O)c1c[nH]c2ncnc(N3C[C@@H]4CCC[C@@H]([N@@H+](C)Cc5ccccn5)[C@@H]4C3)c12 ZINC001165024608 721805912 /nfs/dbraw/zinc/80/59/12/721805912.db2.gz MJOUEQHRNBVCJP-PWIZWCRZSA-N 1 1 434.544 3.267 20 0 IGADMO C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@@H]2CN(c3c(Cl)nc(Cl)nc3C(N)=O)C[C@H]21 ZINC001165025233 721815323 /nfs/dbraw/zinc/81/53/23/721815323.db2.gz MAYKWRQJVYOVBP-BPLDGKMQSA-N 1 1 435.359 3.014 20 0 IGADMO Cc1cnc2n1CCN(C)C21CCN(c2[nH+]cnc3c2ccn3Cc2ccccc2)CC1 ZINC001164918384 721816783 /nfs/dbraw/zinc/81/67/83/721816783.db2.gz VLOGSFMRLGBUTP-UHFFFAOYSA-N 1 1 427.556 3.426 20 0 IGADMO COc1cc(N2CCO[C@@]3(C2)COCCN(Cc2csc(C)n2)C3)[nH+]c2ccccc21 ZINC001164921176 721830467 /nfs/dbraw/zinc/83/04/67/721830467.db2.gz IRKNCHSPYYVWKL-QHCPKHFHSA-N 1 1 440.569 3.116 20 0 IGADMO O=C(C[C@@H]1OC[C@H]2CN(c3nc(Cl)ccc3C[NH+]3CCCC3)CC[C@H]21)NC1CCC1 ZINC001164932766 721896615 /nfs/dbraw/zinc/89/66/15/721896615.db2.gz IEGVWZGCZYXVJG-RLLQIKCJSA-N 1 1 432.996 3.231 20 0 IGADMO CC[N@H+]1CCCC[C@H]1c1ccc(N2CCC3(CC2)COCCN3Cc2ccn(C)n2)nc1 ZINC001164935967 721909793 /nfs/dbraw/zinc/90/97/93/721909793.db2.gz QHZHCLNEVLATCM-QHCPKHFHSA-N 1 1 438.620 3.233 20 0 IGADMO Cc1nc2sc3c(c2c(N2CCC4(CC2)C(=O)NCC[N@H+]4Cc2ccccc2)n1)CCC3 ZINC001164946935 721978318 /nfs/dbraw/zinc/97/83/18/721978318.db2.gz MHTVCRBCHQHVGM-UHFFFAOYSA-N 1 1 447.608 3.459 20 0 IGADMO Cc1nc2sc3c(c2c(N2CCC4(CC2)C(=O)NCC[N@@H+]4Cc2ccccc2)n1)CCC3 ZINC001164946935 721978322 /nfs/dbraw/zinc/97/83/22/721978322.db2.gz MHTVCRBCHQHVGM-UHFFFAOYSA-N 1 1 447.608 3.459 20 0 IGADMO Cc1nc(Cn2c(=O)ccc3c2CCN(c2ccc(C[N@H+](C)C4CC4)cn2)CC3)cs1 ZINC001164950723 722007477 /nfs/dbraw/zinc/00/74/77/722007477.db2.gz FSPOVHUKVJZMAR-UHFFFAOYSA-N 1 1 435.597 3.256 20 0 IGADMO O=C(NCc1ccccc1)c1cc(Cl)nc(N2CC[NH+](CCc3ccccn3)CC2)c1 ZINC001165053246 722010023 /nfs/dbraw/zinc/01/00/23/722010023.db2.gz CQSVDXAPBAFXCU-UHFFFAOYSA-N 1 1 435.959 3.425 20 0 IGADMO COC(=O)c1c(Cl)cnc(N2CCC3(CC[N@@H+](Cc4cccnc4)C3)CC2)c1OC ZINC001164956107 722020534 /nfs/dbraw/zinc/02/05/34/722020534.db2.gz WLRGDMJLSWTBMP-UHFFFAOYSA-N 1 1 430.936 3.418 20 0 IGADMO CCOC(=O)[C@H]1CCc2nnc(N3CCC4(CC[N@@H+](Cc5cccnc5)C4)CC3)cc2C1 ZINC001164963337 722025056 /nfs/dbraw/zinc/02/50/56/722025056.db2.gz SJLDNCYNLZWGIC-FQEVSTJZSA-N 1 1 435.572 3.032 20 0 IGADMO CC(C)C(=O)N[C@@H]1[C@H]2CN(c3nc(C[NH+]4CCCC4)nc4sc5c(c43)CCCC5)C[C@H]21 ZINC001164958434 722039667 /nfs/dbraw/zinc/03/96/67/722039667.db2.gz DFOGVCMNCWPGRN-LFUKPOHLSA-N 1 1 439.629 3.373 20 0 IGADMO FC(F)(c1cnc(Cl)nc1Cl)N1CC[C@@H]2C[N@@H+](Cc3cccnc3)CCO[C@@H]2C1 ZINC001164986392 722100990 /nfs/dbraw/zinc/10/09/90/722100990.db2.gz YXVROGVEOCTUSO-GDBMZVCRSA-N 1 1 444.313 3.451 20 0 IGADMO FC(F)(c1nc(Cl)ncc1Cl)N1CC[C@H]2C[N@@H+](Cc3cccnc3)CCO[C@H]2C1 ZINC001164983883 722106885 /nfs/dbraw/zinc/10/68/85/722106885.db2.gz QVPICWBEIXZBQV-HOCLYGCPSA-N 1 1 444.313 3.451 20 0 IGADMO COc1ccc2nc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)c(Cl)nc2c1 ZINC001164975700 722111347 /nfs/dbraw/zinc/11/13/47/722111347.db2.gz KKJBLZMXLCKAOP-DYESRHJHSA-N 1 1 439.947 3.414 20 0 IGADMO CSc1nc2c(c(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)n1)CCCC2 ZINC001164981846 722113399 /nfs/dbraw/zinc/11/33/99/722113399.db2.gz VIJOXCFJQBTWQP-RXVVDRJESA-N 1 1 425.602 3.200 20 0 IGADMO COc1ccc(C(F)(F)N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)c(Cl)n1 ZINC001164973886 722115222 /nfs/dbraw/zinc/11/52/22/722115222.db2.gz HVEKDBQXWGFKSO-AEFFLSMTSA-N 1 1 438.906 3.411 20 0 IGADMO Clc1ccc(CN2CCCC2)c(N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)n1 ZINC001164983727 722125165 /nfs/dbraw/zinc/12/51/65/722125165.db2.gz ZIJYEQICOVAYQT-IFMALSPDSA-N 1 1 442.007 3.453 20 0 IGADMO c1ccc(COc2cnnc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)c2)cc1 ZINC001164982673 722125956 /nfs/dbraw/zinc/12/59/56/722125956.db2.gz XREBYSKMEQQDAP-UPVQGACJSA-N 1 1 431.540 3.178 20 0 IGADMO FC(F)(COc1cccc(Cl)n1)N1CC[C@H]2C[N@@H+](Cc3cccnc3)CCO[C@H]2C1 ZINC001164983079 722128362 /nfs/dbraw/zinc/12/83/62/722128362.db2.gz YAQCVSMLGBUYHE-ROUUACIJSA-N 1 1 438.906 3.325 20 0 IGADMO COC(=O)c1ccc2cc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)ncc2c1 ZINC001164984600 722137185 /nfs/dbraw/zinc/13/71/85/722137185.db2.gz XNLBGVYARAMAHL-GGAORHGYSA-N 1 1 432.524 3.144 20 0 IGADMO COc1cccc(-c2ccc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)nn2)c1 ZINC001164983311 722141451 /nfs/dbraw/zinc/14/14/51/722141451.db2.gz TYLBEAXEHZUASK-QPPBQGQZSA-N 1 1 431.540 3.275 20 0 IGADMO COc1ccc(-c2cc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)ncn2)cc1 ZINC001164975231 722145115 /nfs/dbraw/zinc/14/51/15/722145115.db2.gz GDGHMLCIXPJPPQ-QPPBQGQZSA-N 1 1 431.540 3.275 20 0 IGADMO COc1cc2nc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)ccc2c(OC)c1 ZINC001164977098 722153214 /nfs/dbraw/zinc/15/32/14/722153214.db2.gz WTGSGRYNXYZDEJ-YADARESESA-N 1 1 434.540 3.374 20 0 IGADMO COc1cc2nc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)ccc2c(OC)c1 ZINC001164976358 722153453 /nfs/dbraw/zinc/15/34/53/722153453.db2.gz WTGSGRYNXYZDEJ-CYFREDJKSA-N 1 1 434.540 3.374 20 0 IGADMO Fc1ccc2c(c1)[nH]c1ncnc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)c21 ZINC001164971059 722158036 /nfs/dbraw/zinc/15/80/36/722158036.db2.gz ACBHSUXZBADJME-UTKZUKDTSA-N 1 1 432.503 3.373 20 0 IGADMO CCc1cc(N2CCC[C@]3(CC[N@H+]3Cc3cccc(F)c3)C2)nc(N2CCOCC2)n1 ZINC001164996344 722204268 /nfs/dbraw/zinc/20/42/68/722204268.db2.gz UEIGOFBKUMQHBG-DEOSSOPVSA-N 1 1 425.552 3.260 20 0 IGADMO CC(C)NS(=O)(=O)c1ccc(N2CCC[C@]3(CC[N@H+]3Cc3cccc(F)c3)C2)nc1 ZINC001164994851 722207751 /nfs/dbraw/zinc/20/77/51/722207751.db2.gz ISFGHMUMYFYBSU-QFIPXVFZSA-N 1 1 432.565 3.152 20 0 IGADMO C[NH+]1CCN(c2ncnc3c2CCN(c2nc4c(Cl)cccc4nc2Cl)CC3)CC1 ZINC001165001244 722239716 /nfs/dbraw/zinc/23/97/16/722239716.db2.gz FPQQRULOABEVEJ-UHFFFAOYSA-N 1 1 444.370 3.084 20 0 IGADMO C[NH+]1CCN(c2ncnc3c2CCN(c2nc(Cl)cc4cccc(F)c42)CC3)CC1 ZINC001165006512 722240816 /nfs/dbraw/zinc/24/08/16/722240816.db2.gz ZDLIJORMKJFBPB-UHFFFAOYSA-N 1 1 426.927 3.174 20 0 IGADMO CC(C)C[C@@H](CNC(=O)c1cn(-c2ccccc2)nc1-c1cccnc1)[NH+]1CCOCC1 ZINC000022898115 519213278 /nfs/dbraw/zinc/21/32/78/519213278.db2.gz NGBQWQUZPOYNJY-QFIPXVFZSA-N 1 1 433.556 3.411 20 0 IGADMO O=C1NCCc2[nH]c(-c3ccnc(N4CCC[C@H]5C[N@@H+](Cc6ccccc6)C[C@@H]54)c3)cc21 ZINC001164619927 719075818 /nfs/dbraw/zinc/07/58/18/719075818.db2.gz DCVZYTYUPBXMLZ-RDPSFJRHSA-N 1 1 427.552 3.463 20 0 IGADMO COC(=O)c1c[nH]c2nc(Cl)nc(N3CCC[C@H]4C[N@@H+](Cc5ccccc5)C[C@@H]43)c12 ZINC001164631429 719095661 /nfs/dbraw/zinc/09/56/61/719095661.db2.gz YBPGWEWYMUXGOE-RDJZCZTQSA-N 1 1 425.920 3.499 20 0 IGADMO COCCN1CC[N@H+](C)C2(CCN(c3nc(-c4ccccc4)nc4ccccc43)CC2)C1=O ZINC001164632805 719272771 /nfs/dbraw/zinc/27/27/71/719272771.db2.gz CUZKUOKLGZYMIQ-UHFFFAOYSA-N 1 1 445.567 3.056 20 0 IGADMO COCCN1CC[N@@H+](C)C2(CCN(c3nc(-c4ccccc4)nc4ccccc43)CC2)C1=O ZINC001164632805 719272776 /nfs/dbraw/zinc/27/27/76/719272776.db2.gz CUZKUOKLGZYMIQ-UHFFFAOYSA-N 1 1 445.567 3.056 20 0 IGADMO O=C(CC1CC1)N[C@@H]1CN(c2nc(Cl)ccc2C[NH+]2CCCC2)C[C@@H]2CCCO[C@H]12 ZINC001164656616 719325183 /nfs/dbraw/zinc/32/51/83/719325183.db2.gz YRBVJLFPPVNLHD-KPLVRAHFSA-N 1 1 432.996 3.231 20 0 IGADMO CCN(CC)C(=O)c1nc2c(s1)CCN(c1cc(OC3CC[NH+](C)CC3)ccn1)CC2 ZINC001164663000 719360013 /nfs/dbraw/zinc/36/00/13/719360013.db2.gz BPIXILDQWWOPAO-UHFFFAOYSA-N 1 1 443.617 3.098 20 0 IGADMO CCOC[C@H]1CN(c2cc(OC3CC[NH+](C)CC3)ccn2)Cc2nn(CC3CC3)cc21 ZINC001164663242 719364100 /nfs/dbraw/zinc/36/41/00/719364100.db2.gz IHKGCQXWYPWFRA-LJQANCHMSA-N 1 1 425.577 3.301 20 0 IGADMO C[C@@H]1CCc2c(sc3nc(CN4CCCCC4)nc(N4C[C@@H]5[C@H](C4)OCC[N@H+]5C)c23)C1 ZINC001164667893 719443485 /nfs/dbraw/zinc/44/34/85/719443485.db2.gz IEABGVWDSJKXAJ-QRQLOZEOSA-N 1 1 441.645 3.321 20 0 IGADMO COC(=O)c1cc2c[nH]c(N3CCC4(CC3)COCC[N@@H+]4Cc3ccc(F)cc3)cc-2n1 ZINC001164671657 719520388 /nfs/dbraw/zinc/52/03/88/719520388.db2.gz GWRJSWWRZVTAMY-UHFFFAOYSA-N 1 1 438.503 3.360 20 0 IGADMO COC(=O)c1cc2c[nH]c(N3CCC4(CC3)COCC[N@H+]4Cc3ccc(F)cc3)cc-2n1 ZINC001164671657 719520390 /nfs/dbraw/zinc/52/03/90/719520390.db2.gz GWRJSWWRZVTAMY-UHFFFAOYSA-N 1 1 438.503 3.360 20 0 IGADMO COC(=O)[C@]1(C)C[C@@H]([NH+]2CCOCC2)CCN1c1nc(Cl)cc2cc(OC)ccc21 ZINC001164700115 719861751 /nfs/dbraw/zinc/86/17/51/719861751.db2.gz GMOIHOABHPSTGG-AOMKIAJQSA-N 1 1 433.936 3.130 20 0 IGADMO COC(=O)[C@@]1(C)C[C@@H]([NH+]2CCOCC2)CCN1c1ncc(Cl)nc1-c1ccccc1 ZINC001164701675 719871989 /nfs/dbraw/zinc/87/19/89/719871989.db2.gz GQFSAZCXFCUPOL-HTAPYJJXSA-N 1 1 430.936 3.030 20 0 IGADMO CCOC(=O)c1cnc(Cl)nc1N1CCC2(CC1)C[N@H+](Cc1cccs1)CCO2 ZINC001164704387 719887036 /nfs/dbraw/zinc/88/70/36/719887036.db2.gz WMAZUOHBCOLINT-UHFFFAOYSA-N 1 1 436.965 3.240 20 0 IGADMO CCOC(=O)c1cnc(Cl)nc1N1CCC2(CC1)C[N@@H+](Cc1cccs1)CCO2 ZINC001164704387 719887037 /nfs/dbraw/zinc/88/70/37/719887037.db2.gz WMAZUOHBCOLINT-UHFFFAOYSA-N 1 1 436.965 3.240 20 0 IGADMO FC(F)(Oc1cnc(Cl)cn1)N1CCC2(CC1)C[N@@H+](Cc1cccs1)CCO2 ZINC001164706958 719908836 /nfs/dbraw/zinc/90/88/36/719908836.db2.gz MDNMSWIFKAMJCK-UHFFFAOYSA-N 1 1 430.908 3.488 20 0 IGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(C(F)(F)c1cnc(Cl)c(C(=O)OC)c1)C2 ZINC001164809257 720096755 /nfs/dbraw/zinc/09/67/55/720096755.db2.gz IZPBYZXUIAURQY-OXQOHEQNSA-N 1 1 443.922 3.251 20 0 IGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(C(F)(F)c1cc(C(=O)OC)cc(Cl)n1)C2 ZINC001164810454 720127347 /nfs/dbraw/zinc/12/73/47/720127347.db2.gz JWIBJRCKIAUNIR-OXQOHEQNSA-N 1 1 443.922 3.251 20 0 IGADMO CCCNC(=O)c1cccnc1N1CCC2(C[C@H](COC)[N@@H+](Cc3ccccn3)C2)CC1 ZINC001164713080 720141666 /nfs/dbraw/zinc/14/16/66/720141666.db2.gz QFOWNAQYRFEGCZ-OAQYLSRUSA-N 1 1 437.588 3.124 20 0 IGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1cc([C@@H](CC(=O)OC)C3CC3)ccn1)C2 ZINC001164817888 720158446 /nfs/dbraw/zinc/15/84/46/720158446.db2.gz QQYPQMRSSNGWGR-HWBMXIPRSA-N 1 1 427.589 3.323 20 0 IGADMO CC(C)[N@@H+](C)Cc1cc(=O)n2c(n1)CN(C(F)(F)c1cnc(Cl)nc1Cl)CCC2 ZINC001164815291 720211219 /nfs/dbraw/zinc/21/12/19/720211219.db2.gz YIMQDBHJXKIMNZ-UHFFFAOYSA-N 1 1 447.317 3.136 20 0 IGADMO CC(C)[N@@H+](C)Cc1cc(=O)n2c(n1)CN(c1nc(Cl)nc3cccc(F)c31)CCC2 ZINC001164811912 720218865 /nfs/dbraw/zinc/21/88/65/720218865.db2.gz AHCGJEFEEPHXRY-UHFFFAOYSA-N 1 1 430.915 3.230 20 0 IGADMO COc1ccc2nc(N3CCCn4c(=O)cc(C[N@@H+](C)C(C)C)nc4C3)c(Cl)nc2c1 ZINC001164814723 720218974 /nfs/dbraw/zinc/21/89/74/720218974.db2.gz WSHQAAIDRFCZNH-UHFFFAOYSA-N 1 1 442.951 3.099 20 0 IGADMO COc1ccc(C(F)(F)N2CCCn3c(=O)cc(C[N@@H+](C)C(C)C)nc3C2)c(Cl)n1 ZINC001164814918 720221643 /nfs/dbraw/zinc/22/16/43/720221643.db2.gz ZYCMDJHHBQTTAV-UHFFFAOYSA-N 1 1 441.910 3.096 20 0 IGADMO Cc1nc2c3ccccc3oc2c(N2CCCn3c(=O)cc(C[N@H+](C)C(C)C)nc3C2)n1 ZINC001164814500 720229665 /nfs/dbraw/zinc/22/96/65/720229665.db2.gz VWLCSIKLGVCULV-UHFFFAOYSA-N 1 1 432.528 3.492 20 0 IGADMO CC(C)[N@@H+](C)Cc1cc(=O)n2c(n1)CN(c1nc3ccccc3nc1N1CCCC1)CCC2 ZINC001164812044 720233938 /nfs/dbraw/zinc/23/39/38/720233938.db2.gz AUYJIDMSLVBKRK-UHFFFAOYSA-N 1 1 447.587 3.037 20 0 IGADMO CCOC(=O)c1cc(Cl)nc(N2CC[C@@H]3[C@H](C[C@H](Cn4cccn4)[N@H+]3C(C)C)C2)c1 ZINC001164840040 720505987 /nfs/dbraw/zinc/50/59/87/720505987.db2.gz WBRYESHDBNANHX-GUDVDZBRSA-N 1 1 431.968 3.486 20 0 IGADMO COc1cc2ncnc(N3CC[C@@H]4[C@H](C[C@H](Cn5cccn5)[N@H+]4C(C)C)C3)c2cc1OC ZINC001164834880 720519790 /nfs/dbraw/zinc/51/97/90/720519790.db2.gz HUFMULYFRVXVLH-DBXWQHBBSA-N 1 1 436.560 3.221 20 0 IGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@@H]2CN(c3nc(Cl)nc4c3COC4(C)C)CC[C@@H]21 ZINC001164836048 720525060 /nfs/dbraw/zinc/52/50/60/720525060.db2.gz LXLRUTYMMFFLGV-RYRKJORJSA-N 1 1 430.984 3.470 20 0 IGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@H]2CN(c3ccnc(NC(=O)OC(C)(C)C)n3)CC[C@@H]21 ZINC001164838465 720527989 /nfs/dbraw/zinc/52/79/89/720527989.db2.gz RHZJSMIPJOCKGX-FHWLQOOXSA-N 1 1 441.580 3.398 20 0 IGADMO CCOC(=O)c1cc2cccnc2nc1N1CC[C@@H]2[C@H](C[C@@H](Cn3cccn3)[N@H+]2C(C)C)C1 ZINC001164835056 720542710 /nfs/dbraw/zinc/54/27/10/720542710.db2.gz GVEYJVJLZVWRDJ-RZUBCFFCSA-N 1 1 448.571 3.381 20 0 IGADMO CSc1nc2ncnc(N3CC[C@@H]4[C@@H](C[C@H](Cn5cccn5)[N@H+]4C(C)C)C3)c2s1 ZINC001164835462 720572554 /nfs/dbraw/zinc/57/25/54/720572554.db2.gz HJNUQCGFQLUVCX-ARFHVFGLSA-N 1 1 429.619 3.383 20 0 IGADMO CSc1nc2ncnc(N3CC[C@@H]4[C@H](C[C@@H](Cn5cccn5)[N@H+]4C(C)C)C3)c2s1 ZINC001164835470 720573101 /nfs/dbraw/zinc/57/31/01/720573101.db2.gz HJNUQCGFQLUVCX-OWCLPIDISA-N 1 1 429.619 3.383 20 0 IGADMO CC(C)[N@@H+]1[C@@H]2CCN(C(F)(F)Oc3cnc(Cl)cn3)C[C@@H]2C[C@H]1Cn1cccn1 ZINC001164842016 720648384 /nfs/dbraw/zinc/64/83/84/720648384.db2.gz RQBMZLWPDSKNMD-HRCADAONSA-N 1 1 426.899 3.129 20 0 IGADMO COC(=O)c1cc(Cl)nc(N2CCC3(C[C@H]([N@@H+](C)Cc4ccccc4)CO3)CC2)n1 ZINC001164838853 720662784 /nfs/dbraw/zinc/66/27/84/720662784.db2.gz IBPHISFFRHJUKA-KRWDZBQOSA-N 1 1 430.936 3.177 20 0 IGADMO COC(=O)c1cnc(N2CCC3(C[C@@H]([N@@H+](C)Cc4ccccc4)CO3)CC2)cc1OC ZINC001164843762 720667436 /nfs/dbraw/zinc/66/74/36/720667436.db2.gz XRCALEUBBRUJJD-LJQANCHMSA-N 1 1 425.529 3.137 20 0 IGADMO C[N@@H+](Cc1ccccc1)[C@@H]1COC2(C1)CCN(c1ccc(C(=O)NC3CCCC3)nn1)CC2 ZINC001164838200 720718342 /nfs/dbraw/zinc/71/83/42/720718342.db2.gz HDXSGBDGHANWDI-QFIPXVFZSA-N 1 1 449.599 3.409 20 0 IGADMO COC(=O)c1nc(Cl)cc(N2CCC3(C[C@@H]([N@@H+](C)Cc4ccccc4)CO3)CC2)n1 ZINC001164842353 720720896 /nfs/dbraw/zinc/72/08/96/720720896.db2.gz YSIGMCWHMRTCMS-QGZVFWFLSA-N 1 1 430.936 3.177 20 0 IGADMO CCS(=O)(=O)c1ccnc(N2CCC3(C[C@H]([N@@H+](C)Cc4ccccc4)CO3)CC2)c1 ZINC001164838937 720729061 /nfs/dbraw/zinc/72/90/61/720729061.db2.gz ZUMVXOFHYBEZFI-FQEVSTJZSA-N 1 1 429.586 3.135 20 0 IGADMO CCS(=O)(=O)c1ccnc(N2CCC3(C[C@@H]([N@@H+](C)Cc4ccccc4)CO3)CC2)c1 ZINC001164838939 720729234 /nfs/dbraw/zinc/72/92/34/720729234.db2.gz ZUMVXOFHYBEZFI-HXUWFJFHSA-N 1 1 429.586 3.135 20 0 IGADMO CSc1ccc(Oc2cc(N3CC[N@H+]4C[C@@H](Oc5cncnc5)C[C@@H]4C3)ncn2)cc1 ZINC001164739934 720743713 /nfs/dbraw/zinc/74/37/13/720743713.db2.gz JYSCNELEJSTIRX-AEFFLSMTSA-N 1 1 436.541 3.123 20 0 IGADMO Fc1c(Cl)nccc1C(F)(F)N1CC[C@@H]2[C@H](C[C@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164752725 720812003 /nfs/dbraw/zinc/81/20/03/720812003.db2.gz ZQHSLASGCGLTPO-BFYDXBDKSA-N 1 1 440.901 3.390 20 0 IGADMO c1ncn(C[C@H]2C[C@@H]3CN(c4cncc(OCc5ccccc5)n4)CC[C@H]3[N@@H+]2CC2CC2)n1 ZINC001164737686 720817338 /nfs/dbraw/zinc/81/73/38/720817338.db2.gz BYPVYJHAGLBHBE-DNVJHFABSA-N 1 1 445.571 3.027 20 0 IGADMO CCCN(CCC)c1cc(N2CC[C@@H]3[C@@H](C[C@H](Cn4cncn4)[N@H+]3CC3CC3)C2)ncn1 ZINC001164745144 720839173 /nfs/dbraw/zinc/83/91/73/720839173.db2.gz LPZCGPISDCCOBH-BHDDXSALSA-N 1 1 438.624 3.074 20 0 IGADMO Fc1cccc(Oc2cncc(N3CC[C@@H]4[C@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)n2)c1 ZINC001164743696 720839843 /nfs/dbraw/zinc/83/98/43/720839843.db2.gz JUCHSEASFJEGSJ-SYYKKAFVSA-N 1 1 449.534 3.379 20 0 IGADMO Fc1cc2ncnc(Cl)c2c(N2CC[C@@H]3[C@H](C[C@@H](Cn4cncn4)[N@H+]3CC3CC3)C2)c1 ZINC001164740030 720842294 /nfs/dbraw/zinc/84/22/94/720842294.db2.gz BOZOGJFDQOISBE-HHXXYDBFSA-N 1 1 441.942 3.393 20 0 IGADMO Fc1cc2ncnc(Cl)c2c(N2CC[C@@H]3[C@H](C[C@H](Cn4cncn4)[N@H+]3CC3CC3)C2)c1 ZINC001164740032 720842535 /nfs/dbraw/zinc/84/25/35/720842535.db2.gz BOZOGJFDQOISBE-SZVBFZGTSA-N 1 1 441.942 3.393 20 0 IGADMO CCc1cc2c(nc(Cl)nc2N2CC[C@@H]3[C@H](C[C@@H](Cn4cncn4)[N@H+]3CC3CC3)C2)[nH]1 ZINC001164747537 720842798 /nfs/dbraw/zinc/84/27/98/720842798.db2.gz REFRBANKHGUSLX-HHXXYDBFSA-N 1 1 440.983 3.145 20 0 IGADMO Fc1ccc(-c2cc(N3CC[C@@H]4[C@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)ncn2)cc1 ZINC001164745922 720850042 /nfs/dbraw/zinc/85/00/42/720850042.db2.gz OEGRYXYCTUGYGG-UNWVZKJWSA-N 1 1 433.535 3.254 20 0 IGADMO COCC[N@H+]1CCO[C@@H]2CN(C(F)(F)c3ccc4nc(Cl)cnc4c3)CC[C@H]2C1 ZINC001164853726 720851444 /nfs/dbraw/zinc/85/14/44/720851444.db2.gz OTALPLACKPLMPD-KBXCAEBGSA-N 1 1 426.895 3.002 20 0 IGADMO Fc1ccccc1-c1ccc(N2CC[C@@H]3[C@H](C[C@H](Cn4cncn4)[N@H+]3CC3CC3)C2)nn1 ZINC001164752667 720852151 /nfs/dbraw/zinc/85/21/51/720852151.db2.gz UEGMMYHALFWWDG-DNVFCKCGSA-N 1 1 433.535 3.254 20 0 IGADMO FC(F)(Oc1ccnc(Cl)c1)N1CC[C@@H]2[C@@H](C[C@@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164753902 720857291 /nfs/dbraw/zinc/85/72/91/720857291.db2.gz ZBDHCXBBKMZHEK-XYJFISCASA-N 1 1 438.910 3.131 20 0 IGADMO Fc1ccc2c(Cl)ncnc2c1N1CC[C@@H]2[C@@H](C[C@@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164746156 720860527 /nfs/dbraw/zinc/86/05/27/720860527.db2.gz GCODIIGMIWAUPX-TXPKVOOTSA-N 1 1 441.942 3.393 20 0 IGADMO COCC[N@H+]1CCO[C@@H]2CN(c3ncnc4c3c(C)c(C)n4Cc3ccccc3)CC[C@@H]2C1 ZINC001164858332 720875933 /nfs/dbraw/zinc/87/59/33/720875933.db2.gz KSIDLUKERCBJIO-DHIUTWEWSA-N 1 1 449.599 3.270 20 0 IGADMO COCC[N@H+]1CCO[C@H]2CN(C(F)(F)c3cc(-c4ccco4)nnc3Cl)CC[C@@H]2C1 ZINC001164860774 720877784 /nfs/dbraw/zinc/87/77/84/720877784.db2.gz PCPQHEOLAYVLCX-KDOFPFPSSA-N 1 1 442.894 3.108 20 0 IGADMO COCC[N@H+]1CCO[C@H]2CN(C(F)(F)c3cc(-c4ccco4)nnc3Cl)CC[C@H]2C1 ZINC001164860782 720877927 /nfs/dbraw/zinc/87/79/27/720877927.db2.gz PCPQHEOLAYVLCX-KSSFIOAISA-N 1 1 442.894 3.108 20 0 IGADMO COCc1cc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COCc2cccnc2)nc(C)n1 ZINC001164758820 720885350 /nfs/dbraw/zinc/88/53/50/720885350.db2.gz ZQQRSYAHHSGSOS-RDGATRHJSA-N 1 1 437.588 3.082 20 0 IGADMO COCC[N@H+]1CCO[C@H]2CN(c3nc(C(F)F)nc4ccc(Cl)cc43)CC[C@H]2C1 ZINC001164860821 720886074 /nfs/dbraw/zinc/88/60/74/720886074.db2.gz PEOORESARNYKGB-GUYCJALGSA-N 1 1 426.895 3.394 20 0 IGADMO COCC[N@H+]1CCO[C@H]2CN(c3cnc(Cl)nc3Oc3cccc(C)c3)CC[C@H]2C1 ZINC001164865087 720888672 /nfs/dbraw/zinc/88/86/72/720888672.db2.gz YERVUBFAMHEJGU-PXNSSMCTSA-N 1 1 432.952 3.404 20 0 IGADMO COCC[N@H+]1CCO[C@@H]2CN(c3cnc(Cl)nc3Oc3ccc(OC)cc3)CC[C@H]2C1 ZINC001164864817 720889432 /nfs/dbraw/zinc/88/94/32/720889432.db2.gz XLHSRCQGJUKGAM-OXJNMPFZSA-N 1 1 448.951 3.104 20 0 IGADMO Cc1cc2ncnc(N3CC[C@@]4(C3)C[N@@H+](CC3CC3)C[C@@H]4COCc3cccnc3)c2[nH]1 ZINC001164752522 720895241 /nfs/dbraw/zinc/89/52/41/720895241.db2.gz DWXMSMYUTQWUSC-BWKNWUBXSA-N 1 1 432.572 3.416 20 0 IGADMO CC(C)Oc1cncc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COCc2cccnc2)n1 ZINC001164752812 720914366 /nfs/dbraw/zinc/91/43/66/720914366.db2.gz OZKYYUCDCWJDRZ-RCZVLFRGSA-N 1 1 437.588 3.414 20 0 IGADMO CSc1nc(Cl)cc(C(F)(F)N2CC[N@H+]3C[C@@H](OCc4cccnc4)C[C@@H]3C2)n1 ZINC001164866590 721051528 /nfs/dbraw/zinc/05/15/28/721051528.db2.gz FSYAPHDINUKXQX-CABCVRRESA-N 1 1 441.935 3.272 20 0 IGADMO COCc1cc(N2CC[N@H+]3C[C@@H](OCc4cccnc4)C[C@H]3C2)nc(-c2ccccc2)n1 ZINC001164865856 721051741 /nfs/dbraw/zinc/05/17/41/721051741.db2.gz APVCQYMHTWBYLB-GOTSBHOMSA-N 1 1 431.540 3.165 20 0 IGADMO CCOC(=O)c1c(C)nc(Cl)cc1N1CC[N@H+]2C[C@H](OCc3cccnc3)C[C@H]2C1 ZINC001164871545 721071486 /nfs/dbraw/zinc/07/14/86/721071486.db2.gz ZNWRAUKWXMVPPL-ZWKOTPCHSA-N 1 1 430.936 3.095 20 0 IGADMO CCOC(=O)c1c(C)nc(Cl)cc1N1CC[N@H+]2C[C@H](OCc3cccnc3)C[C@@H]2C1 ZINC001164871541 721071748 /nfs/dbraw/zinc/07/17/48/721071748.db2.gz ZNWRAUKWXMVPPL-QZTJIDSGSA-N 1 1 430.936 3.095 20 0 IGADMO CSc1nc(Cl)cc(C(F)(F)N2C[C@@H]3CC[N@@H+](Cc4cnn(C)c4)C[C@H]3C2)n1 ZINC001164767388 721081904 /nfs/dbraw/zinc/08/19/04/721081904.db2.gz LPJXHAYWZWVAHU-KBPBESRZSA-N 1 1 428.940 3.089 20 0 IGADMO COc1cc2c(cc1Cl)ncnc2N1CC[N@H+]2C[C@H](OCc3cccnc3)C[C@@H]2C1 ZINC001164865915 721092116 /nfs/dbraw/zinc/09/21/16/721092116.db2.gz PRSZMDVZSPOPSN-IAGOWNOFSA-N 1 1 425.920 3.167 20 0 IGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4cc(C(=O)N5CCCCC5)cc(Cl)n4)C[C@H]3C2)cn1 ZINC001164774189 721093306 /nfs/dbraw/zinc/09/33/06/721093306.db2.gz YZHZJOSSHHHONI-UYAOXDASSA-N 1 1 442.995 3.053 20 0 IGADMO COc1ccc2nc(Cl)cc(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@H]4C3)c2n1 ZINC001164865178 721095558 /nfs/dbraw/zinc/09/55/58/721095558.db2.gz JKXSPCCIGPYUOI-DLBZAZTESA-N 1 1 425.920 3.167 20 0 IGADMO c1cn(Cc2ccccc2)c2ncnc(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@H]4C3)c12 ZINC001164866331 721098334 /nfs/dbraw/zinc/09/83/34/721098334.db2.gz SFLQFUXTWBGADR-GOTSBHOMSA-N 1 1 440.551 3.354 20 0 IGADMO Cn1cc(C[N@@H+]2CC[C@H]3CN(c4ccc5c(n4)CCN(Cc4ccccc4)C5)C[C@H]3C2)cn1 ZINC001164769926 721105277 /nfs/dbraw/zinc/10/52/77/721105277.db2.gz QHBLZCMZGCLGTG-UKILVPOCSA-N 1 1 442.611 3.332 20 0 IGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4ccc5c(n4)CCN(Cc4ccccc4)C5)C[C@H]3C2)cn1 ZINC001164769926 721105288 /nfs/dbraw/zinc/10/52/88/721105288.db2.gz QHBLZCMZGCLGTG-UKILVPOCSA-N 1 1 442.611 3.332 20 0 IGADMO Cn1cc(C[N@@H+]2CC[C@@H]3CN(c4ccc5c(n4)CCN(Cc4ccccc4)C5)C[C@@H]3C2)cn1 ZINC001164769925 721105981 /nfs/dbraw/zinc/10/59/81/721105981.db2.gz QHBLZCMZGCLGTG-NOZRDPDXSA-N 1 1 442.611 3.332 20 0 IGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4ccc5c(n4)CCN(Cc4ccccc4)C5)C[C@@H]3C2)cn1 ZINC001164769925 721105986 /nfs/dbraw/zinc/10/59/86/721105986.db2.gz QHBLZCMZGCLGTG-NOZRDPDXSA-N 1 1 442.611 3.332 20 0 IGADMO CCOC(=O)c1cc2ccccc2nc1N1CC[N@H+]2C[C@H](OCc3cccnc3)C[C@H]2C1 ZINC001164864389 721112291 /nfs/dbraw/zinc/11/22/91/721112291.db2.gz FSXRFSCVOKHTKO-LEWJYISDSA-N 1 1 432.524 3.286 20 0 IGADMO COC(=O)C[C@H](c1ccnc(N2CC[N@H+]3C[C@H](OCc4cccnc4)C[C@@H]3C2)c1)C1CC1 ZINC001164881017 721133825 /nfs/dbraw/zinc/13/38/25/721133825.db2.gz YVIMDUHZMUBJRW-ZLNRFVROSA-N 1 1 436.556 3.013 20 0 IGADMO c1ccc2nc(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@H]4C3)c(N3CCCC3)nc2c1 ZINC001164878357 721136063 /nfs/dbraw/zinc/13/60/63/721136063.db2.gz PXKQGPQQSFBERQ-SFTDATJTSA-N 1 1 430.556 3.105 20 0 IGADMO FC(F)(c1nc2ccc(Cl)nc2[nH]1)N1CC[N@H+]2C[C@@H](OCc3cccnc3)C[C@@H]2C1 ZINC001164878418 721156241 /nfs/dbraw/zinc/15/62/41/721156241.db2.gz QCJYFTSZIXNVGW-CABCVRRESA-N 1 1 434.878 3.031 20 0 IGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4nc(Cl)nc(Oc5cccc(F)c5)n4)C[C@H]3C2)cn1 ZINC001164762101 721165523 /nfs/dbraw/zinc/16/55/23/721165523.db2.gz BXKQILDPTGODJA-JKSUJKDBSA-N 1 1 443.914 3.148 20 0 IGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4nc(-c5cccnc5)nc5ccccc54)C[C@H]3C2)cn1 ZINC001164772331 721194528 /nfs/dbraw/zinc/19/45/28/721194528.db2.gz SGOMHSSNJWNIGO-NHCUHLMSSA-N 1 1 425.540 3.384 20 0 IGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4nc(-c5ccccn5)nc5sccc54)C[C@@H]3C2)cn1 ZINC001164766166 721228835 /nfs/dbraw/zinc/22/88/35/721228835.db2.gz SIBGRTNTVPUKPI-ROUUACIJSA-N 1 1 431.569 3.445 20 0 IGADMO Cc1c(Cl)ccc2ccc(N3CCC4(CC3)COCC[N@H+](CC(=O)N(C)C)C4)nc21 ZINC001164874534 721282621 /nfs/dbraw/zinc/28/26/21/721282621.db2.gz UFJCEXWBVNHBIS-UHFFFAOYSA-N 1 1 430.980 3.204 20 0 IGADMO Cc1nc2nc(Cl)nc(N3CCC[C@]4(C3)COCC[N@@H+](Cc3c(C)noc3C)C4)c2[nH]1 ZINC001164776834 721343837 /nfs/dbraw/zinc/34/38/37/721343837.db2.gz DEKQARRDISBOCR-NRFANRHFSA-N 1 1 445.955 3.039 20 0 IGADMO CCOC(=O)c1cc(C)cnc1N1CCC[C@@]2(C1)COCC[N@H+](Cc1c(C)noc1C)C2 ZINC001164779407 721350257 /nfs/dbraw/zinc/35/02/57/721350257.db2.gz SYHCRTRRUIYDJK-XMMPIXPASA-N 1 1 442.560 3.291 20 0 IGADMO CCOC(=O)c1cc(C)cnc1N1CCC[C@@]2(C1)COCC[N@@H+](Cc1c(C)noc1C)C2 ZINC001164779407 721350258 /nfs/dbraw/zinc/35/02/58/721350258.db2.gz SYHCRTRRUIYDJK-XMMPIXPASA-N 1 1 442.560 3.291 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@]2(CCCN(c3nnc(Cl)c4cccnc43)C2)C1 ZINC001164777294 721351194 /nfs/dbraw/zinc/35/11/94/721351194.db2.gz FRZJFHPHAYERRL-JOCHJYFZSA-N 1 1 442.951 3.402 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@@]2(CCCN(c3nncc4ccc(F)cc43)C2)C1 ZINC001164779428 721353776 /nfs/dbraw/zinc/35/37/76/721353776.db2.gz TUKUIYFYRDFKSH-QHCPKHFHSA-N 1 1 425.508 3.493 20 0 IGADMO CCN(CC)c1cncc(N2CCC[C@]3(C2)COCC[N@H+](Cc2c(C)noc2C)C3)n1 ZINC001164782932 721358824 /nfs/dbraw/zinc/35/88/24/721358824.db2.gz NRTYKKOHEBDRDM-QHCPKHFHSA-N 1 1 428.581 3.047 20 0 IGADMO CCN(CC)c1cncc(N2CCC[C@]3(C2)COCC[N@@H+](Cc2c(C)noc2C)C3)n1 ZINC001164782932 721358826 /nfs/dbraw/zinc/35/88/26/721358826.db2.gz NRTYKKOHEBDRDM-QHCPKHFHSA-N 1 1 428.581 3.047 20 0 IGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@@]2(CCCN(c3nc[nH]c4nc(=S)sc3-4)C2)C1 ZINC001164780655 721364545 /nfs/dbraw/zinc/36/45/45/721364545.db2.gz GEVMOUJEZHDMDX-FQEVSTJZSA-N 1 1 446.602 3.099 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@@]2(CCCN(c3nc[nH]c4nc(=S)sc3-4)C2)C1 ZINC001164780655 721364548 /nfs/dbraw/zinc/36/45/48/721364548.db2.gz GEVMOUJEZHDMDX-FQEVSTJZSA-N 1 1 446.602 3.099 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@@]2(CCCN(c3ccnc(N4CCCCC4)n3)C2)C1 ZINC001164782273 721365595 /nfs/dbraw/zinc/36/55/95/721365595.db2.gz MDKAMBFTKOEEQH-DEOSSOPVSA-N 1 1 440.592 3.191 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@]2(CCCN(c3cc4c(nn3)CC[C@@H](C)C4)C2)C1 ZINC001164785265 721372251 /nfs/dbraw/zinc/37/22/51/721372251.db2.gz SWFHLZFWWGEXAM-MZNJEOGPSA-N 1 1 425.577 3.325 20 0 IGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@]2(CCCN(c3cc4c(nn3)CC[C@@H](C)C4)C2)C1 ZINC001164785265 721372254 /nfs/dbraw/zinc/37/22/54/721372254.db2.gz SWFHLZFWWGEXAM-MZNJEOGPSA-N 1 1 425.577 3.325 20 0 IGADMO COc1ccc2nc(Cl)nc(N3CC[C@]4(C3)CCC[C@H](CN3CC[NH+](C)CC3)O4)c2c1 ZINC001164886724 721379807 /nfs/dbraw/zinc/37/98/07/721379807.db2.gz FYMXULOJAPPOCB-JPYJTQIMSA-N 1 1 445.995 3.057 20 0 IGADMO C[NH+]1CCN(C[C@H]2CCC[C@@]3(CCN(C(F)(F)c4ccnc(Cl)c4F)C3)O2)CC1 ZINC001164887298 721384731 /nfs/dbraw/zinc/38/47/31/721384731.db2.gz HOJPHGIPCSLOEE-BEFAXECRSA-N 1 1 432.918 3.184 20 0 IGADMO C[NH+]1CCN(C[C@@H]2CCC[C@@]3(CCN(C(F)(F)c4ccc(F)c(Cl)n4)C3)O2)CC1 ZINC001164886757 721389610 /nfs/dbraw/zinc/38/96/10/721389610.db2.gz GDTMQFCWYAGNSQ-KXBFYZLASA-N 1 1 432.918 3.184 20 0 IGADMO c1csc(C[NH+]2C[C@@H]3CN(c4ncnc5c4CN(Cc4ccccc4)CC5)C[C@H]3C2)n1 ZINC001164782823 721395921 /nfs/dbraw/zinc/39/59/21/721395921.db2.gz FVWPHYAOHARLPG-WOJBJXKFSA-N 1 1 432.597 3.060 20 0 IGADMO C[NH+]1CCN(C[C@@H]2CCC[C@@]3(CCN(c4nc(Cl)nc5c(F)cccc54)C3)O2)CC1 ZINC001164883628 721405770 /nfs/dbraw/zinc/40/57/70/721405770.db2.gz BJNPHYNGQNLNSP-AOMKIAJQSA-N 1 1 433.959 3.188 20 0 IGADMO Cc1cccc2c(Cl)nnc(N3CC[C@@]4(C3)CCC[C@H](CN3CC[NH+](C)CC3)O4)c12 ZINC001164885259 721408506 /nfs/dbraw/zinc/40/85/06/721408506.db2.gz GJDYFKSSNWKJMO-WZONZLPQSA-N 1 1 429.996 3.357 20 0 IGADMO Cc1sc2nc(C)nc(N3CC[C@@]4(C3)CCC[C@H](CN3CC[NH+](C)CC3)O4)c2c1C ZINC001164891924 721409672 /nfs/dbraw/zinc/40/96/72/721409672.db2.gz WQWHNHSLVBINLO-AUSIDOKSSA-N 1 1 429.634 3.382 20 0 IGADMO Cc1cccc2nc(Cl)nc(N3CC[C@]4(C3)CCC[C@H](CN3CC[NH+](C)CC3)O4)c12 ZINC001164892350 721425065 /nfs/dbraw/zinc/42/50/65/721425065.db2.gz IFJVIJKFQZGPCE-JPYJTQIMSA-N 1 1 429.996 3.357 20 0 IGADMO C[NH+]1CCN(C[C@@H]2CCC[C@]3(CCN(c4cccc(OCc5ccccc5)n4)C3)O2)CC1 ZINC001164896721 721426361 /nfs/dbraw/zinc/42/63/61/721426361.db2.gz RVTCWMCKPRXVDE-JYFHCDHNSA-N 1 1 436.600 3.426 20 0 IGADMO C[NH+]1CCN(C[C@H]2CCC[C@@]3(CCN(c4nccc(Oc5cccc(F)c5)n4)C3)O2)CC1 ZINC001164890244 721428002 /nfs/dbraw/zinc/42/80/02/721428002.db2.gz CQVGCZNONBOMQD-QPPBQGQZSA-N 1 1 441.551 3.173 20 0 IGADMO C[NH+]1CCN(C[C@H]2CCC[C@]3(CCN(c4cc(-c5ccc(F)cc5)ncn4)C3)O2)CC1 ZINC001164888711 721438054 /nfs/dbraw/zinc/43/80/54/721438054.db2.gz ANOSFJSWVZTQGR-ZJSXRUAMSA-N 1 1 425.552 3.048 20 0 IGADMO C[NH+]1CCN(C[C@@H]2CCC[C@@]3(CCN(c4cc(-c5ccc(F)cc5)ncn4)C3)O2)CC1 ZINC001164888709 721438267 /nfs/dbraw/zinc/43/82/67/721438267.db2.gz ANOSFJSWVZTQGR-URXFXBBRSA-N 1 1 425.552 3.048 20 0 IGADMO C[NH+]1CCN(C[C@H]2CCC[C@@]3(CCN(c4cc5nc(Cl)cnc5cc4F)C3)O2)CC1 ZINC001164891780 721439844 /nfs/dbraw/zinc/43/98/44/721439844.db2.gz HKMTWFFJKPGFEH-ZHRRBRCNSA-N 1 1 433.959 3.188 20 0 IGADMO CCc1nc(Cl)nc(Cl)c1N1CC[C@@]2(C1)CCC[C@H](CN1CC[NH+](C)CC1)O2 ZINC001164888480 721450280 /nfs/dbraw/zinc/45/02/80/721450280.db2.gz MPEKBBNRNDEVGF-FOIQADDNSA-N 1 1 428.408 3.111 20 0 IGADMO CCc1nc(Cl)nc(Cl)c1N1CC[C@]2(C1)CCC[C@@H](CN1CC[NH+](C)CC1)O2 ZINC001164888491 721450402 /nfs/dbraw/zinc/45/04/02/721450402.db2.gz MPEKBBNRNDEVGF-YWZLYKJASA-N 1 1 428.408 3.111 20 0 IGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1ccc(-c3ccccn3)nn1)CC2 ZINC001164790610 721469214 /nfs/dbraw/zinc/46/92/14/721469214.db2.gz SFMMUIRXHSIUEZ-OAQYLSRUSA-N 1 1 437.588 3.273 20 0 IGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1ncccc1C(=O)OC(C)C)CC2 ZINC001164789949 721471462 /nfs/dbraw/zinc/47/14/62/721471462.db2.gz PIETXLSBBXGPTD-OAQYLSRUSA-N 1 1 445.604 3.381 20 0 IGADMO CCC[N@H+]1CCCC[C@@H]1c1ccc(N2CC[C@@H]3OCC[C@@H](C(=O)N4CCCO4)[C@@H]3C2)nc1 ZINC001164789168 721482989 /nfs/dbraw/zinc/48/29/89/721482989.db2.gz BPTUHFSZPQPNCC-ACESQOTJSA-N 1 1 442.604 3.414 20 0 IGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2CC[C@@H]3OCC[C@H](C(=O)N4CCCO4)[C@H]3C2)nc1 ZINC001164791895 721483275 /nfs/dbraw/zinc/48/32/75/721483275.db2.gz KLKUDNURTRSWKJ-CBPXPLCBSA-N 1 1 428.577 3.024 20 0 IGADMO CCOC(=O)c1nnc(SC)nc1N1CCC2(CC([N@@H+](C)Cc3ccncc3)C2)CC1 ZINC001164791357 721493502 /nfs/dbraw/zinc/49/35/02/721493502.db2.gz BNHFNLXAYCUQSD-UHFFFAOYSA-N 1 1 442.589 3.046 20 0 IGADMO C[N@@H+](Cc1ccncc1)C1CC2(C1)CCN(c1ccc(C(=O)NC3CCCC3)nn1)CC2 ZINC001164796653 721502479 /nfs/dbraw/zinc/50/24/79/721502479.db2.gz UYISXSXXMQLKII-UHFFFAOYSA-N 1 1 434.588 3.425 20 0 IGADMO CCOC(=O)[C@@H]1CCc2nnc(N3CCC4(CC([N@@H+](C)Cc5ccncc5)C4)CC3)cc2C1 ZINC001164797070 721504623 /nfs/dbraw/zinc/50/46/23/721504623.db2.gz YNCDQBUVQARBHY-HXUWFJFHSA-N 1 1 449.599 3.421 20 0 IGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2nc(Cl)nc3c2COC3(C)C)[C@@H]2CCCO[C@@H]12 ZINC001164805520 721542162 /nfs/dbraw/zinc/54/21/62/721542162.db2.gz MANFTLHKFQEBRO-KZNAEPCWSA-N 1 1 429.952 3.159 20 0 IGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2nc(Cl)nc3c2COC3(C)C)[C@@H]2CCCO[C@@H]12 ZINC001164805520 721542166 /nfs/dbraw/zinc/54/21/66/721542166.db2.gz MANFTLHKFQEBRO-KZNAEPCWSA-N 1 1 429.952 3.159 20 0 IGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2nc(Cl)nc(-c3ccccc3)n2)[C@H]2CCCO[C@@H]12 ZINC001164803024 721545060 /nfs/dbraw/zinc/54/50/60/721545060.db2.gz HKYQMCWCTSCWIE-XUVXKRRUSA-N 1 1 436.947 3.455 20 0 IGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2nc(Cl)nc(-c3ccccc3)n2)[C@H]2CCCO[C@@H]12 ZINC001164803024 721545063 /nfs/dbraw/zinc/54/50/63/721545063.db2.gz HKYQMCWCTSCWIE-XUVXKRRUSA-N 1 1 436.947 3.455 20 0 IGADMO COC(=O)/C=C/c1cc2cc[nH]c2c(N2CC[N@H+]3C[C@H](Oc4cccc(F)c4)C[C@@H]3C2)n1 ZINC001164908664 721547720 /nfs/dbraw/zinc/54/77/20/721547720.db2.gz QBJPSSVRAACBSV-WHIUHWMMSA-N 1 1 436.487 3.230 20 0 IGADMO COC(=O)c1ccc2nc(N3C[C@H]([N@@H+](C)Cc4cccnc4)[C@@H]4OCCC[C@@H]43)ccc2c1 ZINC001164804591 721548241 /nfs/dbraw/zinc/54/82/41/721548241.db2.gz KOPFAIJVRONYSN-WPFOTENUSA-N 1 1 432.524 3.285 20 0 IGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2nccc(OCc3ccccc3)n2)[C@@H]2CCCO[C@H]12 ZINC001164803124 721553096 /nfs/dbraw/zinc/55/30/96/721553096.db2.gz IFHQUEMPHCJXQW-AKFKNWHVSA-N 1 1 431.540 3.319 20 0 IGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2nccc(OCc3ccccc3)n2)[C@@H]2CCCO[C@H]12 ZINC001164803124 721553098 /nfs/dbraw/zinc/55/30/98/721553098.db2.gz IFHQUEMPHCJXQW-AKFKNWHVSA-N 1 1 431.540 3.319 20 0 IGADMO CCOC(=O)c1cc2cccnc2nc1N1C[C@H]([N@H+](C)Cc2cccnc2)[C@@H]2OCCC[C@@H]21 ZINC001164805639 721553637 /nfs/dbraw/zinc/55/36/37/721553637.db2.gz MNIARKONSVEOHN-FDFHNCONSA-N 1 1 447.539 3.070 20 0 IGADMO CCOC(=O)c1cc2cccnc2nc1N1C[C@H]([N@@H+](C)Cc2cccnc2)[C@@H]2OCCC[C@@H]21 ZINC001164805639 721553639 /nfs/dbraw/zinc/55/36/39/721553639.db2.gz MNIARKONSVEOHN-FDFHNCONSA-N 1 1 447.539 3.070 20 0 IGADMO NC(=S)c1cnc(N2CC[N@H+]3C[C@H](Oc4cccc(F)c4)C[C@H]3C2)c2sccc21 ZINC001164907583 721567944 /nfs/dbraw/zinc/56/79/44/721567944.db2.gz OSBUIESZPXKNND-GOEBONIOSA-N 1 1 428.558 3.412 20 0 IGADMO CCOC[C@H]1c2c(cnn2CC2CCOCC2)CCN1c1ccc(C[N@@H+](C)C2CC2)cn1 ZINC001164903050 721578256 /nfs/dbraw/zinc/57/82/56/721578256.db2.gz KNDVAUGLZBWBLA-QHCPKHFHSA-N 1 1 439.604 3.439 20 0 IGADMO COc1cccc(-c2ccc(N3C[C@H]([N@H+](C)Cc4cccnc4)[C@H]4OCCC[C@H]43)nn2)c1 ZINC001164808327 721578548 /nfs/dbraw/zinc/57/85/48/721578548.db2.gz QQEJSAOCLGRSEB-CUYJMHBOSA-N 1 1 431.540 3.415 20 0 IGADMO COc1cccc(-c2ccc(N3C[C@H]([N@@H+](C)Cc4cccnc4)[C@H]4OCCC[C@H]43)nn2)c1 ZINC001164808327 721578550 /nfs/dbraw/zinc/57/85/50/721578550.db2.gz QQEJSAOCLGRSEB-CUYJMHBOSA-N 1 1 431.540 3.415 20 0 IGADMO COC(=O)c1cc2ccccc2c(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@H]3OCCC[C@@H]32)n1 ZINC001164806984 721581498 /nfs/dbraw/zinc/58/14/98/721581498.db2.gz OHRKNZYOKKDKMB-VABKMULXSA-N 1 1 432.524 3.285 20 0 IGADMO COC(=O)c1cc(Cl)nc(N2CCC(F)(F)[C@@]3(CC[N@@H+](Cc4ccccn4)C3)C2)n1 ZINC001164905611 721585013 /nfs/dbraw/zinc/58/50/13/721585013.db2.gz KCGJCTSRNLEKHP-LJQANCHMSA-N 1 1 437.878 3.049 20 0 IGADMO COC(=O)c1cccc2nc(N3C[C@H]([N@@H+](C)Cc4cccnc4)[C@H]4OCCC[C@H]43)ccc21 ZINC001164801874 721585952 /nfs/dbraw/zinc/58/59/52/721585952.db2.gz GAHPIODUJJMENJ-GPXNEJASSA-N 1 1 432.524 3.285 20 0 IGADMO COC(=O)c1cc(Cl)c(N2C[C@H]([N@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@@H]32)nc1C ZINC001164805788 721588772 /nfs/dbraw/zinc/58/87/72/721588772.db2.gz LXHPHVDXHRUEMS-SLFFLAALSA-N 1 1 430.936 3.093 20 0 IGADMO COC(=O)c1cc(Cl)c(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@@H]32)nc1C ZINC001164805788 721588774 /nfs/dbraw/zinc/58/87/74/721588774.db2.gz LXHPHVDXHRUEMS-SLFFLAALSA-N 1 1 430.936 3.093 20 0 IGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2ncc(C(N)=S)c3ccsc32)[C@H]2CCCO[C@H]12 ZINC001164805098 721591433 /nfs/dbraw/zinc/59/14/33/721591433.db2.gz KQJMYIKZBJFQSI-OTWHNJEPSA-N 1 1 439.610 3.194 20 0 IGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2ncc(C(N)=S)c3ccsc32)[C@H]2CCCO[C@H]12 ZINC001164805098 721591435 /nfs/dbraw/zinc/59/14/35/721591435.db2.gz KQJMYIKZBJFQSI-OTWHNJEPSA-N 1 1 439.610 3.194 20 0 IGADMO COC(=O)c1cc(OC)cnc1N1CCC(F)(F)[C@@]2(CC[N@@H+](Cc3ccccn3)C2)C1 ZINC001164907478 721697045 /nfs/dbraw/zinc/69/70/45/721697045.db2.gz UDXLFQFVLWGSQI-OAQYLSRUSA-N 1 1 432.471 3.010 20 0 IGADMO CCOC(=O)c1ncnc(N2CCC(F)(F)[C@]3(CC[N@@H+](Cc4ccccn4)C3)C2)c1C ZINC001164907395 721709419 /nfs/dbraw/zinc/70/94/19/721709419.db2.gz RNUGIAUIGRSJLQ-NRFANRHFSA-N 1 1 431.487 3.094 20 0 IGADMO FC1(F)CCN(c2cccc(N3CCOCC3)n2)C[C@@]12CC[N@H+](Cc1ccccn1)C2 ZINC001164905581 721717204 /nfs/dbraw/zinc/71/72/04/721717204.db2.gz HUFBWCFAOKQMNV-QFIPXVFZSA-N 1 1 429.515 3.051 20 0 IGADMO FC1(F)CCN(c2cccc(N3CCOCC3)n2)C[C@@]12CC[N@@H+](Cc1ccccn1)C2 ZINC001164905581 721717211 /nfs/dbraw/zinc/71/72/11/721717211.db2.gz HUFBWCFAOKQMNV-QFIPXVFZSA-N 1 1 429.515 3.051 20 0 IGADMO COC(=O)CSc1cccc(N2CCC(F)(F)[C@@]3(CC[N@@H+](Cc4ccccn4)C3)C2)n1 ZINC001164905616 721718969 /nfs/dbraw/zinc/71/89/69/721718969.db2.gz IBOJYQWTCBNTIS-OAQYLSRUSA-N 1 1 448.539 3.479 20 0 IGADMO CCOc1ccc(C(=O)OC)c(N2CCc3c(C[N@H+](C)Cc4ccco4)cncc3C2)n1 ZINC001164911715 721756146 /nfs/dbraw/zinc/75/61/46/721756146.db2.gz XRBYQRBQXALLPD-UHFFFAOYSA-N 1 1 436.512 3.450 20 0 IGADMO CCOc1ccc(C(=O)OC)c(N2CCc3c(C[N@@H+](C)Cc4ccco4)cncc3C2)n1 ZINC001164911715 721756148 /nfs/dbraw/zinc/75/61/48/721756148.db2.gz XRBYQRBQXALLPD-UHFFFAOYSA-N 1 1 436.512 3.450 20 0 IGADMO Clc1ccc(C[NH+]2CCCC2)c(N2CCO[C@H]3[C@H]2CC[C@@H]3OCCCn2cccn2)n1 ZINC001165024550 721780796 /nfs/dbraw/zinc/78/07/96/721780796.db2.gz XWEWZBQZWYFWIX-URVUXULASA-N 1 1 445.995 3.370 20 0 IGADMO CCOC(=O)c1nnc(Cl)cc1N1C[C@@H]2CCC[C@H]([N@@H+](C)Cc3ccccn3)[C@H]2C1 ZINC001165025951 721810076 /nfs/dbraw/zinc/81/00/76/721810076.db2.gz OLEGZMDCSFFREG-SZMVWBNQSA-N 1 1 429.952 3.439 20 0 IGADMO CCOC(=O)Cc1nc(Cl)cc(N2C[C@@H]3CCC[C@H]([N@@H+](C)Cc4ccccn4)[C@@H]3C2)n1 ZINC001165026512 721810166 /nfs/dbraw/zinc/81/01/66/721810166.db2.gz QXKJDEBNWDUNOH-UHOSZYNNSA-N 1 1 443.979 3.368 20 0 IGADMO C[NH+]1CCC(Oc2ccnc(N3CCO[C@@H]4[C@@H](COCc5nccs5)CC[C@H]43)c2)CC1 ZINC001164918641 721811357 /nfs/dbraw/zinc/81/13/57/721811357.db2.gz SKQLEPVJXVRSSB-HCLVMJGWSA-N 1 1 444.601 3.212 20 0 IGADMO CCc1cc(N2C[C@@H]3CCC[C@H]([N@H+](C)Cc4ccccn4)[C@@H]3C2)nc(N2CCOCC2)n1 ZINC001165025346 721818152 /nfs/dbraw/zinc/81/81/52/721818152.db2.gz MRYDJIVJBJAURT-PMOQBDJRSA-N 1 1 436.604 3.008 20 0 IGADMO CCc1cc(N2C[C@@H]3CCC[C@H]([N@@H+](C)Cc4ccccn4)[C@@H]3C2)nc(N2CCOCC2)n1 ZINC001165025346 721818154 /nfs/dbraw/zinc/81/81/54/721818154.db2.gz MRYDJIVJBJAURT-PMOQBDJRSA-N 1 1 436.604 3.008 20 0 IGADMO COC(=O)CSc1cccc(N2C[C@@H]3CCC[C@H]([N@@H+](C)Cc4ccccn4)[C@@H]3C2)n1 ZINC001165022587 721820771 /nfs/dbraw/zinc/82/07/71/721820771.db2.gz FZESWOOTQVUSKG-SXLOBPIMSA-N 1 1 426.586 3.479 20 0 IGADMO CCOC(=O)[C@@H]1CCc2nnc(N3C[C@@H]4CCC[C@@H]([N@@H+](C)Cc5ccccn5)[C@H]4C3)cc2C1 ZINC001165026356 721831901 /nfs/dbraw/zinc/83/19/01/721831901.db2.gz PCRYBFLJMVTCFP-KFELQJHASA-N 1 1 449.599 3.277 20 0 IGADMO CCC[N@H+]1CCCC[C@H]1c1ccc(N2CCN(Cc3nc(OC)cc(OC)n3)CC2)nc1 ZINC001165030239 721851184 /nfs/dbraw/zinc/85/11/84/721851184.db2.gz SIBZTCCPDLZKCF-FQEVSTJZSA-N 1 1 440.592 3.148 20 0 IGADMO CN1C(=O)CC[C@@H]2[C@H]1CCN2c1nc(C[NH+]2CCCC2)nc2sc3c(c21)CCCC3 ZINC001164933697 721893340 /nfs/dbraw/zinc/89/33/40/721893340.db2.gz NBRGVNFRURYSMJ-IAGOWNOFSA-N 1 1 425.602 3.365 20 0 IGADMO CN1C(=O)CC[C@@H]2[C@@H]1CCN2c1nc(C[NH+]2CCCC2)nc2sc3c(c21)CCCC3 ZINC001164933696 721893428 /nfs/dbraw/zinc/89/34/28/721893428.db2.gz NBRGVNFRURYSMJ-DLBZAZTESA-N 1 1 425.602 3.365 20 0 IGADMO Cc1nc2nc(Cl)nc(N3CCC4(CC3)C[N@@H+](Cc3ccc(C)cc3)CCO4)c2[nH]1 ZINC001164941045 721924739 /nfs/dbraw/zinc/92/47/39/721924739.db2.gz ZQJGECJEXJNIBY-UHFFFAOYSA-N 1 1 426.952 3.495 20 0 IGADMO Cc1ccc(C[N@H+]2CCOC3(CCN(c4nnc(Cl)c5c4N(C)CCO5)CC3)C2)cc1 ZINC001164940181 721929486 /nfs/dbraw/zinc/92/94/86/721929486.db2.gz RGRQRSMWICHUQL-UHFFFAOYSA-N 1 1 443.979 3.138 20 0 IGADMO NC(=O)c1ccc(C(F)(F)N2CCC3(CC[N@@H+](Cc4cccnc4)C3)CC2)nc1Cl ZINC001164954892 722012808 /nfs/dbraw/zinc/01/28/08/722012808.db2.gz QNAUNNYOJRTUCI-UHFFFAOYSA-N 1 1 435.906 3.266 20 0 IGADMO c1ccc2nc(N3CCC4(CC[N@H+](Cc5cccnc5)C4)CC3)c(N3CCOCC3)nc2c1 ZINC001164951573 722017007 /nfs/dbraw/zinc/01/70/07/722017007.db2.gz BBBWAPHIHVGIQY-UHFFFAOYSA-N 1 1 444.583 3.354 20 0 IGADMO Cc1noc(C[C@@H]2C[C@@H]3CN(c4ccc5c(n4)CC[N@H+](Cc4ccccc4)C5)C[C@@H]3O2)n1 ZINC001164961831 722040973 /nfs/dbraw/zinc/04/09/73/722040973.db2.gz NJDOTSSNYSKFAS-GIWBLDEGSA-N 1 1 431.540 3.168 20 0 IGADMO CCOC(=O)/C=C\c1cccnc1N1CCC2(CC1)COCC[N@@H+](Cc1ccncc1)C2 ZINC001164960447 722052454 /nfs/dbraw/zinc/05/24/54/722052454.db2.gz NSUJXDJYECWXHR-WAYWQWQTSA-N 1 1 436.556 3.172 20 0 IGADMO Cn1ccc2c1nc(Cl)nc2N1CCC2(CC1)COCC[N@@H+](Cc1ccncc1)C2 ZINC001164963045 722054899 /nfs/dbraw/zinc/05/48/99/722054899.db2.gz GRIOEPYAYYMKSE-UHFFFAOYSA-N 1 1 426.952 3.136 20 0 IGADMO Fc1ncccc1-c1ccnc(N2CCC3(CC2)COCC[N@@H+](Cc2ccncc2)C3)n1 ZINC001164960028 722058282 /nfs/dbraw/zinc/05/82/82/722058282.db2.gz DFVZMZOPVOMFCW-UHFFFAOYSA-N 1 1 434.519 3.192 20 0 IGADMO C[C@H]1CCCN(c2cc(N3CCC4(CC3)COCC[N@@H+](Cc3ccncc3)C4)ncn2)C1 ZINC001164963397 722060821 /nfs/dbraw/zinc/06/08/21/722060821.db2.gz YJTZSRIAFGKRDW-NRFANRHFSA-N 1 1 436.604 3.227 20 0 IGADMO FC(F)(c1cc(Cl)nc(Cl)n1)N1CC[C@@H]2C[N@@H+](Cc3cccnc3)CCO[C@@H]2C1 ZINC001164984002 722101707 /nfs/dbraw/zinc/10/17/07/722101707.db2.gz RMQGEWAMBMGMQP-HUUCEWRRSA-N 1 1 444.313 3.451 20 0 IGADMO CCOC(=O)c1c(Cl)cc(C)nc1N1CC[C@@H]2C[N@@H+](Cc3cccnc3)CCO[C@H]2C1 ZINC001164985192 722102117 /nfs/dbraw/zinc/10/21/17/722102117.db2.gz VGSNFBJVUNWGMV-QUCCMNQESA-N 1 1 444.963 3.342 20 0 IGADMO COc1cc(C(F)(F)N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)cc(Cl)n1 ZINC001164984685 722103280 /nfs/dbraw/zinc/10/32/80/722103280.db2.gz TYWSDEIRVPTOJG-WMZOPIPTSA-N 1 1 438.906 3.411 20 0 IGADMO FC(F)(c1nc(Cl)cc(Cl)n1)N1CC[C@@H]2C[N@@H+](Cc3cccnc3)CCO[C@@H]2C1 ZINC001164983978 722103460 /nfs/dbraw/zinc/10/34/60/722103460.db2.gz RJWUYDHBAYNCHI-HUUCEWRRSA-N 1 1 444.313 3.451 20 0 IGADMO CC1(C)OCc2c1nc(Cl)nc2N1CC[C@H]2C[N@@H+](Cc3cccnc3)CCO[C@@H]2C1 ZINC001164983215 722108713 /nfs/dbraw/zinc/10/87/13/722108713.db2.gz YNDYVIPFEPJWCZ-FUHWJXTLSA-N 1 1 429.952 3.018 20 0 IGADMO CCOC(=O)c1c(C)cc(Cl)nc1N1CC[C@@H]2C[N@@H+](Cc3cccnc3)CCO[C@@H]2C1 ZINC001164971389 722109613 /nfs/dbraw/zinc/10/96/13/722109613.db2.gz BVJNXPHAVUOVEJ-RTBURBONSA-N 1 1 444.963 3.342 20 0 IGADMO Clc1ccc(CN2CCCC2)c(N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)n1 ZINC001164983728 722124971 /nfs/dbraw/zinc/12/49/71/722124971.db2.gz ZIJYEQICOVAYQT-IRLDBZIGSA-N 1 1 442.007 3.453 20 0 IGADMO COc1cc2ccc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)nc2cc1OC ZINC001164974052 722127641 /nfs/dbraw/zinc/12/76/41/722127641.db2.gz IHKCNGJZYURZGF-YKSBVNFPSA-N 1 1 434.540 3.374 20 0 IGADMO Cc1nc(C(F)(F)N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)nc(Cl)c1C ZINC001164981019 722128139 /nfs/dbraw/zinc/12/81/39/722128139.db2.gz SAZYRORUYQZEPN-ROUUACIJSA-N 1 1 437.922 3.414 20 0 IGADMO CC1CCN(C(=O)c2cccnc2N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)CC1 ZINC001164982789 722140778 /nfs/dbraw/zinc/14/07/78/722140778.db2.gz SPPHWSJJNZNIOF-UPVQGACJSA-N 1 1 449.599 3.076 20 0 IGADMO COc1ccc(-c2cc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)ncn2)cc1 ZINC001164975237 722144537 /nfs/dbraw/zinc/14/45/37/722144537.db2.gz GDGHMLCIXPJPPQ-ZJSXRUAMSA-N 1 1 431.540 3.275 20 0 IGADMO c1cncc(C[N@H+]2CCO[C@@H]3CN(c4nc(-c5cccnc5)nc5c4CCC5)CC[C@H]3C2)c1 ZINC001164985500 722149344 /nfs/dbraw/zinc/14/93/44/722149344.db2.gz ZQZGBWZKPWXCFG-XUZZJYLKSA-N 1 1 442.567 3.150 20 0 IGADMO Cc1nc(CN2CCO[C@H]3CCN(c4ccc(C[N@H+](C)C5CC5)cn4)CC[C@H]32)cs1 ZINC001164992994 722185618 /nfs/dbraw/zinc/18/56/18/722185618.db2.gz YMUIUHIXOQGNQH-YADHBBJMSA-N 1 1 427.618 3.311 20 0 IGADMO C[NH+]1CCN(c2ncnc3c2CCN(c2nccc4cc(F)c(Cl)cc42)CC3)CC1 ZINC001165001613 722239050 /nfs/dbraw/zinc/23/90/50/722239050.db2.gz KLMVUOTXTRQICY-UHFFFAOYSA-N 1 1 426.927 3.174 20 0 IGADMO COc1cc2[nH+]c(N3CCN(C(=O)c4cccc5ccccc54)CC3)nc(N)c2cc1OC ZINC000028397563 563054643 /nfs/dbraw/zinc/05/46/43/563054643.db2.gz IJSYXXWDUXZRID-UHFFFAOYSA-N 1 1 443.507 3.345 20 0 IGADMO Cc1cccc(CN2C(=O)COC3(CCN(c4ccc(C[N@@H+](C)C5CC5)cn4)CC3)[C@H]2C)n1 ZINC001164428920 718952029 /nfs/dbraw/zinc/95/20/29/718952029.db2.gz MAFOKNXNXUUYJZ-HXUWFJFHSA-N 1 1 449.599 3.166 20 0 IGADMO CCOC(=O)[C@@H]1CCCN(c2ccc(N3CCC[C@H]4C[N@@H+](Cc5ccccc5)C[C@@H]43)nn2)C1 ZINC001164626729 719098024 /nfs/dbraw/zinc/09/80/24/719098024.db2.gz IPGRLGIFEHEMHD-ZRBLBEILSA-N 1 1 449.599 3.357 20 0 IGADMO CCOC(=O)[C@@H]1CCCN(c2ccc(N3CCC[C@H]4C[N@@H+](Cc5ccccc5)C[C@H]43)nn2)C1 ZINC001164626725 719098464 /nfs/dbraw/zinc/09/84/64/719098464.db2.gz IPGRLGIFEHEMHD-YTFSRNRJSA-N 1 1 449.599 3.357 20 0 IGADMO CNC(=O)C[N@H+]1CCCC12CCN(c1nnc(Cc3ccccc3)c3ccccc31)CC2 ZINC001164690233 719735784 /nfs/dbraw/zinc/73/57/84/719735784.db2.gz WGQPXWLBALGUBA-UHFFFAOYSA-N 1 1 429.568 3.401 20 0 IGADMO CC(C)N(C)C(=O)c1noc2c1CN(c1ncnc3c1CC[N@H+](Cc1ccccc1)C3)CC2 ZINC001164694766 719786054 /nfs/dbraw/zinc/78/60/54/719786054.db2.gz GORWWMGEWYZLOS-UHFFFAOYSA-N 1 1 446.555 3.066 20 0 IGADMO CC(C)N(C)C(=O)c1noc2c1CN(c1ncnc3c1CC[N@@H+](Cc1ccccc1)C3)CC2 ZINC001164694766 719786076 /nfs/dbraw/zinc/78/60/76/719786076.db2.gz GORWWMGEWYZLOS-UHFFFAOYSA-N 1 1 446.555 3.066 20 0 IGADMO COC(=O)CSc1cncc(N2CCC3(CCC[N@H+]3Cc3csc(C)n3)CC2)n1 ZINC001164692740 719814400 /nfs/dbraw/zinc/81/44/00/719814400.db2.gz RLNHPAXIVQNDGG-UHFFFAOYSA-N 1 1 433.603 3.142 20 0 IGADMO COC(=O)[C@@]1(C)C[C@@H]([NH+]2CCOCC2)CCN1c1cc(Cl)nc2c(OC)cccc12 ZINC001164702606 719838341 /nfs/dbraw/zinc/83/83/41/719838341.db2.gz OEWWVBORUQXJPY-OYHNWAKOSA-N 1 1 433.936 3.130 20 0 IGADMO COC(=O)[C@]1(C)C[C@@H]([NH+]2CCOCC2)CCN1c1ncnc2sc3c(c21)CC[C@@H](C)C3 ZINC001164701454 719853623 /nfs/dbraw/zinc/85/36/23/719853623.db2.gz KNSIPFDIFWRTRZ-SYJLOODJSA-N 1 1 444.601 3.049 20 0 IGADMO COC(=O)[C@@]1(C)C[C@@H]([NH+]2CCOCC2)CCN1c1nc(Cl)ncc1-c1ccccc1 ZINC001164705613 719855446 /nfs/dbraw/zinc/85/54/46/719855446.db2.gz UUQGDXBOUDXTCZ-HTAPYJJXSA-N 1 1 430.936 3.030 20 0 IGADMO COC(=O)[C@]1(C)C[C@@H]([NH+]2CCOCC2)CCN1c1nnc(Cl)c2ccc(Cl)cc21 ZINC001164708221 719874503 /nfs/dbraw/zinc/87/45/03/719874503.db2.gz YRKPOTVUNWVLHW-XOBRGWDASA-N 1 1 439.343 3.169 20 0 IGADMO CCOC(=O)c1cnc(SC)nc1N1CCC2(CC1)C[N@H+](Cc1cccs1)CCO2 ZINC001164701328 719886187 /nfs/dbraw/zinc/88/61/87/719886187.db2.gz NFPXCHIWFVZTFT-UHFFFAOYSA-N 1 1 448.614 3.308 20 0 IGADMO CCOC(=O)c1cnc(SC)nc1N1CCC2(CC1)C[N@@H+](Cc1cccs1)CCO2 ZINC001164701328 719886189 /nfs/dbraw/zinc/88/61/89/719886189.db2.gz NFPXCHIWFVZTFT-UHFFFAOYSA-N 1 1 448.614 3.308 20 0 IGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(C(F)(F)c1ccc(Cl)nc1C(=O)OC)C2 ZINC001164814990 720108859 /nfs/dbraw/zinc/10/88/59/720108859.db2.gz VCAYXZNGYZXRJO-MGPUTAFESA-N 1 1 443.922 3.251 20 0 IGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(C(F)(F)c1cc(C(=O)OC)cc(Cl)n1)C2 ZINC001164810452 720128120 /nfs/dbraw/zinc/12/81/20/720128120.db2.gz JWIBJRCKIAUNIR-OXJNMPFZSA-N 1 1 443.922 3.251 20 0 IGADMO CCOC(=O)c1cc2ncnc(N3CC[C@]4(C3)C[N@@H+](CC3CC3)C[C@H]4COC)c2s1 ZINC001164810483 720143789 /nfs/dbraw/zinc/14/37/89/720143789.db2.gz JXEMKJYXBULKEY-KSFYIVLOSA-N 1 1 430.574 3.053 20 0 IGADMO COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN([C@H](F)Oc1ccc(Cl)nn1)CC2 ZINC001164711897 720157888 /nfs/dbraw/zinc/15/78/88/720157888.db2.gz DJGIXCNKAMQLAE-PXNSSMCTSA-N 1 1 435.931 3.160 20 0 IGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(C(F)(F)c1c3c(nnc1Cl)CCC3)C2 ZINC001164817154 720172732 /nfs/dbraw/zinc/17/27/32/720172732.db2.gz OGILFIGBAYVNKP-YWZLYKJASA-N 1 1 426.939 3.348 20 0 IGADMO Cc1cccc2c(Cl)nnc(N3CCCn4c(=O)cc(C[N@H+](C)C(C)C)nc4C3)c12 ZINC001164813522 720221512 /nfs/dbraw/zinc/22/15/12/720221512.db2.gz NMLLBEGKUCMFGL-UHFFFAOYSA-N 1 1 426.952 3.399 20 0 IGADMO COc1cccc2c1nc(Cl)nc2N1CCCn2c(=O)cc(C[N@@H+](C)C(C)C)nc2C1 ZINC001164813949 720221769 /nfs/dbraw/zinc/22/17/69/720221769.db2.gz PSEOYFHLDZOTBV-UHFFFAOYSA-N 1 1 442.951 3.099 20 0 IGADMO CC(C)[N@@H+](C)Cc1cc(=O)n2c(n1)CN(c1ncc3c(n1)-c1ccccc1CC3)CCC2 ZINC001164813432 720233165 /nfs/dbraw/zinc/23/31/65/720233165.db2.gz ODPSKDNIVPKZTM-UHFFFAOYSA-N 1 1 430.556 3.049 20 0 IGADMO COc1cc2cnc(N3CCCn4c(=O)cc(C[N@@H+](C)C(C)C)nc4C3)cc2cc1OC ZINC001164812950 720238551 /nfs/dbraw/zinc/23/85/51/720238551.db2.gz KYGNXVQUSCOSAM-UHFFFAOYSA-N 1 1 437.544 3.059 20 0 IGADMO CCOC(=O)c1c(Cl)nc(SC)nc1N1CC[C@@H]2[C@@H]1CC[N@H+]2Cc1cccnc1 ZINC001164723074 720382491 /nfs/dbraw/zinc/38/24/91/720382491.db2.gz GADLNRDQOYGAFF-CABCVRRESA-N 1 1 433.965 3.277 20 0 IGADMO COc1ccc(CN(C)c2ccnc(N3CC[C@H]4[C@@H]3CC[N@H+]4Cc3cccnc3)n2)cc1 ZINC001164728954 720469783 /nfs/dbraw/zinc/46/97/83/720469783.db2.gz QAHMQCXJLFPVDM-GOTSBHOMSA-N 1 1 430.556 3.370 20 0 IGADMO CCOC(=O)c1cc(Cl)nc(N2CC[C@@H]3[C@@H](C[C@H](Cn4cccn4)[N@H+]3C(C)C)C2)c1 ZINC001164840041 720505526 /nfs/dbraw/zinc/50/55/26/720505526.db2.gz WBRYESHDBNANHX-IPMKNSEASA-N 1 1 431.968 3.486 20 0 IGADMO COc1cc(OC)c2ncnc(N3CC[C@@H]4[C@H](C[C@@H](Cn5cccn5)[N@H+]4C(C)C)C3)c2c1 ZINC001164842506 720646218 /nfs/dbraw/zinc/64/62/18/720646218.db2.gz RUDJCIMYSIEWSJ-LVCYWYKZSA-N 1 1 436.560 3.221 20 0 IGADMO COc1cc(C(F)(F)N2CC[C@@H]3[C@H](C[C@H](Cn4cccn4)[N@H+]3C(C)C)C2)nc(Cl)n1 ZINC001164843772 720647352 /nfs/dbraw/zinc/64/73/52/720647352.db2.gz YEQTVMCMWCRGGD-BZUAXINKSA-N 1 1 440.926 3.258 20 0 IGADMO c1sc2ncnc(N3CC[N@@H+]4C[C@H](Oc5cncnc5)C[C@H]4C3)c2c1-c1ccccc1 ZINC001164744403 720656902 /nfs/dbraw/zinc/65/69/02/720656902.db2.gz ZTPVKGDOOIEJDO-ZWKOTPCHSA-N 1 1 430.537 3.490 20 0 IGADMO Cn1cnc2c1nc(Cl)nc2N1CCC2(C[C@@H]([N@@H+](C)Cc3ccccc3)CO2)CC1 ZINC001164839861 720680859 /nfs/dbraw/zinc/68/08/59/720680859.db2.gz CDRZGORXNQYYRC-QGZVFWFLSA-N 1 1 426.952 3.277 20 0 IGADMO CNC(=O)c1nc(N2CCC3(C[C@H]([N@@H+](C)Cc4ccccc4)CO3)CC2)ccc1Cl ZINC001164843832 720699249 /nfs/dbraw/zinc/69/92/49/720699249.db2.gz RHDHCIAFRRDDOA-SFHVURJKSA-N 1 1 428.964 3.355 20 0 IGADMO C[NH+]1CCC(Oc2ccnc(N3CC[C@@H]4O[C@@H](COCc5ccccn5)CC[C@@H]43)c2)CC1 ZINC001164846187 720780250 /nfs/dbraw/zinc/78/02/50/720780250.db2.gz IDZPUTQDVDKQQK-SGNDLWITSA-N 1 1 438.572 3.293 20 0 IGADMO Fc1ccccc1Oc1nc(Cl)ncc1N1CC[N@H+]2C[C@@H](Oc3cncnc3)C[C@@H]2C1 ZINC001164741554 720803057 /nfs/dbraw/zinc/80/30/57/720803057.db2.gz BKIQDPCCVLCVKQ-CABCVRRESA-N 1 1 442.882 3.193 20 0 IGADMO Cc1cccc(Oc2nc(Cl)ncc2N2CC[N@H+]3C[C@H](Oc4cncnc4)C[C@H]3C2)c1 ZINC001164741420 720803234 /nfs/dbraw/zinc/80/32/34/720803234.db2.gz BHMANDRMPBQRKJ-FUHWJXTLSA-N 1 1 438.919 3.363 20 0 IGADMO Fc1cccc2nc(Cl)nc(N3CC[C@@H]4[C@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)c12 ZINC001164746265 720822330 /nfs/dbraw/zinc/82/23/30/720822330.db2.gz YSULPUPZRMLIMO-JTDSTZFVSA-N 1 1 441.942 3.393 20 0 IGADMO Fc1cc(C(F)(F)N2CC[C@@H]3[C@@H](C[C@@H](Cn4cncn4)[N@H+]3CC3CC3)C2)cnc1Cl ZINC001164741544 720825633 /nfs/dbraw/zinc/82/56/33/720825633.db2.gz NXGQRVOKWLMURO-QILLFSRXSA-N 1 1 440.901 3.390 20 0 IGADMO Fc1ccc(-c2ccnc(N3CC[C@@H]4[C@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)n2)cc1 ZINC001164742675 720826093 /nfs/dbraw/zinc/82/60/93/720826093.db2.gz QKWRQZXFVNRMPG-UNWVZKJWSA-N 1 1 433.535 3.254 20 0 IGADMO Cc1nc2c(nc(Cl)nc2N2CC[C@@H]3[C@H](C[C@H](Cn4cncn4)[N@H+]3CC3CC3)C2)s1 ZINC001164743554 720832789 /nfs/dbraw/zinc/83/27/89/720832789.db2.gz JBXDWQQNDOPPPL-BZUAXINKSA-N 1 1 444.996 3.019 20 0 IGADMO COCC[N@H+]1CCO[C@@H]2CN(C(F)(F)c3nc(Cl)c4ccccc4n3)CC[C@@H]2C1 ZINC001164852575 720836079 /nfs/dbraw/zinc/83/60/79/720836079.db2.gz KYQPOBLAJXJNIY-RHSMWYFYSA-N 1 1 426.895 3.002 20 0 IGADMO CCCN(CCC)c1cncc(N2CC[C@@H]3[C@@H](C[C@H](Cn4cncn4)[N@H+]3CC3CC3)C2)n1 ZINC001164751026 720839827 /nfs/dbraw/zinc/83/98/27/720839827.db2.gz XWMSDNJNFGFAMP-BHDDXSALSA-N 1 1 438.624 3.074 20 0 IGADMO c1ncn(C[C@H]2C[C@@H]3CN(c4cnc(OCc5ccccc5)cn4)CC[C@H]3[N@@H+]2CC2CC2)n1 ZINC001164741256 720841171 /nfs/dbraw/zinc/84/11/71/720841171.db2.gz DWERNKSWSQKXSD-DNVJHFABSA-N 1 1 445.571 3.027 20 0 IGADMO c1ncn(C[C@H]2C[C@@H]3CN(c4ncc5c(n4)-c4ccccc4CC5)CC[C@H]3[N@H+]2CC2CC2)n1 ZINC001164747427 720841673 /nfs/dbraw/zinc/84/16/73/720841673.db2.gz QMJZMEOCQYFPNN-CQOQZXRMSA-N 1 1 441.583 3.213 20 0 IGADMO Cc1nc(C2CC2)nc(Cl)c1N1CC[C@@H]2[C@@H](C[C@@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164747891 720850435 /nfs/dbraw/zinc/85/04/35/720850435.db2.gz RYDMKRMXJQYVAM-GBESFXJTSA-N 1 1 427.984 3.287 20 0 IGADMO Cc1nc(-c2ccccn2)nc(N2CC[C@@H]3[C@H](C[C@H](Cn4cncn4)[N@H+]3CC3CC3)C2)c1C ZINC001164752682 720853017 /nfs/dbraw/zinc/85/30/17/720853017.db2.gz UGIGPAWMQOUFFJ-MQSCRBSSSA-N 1 1 444.587 3.126 20 0 IGADMO CC(C)c1noc(-c2ccnc(N3CC[C@@H]4[C@@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)c2)n1 ZINC001164751888 720853723 /nfs/dbraw/zinc/85/37/23/720853723.db2.gz RLOBLPGPLMYERA-PCCBWWKXSA-N 1 1 448.575 3.226 20 0 IGADMO Fc1ccc2c(c1)[nH]c1ncnc(N3CC[C@@H]4[C@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)c21 ZINC001164746212 720861092 /nfs/dbraw/zinc/86/10/92/720861092.db2.gz GMFWGWGROLKNLM-HGHGUNKESA-N 1 1 446.534 3.221 20 0 IGADMO COc1cnc(Cl)nc1N1CC[C@@]2(C1)C[N@@H+](CC1CC1)C[C@@H]2COCc1cccnc1 ZINC001164752408 720870913 /nfs/dbraw/zinc/87/09/13/720870913.db2.gz MWQBXGQZIFJRSJ-XXBNENTESA-N 1 1 443.979 3.289 20 0 IGADMO COCC[N@H+]1CCO[C@@H]2CN(c3nc4ccccc4nc3N3CCCC[C@@H]3C)CC[C@@H]2C1 ZINC001164855353 720875034 /nfs/dbraw/zinc/87/50/34/720875034.db2.gz HASOPPJCEJJRGE-MIZPHKNDSA-N 1 1 439.604 3.182 20 0 IGADMO COc1cnnc(Cl)c1N1CC[C@@]2(C1)C[N@@H+](CC1CC1)C[C@H]2COCc1cccnc1 ZINC001164757120 720888263 /nfs/dbraw/zinc/88/82/63/720888263.db2.gz SQDGKEGGOGBPQX-CVDCTZTESA-N 1 1 443.979 3.289 20 0 IGADMO COc1cnnc(Cl)c1N1CC[C@]2(C1)C[N@@H+](CC1CC1)C[C@H]2COCc1cccnc1 ZINC001164757121 720888462 /nfs/dbraw/zinc/88/84/62/720888462.db2.gz SQDGKEGGOGBPQX-WMZHIEFXSA-N 1 1 443.979 3.289 20 0 IGADMO COCC[N@H+]1CCO[C@@H]2CN(c3cnc(Cl)nc3Oc3ccc(C)cc3)CC[C@@H]2C1 ZINC001164853768 720888791 /nfs/dbraw/zinc/88/87/91/720888791.db2.gz CRINLIZFSYJSJJ-YLJYHZDGSA-N 1 1 432.952 3.404 20 0 IGADMO CC(=O)Nc1cccc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COCc2cccnc2)n1 ZINC001164756234 720889818 /nfs/dbraw/zinc/88/98/18/720889818.db2.gz ONMVXTNYKPAYKV-WIOPSUGQSA-N 1 1 435.572 3.190 20 0 IGADMO CC(C)Oc1cncc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COCc2cccnc2)n1 ZINC001164752823 720913952 /nfs/dbraw/zinc/91/39/52/720913952.db2.gz OZKYYUCDCWJDRZ-WIOPSUGQSA-N 1 1 437.588 3.414 20 0 IGADMO CSc1cncc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COCc2cccnc2)n1 ZINC001164755258 720922914 /nfs/dbraw/zinc/92/29/14/720922914.db2.gz ZZRIVSOUMQTPHB-NFBKMPQASA-N 1 1 425.602 3.349 20 0 IGADMO COc1nc(C)nc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COCc2cccnc2)c1C ZINC001164750143 720930812 /nfs/dbraw/zinc/93/08/12/720930812.db2.gz JJTSCNMWIJHWQB-DHLKQENFSA-N 1 1 437.588 3.252 20 0 IGADMO CC(C)[N@@H+](C)Cc1cnc2n1CCN(c1nc3ccsc3c(N3CCOCC3)n1)[C@@H]2C ZINC001164861736 720934151 /nfs/dbraw/zinc/93/41/51/720934151.db2.gz TYKYJAHTPOPNPW-MRXNPFEDSA-N 1 1 441.605 3.146 20 0 IGADMO CC(C)[N@@H+](C)Cc1cnc2n1CCN(C(F)(F)c1nc(Cl)cc(N(C)C)n1)[C@@H]2C ZINC001164859228 720935227 /nfs/dbraw/zinc/93/52/27/720935227.db2.gz LOJKTRGEADYQBV-CYBMUJFWSA-N 1 1 427.931 3.359 20 0 IGADMO COC(=O)c1nc(Cl)c(N2CCn3c(C[N@@H+](C)C(C)C)cnc3[C@@H]2C)c(Cl)n1 ZINC001164857321 721020666 /nfs/dbraw/zinc/02/06/66/721020666.db2.gz CUVKGUUBLSDWHN-NSHDSACASA-N 1 1 427.336 3.188 20 0 IGADMO Fc1ccc2nc(C(F)(F)N3CCc4[nH+]cc(Cn5cccn5)n4CC3)nc(Cl)c2c1 ZINC001164861071 721032847 /nfs/dbraw/zinc/03/28/47/721032847.db2.gz AGDFPTOBZZHQRT-UHFFFAOYSA-N 1 1 447.852 3.471 20 0 IGADMO O=C(NC1CCCCC1)c1cccnc1N1CC[N@H+]2C[C@@H](OCc3cccnc3)C[C@H]2C1 ZINC001164866219 721053319 /nfs/dbraw/zinc/05/33/19/721053319.db2.gz CVTOXZKWBMMVCV-VXKWHMMOSA-N 1 1 435.572 3.019 20 0 IGADMO FC(F)(c1nc(Cl)cc(Cl)n1)N1CC[N@H+]2C[C@H](OCc3cccnc3)C[C@@H]2C1 ZINC001164868021 721054383 /nfs/dbraw/zinc/05/43/83/721054383.db2.gz MBXXXJZPRYAICV-ZIAGYGMSSA-N 1 1 430.286 3.203 20 0 IGADMO Fc1cc2nc(Cl)c(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@H]4C3)nc2cc1F ZINC001164863766 721077615 /nfs/dbraw/zinc/07/76/15/721077615.db2.gz DEOVVUWGGFVFNR-GJZGRUSLSA-N 1 1 431.874 3.436 20 0 IGADMO CCOC(=O)c1cnc(Cl)c(N2C[C@@H]3CC[N@@H+](Cc4cnn(C)c4)C[C@@H]3C2)c1Cl ZINC001164768298 721098201 /nfs/dbraw/zinc/09/82/01/721098201.db2.gz MTIQFUPMFRMEKS-LSDHHAIUSA-N 1 1 438.359 3.257 20 0 IGADMO Clc1ccc(CN2CCCC2)c(N2CC[N@H+]3C[C@H](OCc4cccnc4)C[C@@H]3C2)n1 ZINC001164864578 721100901 /nfs/dbraw/zinc/10/09/01/721100901.db2.gz GMYPNAKCMGYSFW-NHCUHLMSSA-N 1 1 427.980 3.206 20 0 IGADMO CCOC(=O)c1cc2ccccc2nc1N1CC[N@H+]2C[C@H](OCc3cccnc3)C[C@@H]2C1 ZINC001164864392 721111517 /nfs/dbraw/zinc/11/15/17/721111517.db2.gz FSXRFSCVOKHTKO-NHCUHLMSSA-N 1 1 432.524 3.286 20 0 IGADMO CN(C)c1ccc(-c2ccnc(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@@H]4C3)n2)cc1 ZINC001164880718 721122701 /nfs/dbraw/zinc/12/27/01/721122701.db2.gz XFLHOJYQPBHHGL-DHIUTWEWSA-N 1 1 430.556 3.084 20 0 IGADMO CC(C)(C)c1noc(-c2ccnc(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@H]4C3)c2)n1 ZINC001164872051 721127771 /nfs/dbraw/zinc/12/77/71/721127771.db2.gz GEVUNCGEFFUETA-PMACEKPBSA-N 1 1 434.544 3.304 20 0 IGADMO COc1ccc(OC)c(-c2ccc(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@@H]4C3)nn2)c1 ZINC001164880367 721164726 /nfs/dbraw/zinc/16/47/26/721164726.db2.gz WAKRWJQOCWOBTE-CTNGQTDRSA-N 1 1 447.539 3.036 20 0 IGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4ccc(C(=O)OCc5ccccc5)cn4)C[C@@H]3C2)cn1 ZINC001164762538 721211175 /nfs/dbraw/zinc/21/11/75/721211175.db2.gz CRYWEGVCCFVROO-PKTZIBPZSA-N 1 1 431.540 3.130 20 0 IGADMO COc1ccc(Cc2c(C)nc(N3C[C@@H]4C[N@H+](Cc5cnn(C)c5)CC[C@@H]4C3)nc2C)cc1 ZINC001164763896 721235162 /nfs/dbraw/zinc/23/51/62/721235162.db2.gz NXABHXSIDUSKEM-PKTZIBPZSA-N 1 1 446.599 3.385 20 0 IGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2C[C@@H]3COC[C@H](C(=O)NCc4ccco4)[C@@H]3C2)nc1 ZINC001164763932 721257064 /nfs/dbraw/zinc/25/70/64/721257064.db2.gz OCNXPAXMQRKZLP-XBYSBRQOSA-N 1 1 438.572 3.237 20 0 IGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2C[C@@H]3OCC[C@H]3[C@@H](C(=O)NCc3cccnc3)C2)nc1 ZINC001164873370 721304790 /nfs/dbraw/zinc/30/47/90/721304790.db2.gz BEQDIDBHBXVLSE-XQUALCHDSA-N 1 1 449.599 3.181 20 0 IGADMO CN(C)C1=[NH+]OC2(C1)CCN(c1nc(Cl)nc3c1CN(Cc1ccccc1)C3)CC2 ZINC001164880790 721324961 /nfs/dbraw/zinc/32/49/61/721324961.db2.gz ZMDRXODOAPJAPQ-UHFFFAOYSA-N 1 1 426.952 3.280 20 0 IGADMO COC(=O)c1cnc(N2CCC[C@]3(C2)COCC[N@H+](Cc2c(C)noc2C)C3)c(Cl)c1 ZINC001164778029 721330221 /nfs/dbraw/zinc/33/02/21/721330221.db2.gz SWLUGWVMODUDGQ-QFIPXVFZSA-N 1 1 448.951 3.245 20 0 IGADMO COC(=O)c1cnc(N2CCC[C@]3(C2)COCC[N@@H+](Cc2c(C)noc2C)C3)c(Cl)c1 ZINC001164778029 721330224 /nfs/dbraw/zinc/33/02/24/721330224.db2.gz SWLUGWVMODUDGQ-QFIPXVFZSA-N 1 1 448.951 3.245 20 0 IGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@@]2(CCCN(c3ncc(C)c(N4CCCC4)n3)C2)C1 ZINC001164776996 721331080 /nfs/dbraw/zinc/33/10/80/721331080.db2.gz JQPILVMYJJKHKS-DEOSSOPVSA-N 1 1 440.592 3.109 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@@]2(CCCN(c3ncc(C)c(N4CCCC4)n3)C2)C1 ZINC001164776996 721331082 /nfs/dbraw/zinc/33/10/82/721331082.db2.gz JQPILVMYJJKHKS-DEOSSOPVSA-N 1 1 440.592 3.109 20 0 IGADMO COC(=O)c1ccc(Cl)nc1N1CCC[C@@]2(C1)COCC[N@H+](Cc1c(C)noc1C)C2 ZINC001164775835 721331849 /nfs/dbraw/zinc/33/18/49/721331849.db2.gz AIYIVPLUNYWKIC-JOCHJYFZSA-N 1 1 448.951 3.245 20 0 IGADMO COC(=O)c1ccc(Cl)nc1N1CCC[C@@]2(C1)COCC[N@@H+](Cc1c(C)noc1C)C2 ZINC001164775835 721331853 /nfs/dbraw/zinc/33/18/53/721331853.db2.gz AIYIVPLUNYWKIC-JOCHJYFZSA-N 1 1 448.951 3.245 20 0 IGADMO COc1c(Cl)nc(C)nc1N1CCC[C@@]2(C1)COCC[N@H+](Cc1c(C)noc1C)C2 ZINC001164779965 721350192 /nfs/dbraw/zinc/35/01/92/721350192.db2.gz XFMSOEVWZSNYNJ-OAQYLSRUSA-N 1 1 435.956 3.171 20 0 IGADMO COc1c(Cl)nc(C)nc1N1CCC[C@@]2(C1)COCC[N@@H+](Cc1c(C)noc1C)C2 ZINC001164779965 721350195 /nfs/dbraw/zinc/35/01/95/721350195.db2.gz XFMSOEVWZSNYNJ-OAQYLSRUSA-N 1 1 435.956 3.171 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@@]2(CCCN(c3ncnc4cccc(F)c43)C2)C1 ZINC001164779796 721353139 /nfs/dbraw/zinc/35/31/39/721353139.db2.gz WRVQLWYUTTWBAV-QHCPKHFHSA-N 1 1 425.508 3.493 20 0 IGADMO COc1nc(N2CCC[C@@]3(C2)COCC[N@H+](Cc2c(C)noc2C)C3)nc2ccccc21 ZINC001164778826 721354711 /nfs/dbraw/zinc/35/47/11/721354711.db2.gz OYYGOIMCUVBVJJ-XMMPIXPASA-N 1 1 437.544 3.362 20 0 IGADMO COc1nc(N2CCC[C@@]3(C2)COCC[N@@H+](Cc2c(C)noc2C)C3)nc2ccccc21 ZINC001164778826 721354717 /nfs/dbraw/zinc/35/47/17/721354717.db2.gz OYYGOIMCUVBVJJ-XMMPIXPASA-N 1 1 437.544 3.362 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@@]2(CCCN(c3ccc4ncc(F)cc4n3)C2)C1 ZINC001164784994 721362887 /nfs/dbraw/zinc/36/28/87/721362887.db2.gz RSPGQSHHJIDPQF-QHCPKHFHSA-N 1 1 425.508 3.493 20 0 IGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@]2(CCCN(c3cc(-c4ccncc4)ncn3)C2)C1 ZINC001164780077 721367209 /nfs/dbraw/zinc/36/72/09/721367209.db2.gz DAOZUHGCAAVVLH-XMMPIXPASA-N 1 1 434.544 3.262 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@]2(CCCN(c3cc(-c4ccncc4)ncn3)C2)C1 ZINC001164780077 721367212 /nfs/dbraw/zinc/36/72/12/721367212.db2.gz DAOZUHGCAAVVLH-XMMPIXPASA-N 1 1 434.544 3.262 20 0 IGADMO COc1ccc2nc(Cl)nc(N3CC[C@@]4(C3)CCC[C@@H](CN3CC[NH+](C)CC3)O4)c2c1 ZINC001164886723 721379744 /nfs/dbraw/zinc/37/97/44/721379744.db2.gz FYMXULOJAPPOCB-FDDCHVKYSA-N 1 1 445.995 3.057 20 0 IGADMO Cc1cc(C(F)(F)N2CC[C@@]3(C2)CCC[C@H](CN2CC[NH+](C)CC2)O3)cc(Cl)n1 ZINC001164894061 721384259 /nfs/dbraw/zinc/38/42/59/721384259.db2.gz XBBOZBIIUKMSAS-UYAOXDASSA-N 1 1 428.955 3.354 20 0 IGADMO CSc1nc2sccc2c(N2CC[C@@]3(C2)CCC[C@@H](CN2CC[NH+](C)CC2)O3)n1 ZINC001164888062 721387856 /nfs/dbraw/zinc/38/78/56/721387856.db2.gz JFFCYHSGOZOQPC-HRAATJIYSA-N 1 1 433.647 3.179 20 0 IGADMO c1csc(C[NH+]2C[C@@H]3CN(c4ncnc5c4CCN(Cc4ccccc4)C5)C[C@H]3C2)n1 ZINC001164790757 721406611 /nfs/dbraw/zinc/40/66/11/721406611.db2.gz XXKGSOCSHZSLIY-WOJBJXKFSA-N 1 1 432.597 3.060 20 0 IGADMO COc1ccc(C(F)(F)N2CC[C@@]3(C2)CCC[C@@H](CN2CC[NH+](C)CC2)O3)c(Cl)n1 ZINC001164885773 721408705 /nfs/dbraw/zinc/40/87/05/721408705.db2.gz HHWZJEGVLBSIPI-OXJNMPFZSA-N 1 1 444.954 3.054 20 0 IGADMO COc1ccc(C(F)(F)N2CC[C@]3(C2)CCC[C@@H](CN2CC[NH+](C)CC2)O3)c(Cl)n1 ZINC001164885771 721408919 /nfs/dbraw/zinc/40/89/19/721408919.db2.gz HHWZJEGVLBSIPI-JXFKEZNVSA-N 1 1 444.954 3.054 20 0 IGADMO C[NH+]1CCN(C[C@H]2CCC[C@]3(CCN(C(F)(F)c4cc(Cl)ncc4F)C3)O2)CC1 ZINC001164886672 721410588 /nfs/dbraw/zinc/41/05/88/721410588.db2.gz KSMBAAUTEZJEGP-DNVCBOLYSA-N 1 1 432.918 3.184 20 0 IGADMO CCOC(Cc1c(Cl)ncnc1N1C[C@@H]2C[N@@H+](Cc3nccs3)C[C@@H]2C1)OCC ZINC001164780575 721410756 /nfs/dbraw/zinc/41/07/56/721410756.db2.gz BGADPTKXJVGXSB-GASCZTMLSA-N 1 1 437.997 3.096 20 0 IGADMO CCOC(Cc1c(Cl)ncnc1N1C[C@@H]2C[N@H+](Cc3nccs3)C[C@@H]2C1)OCC ZINC001164780575 721410758 /nfs/dbraw/zinc/41/07/58/721410758.db2.gz BGADPTKXJVGXSB-GASCZTMLSA-N 1 1 437.997 3.096 20 0 IGADMO COc1cc2nc(Cl)c(N3C[C@@H]4C[N@@H+](Cc5nccs5)C[C@@H]4C3)nc2cc1OC ZINC001164781204 721411747 /nfs/dbraw/zinc/41/17/47/721411747.db2.gz CYXFVUSBSVWVIS-BETUJISGSA-N 1 1 431.949 3.325 20 0 IGADMO COc1cc2nc(Cl)c(N3C[C@@H]4C[N@H+](Cc5nccs5)C[C@@H]4C3)nc2cc1OC ZINC001164781204 721411749 /nfs/dbraw/zinc/41/17/49/721411749.db2.gz CYXFVUSBSVWVIS-BETUJISGSA-N 1 1 431.949 3.325 20 0 IGADMO Cc1nc2cc(Cl)ccc2c(N2CC[C@@]3(C2)CCC[C@H](CN2CC[NH+](C)CC2)O3)n1 ZINC001164890506 721412941 /nfs/dbraw/zinc/41/29/41/721412941.db2.gz SWLLTMZZFOVORN-AUSIDOKSSA-N 1 1 429.996 3.357 20 0 IGADMO Cc1nc(C(F)(F)N2CC[C@@]3(C2)CCC[C@@H](CN2CC[NH+](C)CC2)O3)nc(Cl)c1C ZINC001164883889 721421526 /nfs/dbraw/zinc/42/15/26/721421526.db2.gz CKGCDUDYJCLBDA-FXAWDEMLSA-N 1 1 443.970 3.057 20 0 IGADMO C[NH+]1CCN(C[C@H]2CCC[C@@]3(CCN(c4ccc(-c5ccc(F)cc5)nn4)C3)O2)CC1 ZINC001164896069 721438818 /nfs/dbraw/zinc/43/88/18/721438818.db2.gz QKCLAVVXOXNOAG-QPPBQGQZSA-N 1 1 425.552 3.048 20 0 IGADMO CCc1nc(Cl)c(N2CC[C@]3(C2)CCC[C@H](CN2CC[NH+](C)CC2)O3)c(Cl)n1 ZINC001164895842 721439522 /nfs/dbraw/zinc/43/95/22/721439522.db2.gz QGWUWAWCVLDCFH-QRWLVFNGSA-N 1 1 428.408 3.111 20 0 IGADMO C[NH+]1CCN(C[C@H]2CCC[C@@]3(CCN(c4nc(C(F)F)nc5ccccc54)C3)O2)CC1 ZINC001164893015 721439827 /nfs/dbraw/zinc/43/98/27/721439827.db2.gz IQSBURAHFNOYAS-HXOBKFHXSA-N 1 1 431.531 3.333 20 0 IGADMO Cc1cc(N2CC[C@@]3(C2)CCC[C@H](CN2CC[NH+](C)CC2)O3)nc(-c2ccsc2)n1 ZINC001164899492 721440528 /nfs/dbraw/zinc/44/05/28/721440528.db2.gz YRDRFQLUBSGTQM-NFBKMPQASA-N 1 1 427.618 3.279 20 0 IGADMO Cc1c(Cl)nc(CC(C)C)nc1N1CC[C@]2(C1)CCC[C@@H](CN1CC[NH+](C)CC1)O2 ZINC001164896178 721446186 /nfs/dbraw/zinc/44/61/86/721446186.db2.gz QTXBWZYEIQAMNG-CVDCTZTESA-N 1 1 436.044 3.402 20 0 IGADMO Cc1cc(-c2ccccc2F)nnc1N1CC[C@]2(C1)CCC[C@H](CN1CC[NH+](C)CC1)O2 ZINC001164891330 721446939 /nfs/dbraw/zinc/44/69/39/721446939.db2.gz UILCLGJUKAKKHB-NLFFAJNJSA-N 1 1 439.579 3.357 20 0 IGADMO Cc1cc(-c2cccc(F)c2)nnc1N1CC[C@@]2(C1)CCC[C@H](CN1CC[NH+](C)CC1)O2 ZINC001164886567 721447052 /nfs/dbraw/zinc/44/70/52/721447052.db2.gz HHHVJGYZQMRJSG-RCZVLFRGSA-N 1 1 439.579 3.357 20 0 IGADMO CSc1ccc2ncnc(N3CC[C@@]4(C3)CCC[C@H](CN3CC[NH+](C)CC3)O4)c2c1 ZINC001164886528 721447083 /nfs/dbraw/zinc/44/70/83/721447083.db2.gz GYJSWKWUEBLNJP-WZONZLPQSA-N 1 1 427.618 3.117 20 0 IGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1nc(Cl)nc3ncccc31)CC2 ZINC001164785948 721453503 /nfs/dbraw/zinc/45/35/03/721453503.db2.gz JXRYRPLTZBPZKD-GOSISDBHSA-N 1 1 445.995 3.412 20 0 IGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1nc(Cl)nc3cccnc31)CC2 ZINC001164790559 721454406 /nfs/dbraw/zinc/45/44/06/721454406.db2.gz ZENWMENNDCLGFG-SFHVURJKSA-N 1 1 445.995 3.412 20 0 IGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1nc(Cl)nc3c1ccn3C)CC2 ZINC001164786378 721455867 /nfs/dbraw/zinc/45/58/67/721455867.db2.gz MGUPSTPMIHOPPP-SFHVURJKSA-N 1 1 448.011 3.356 20 0 IGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1c(C)nc(Cl)nc1OC)CC2 ZINC001164784477 721459859 /nfs/dbraw/zinc/45/98/59/721459859.db2.gz IISSZCQWQPLFIL-GOSISDBHSA-N 1 1 439.000 3.181 20 0 IGADMO Fc1cccnc1OC[C@]12COC[C@@H]1CN(c1nc(Cl)ccc1C[NH+]1CCCC1)C2 ZINC001164793358 721486886 /nfs/dbraw/zinc/48/68/86/721486886.db2.gz QTMYMBNQYNJZKU-JTSKRJEESA-N 1 1 432.927 3.397 20 0 IGADMO CCOC(=O)c1c[n-]c2nc[nH+]c(N3CCC4(CC([N@@H+](C)Cc5ccncc5)C4)CC3)c12 ZINC001164793373 721491861 /nfs/dbraw/zinc/49/18/61/721491861.db2.gz QXLMSHAIDQCKHX-UHFFFAOYSA-N 1 1 434.544 3.411 20 0 IGADMO CCOC(=O)c1c[nH]c2ncnc(N3CCC4(CC([N@H+](C)Cc5ccncc5)C4)CC3)c12 ZINC001164793373 721491866 /nfs/dbraw/zinc/49/18/66/721491866.db2.gz QXLMSHAIDQCKHX-UHFFFAOYSA-N 1 1 434.544 3.411 20 0 IGADMO CCOC(=O)c1c[nH]c2ncnc(N3CCC4(CC([N@@H+](C)Cc5ccncc5)C4)CC3)c12 ZINC001164793373 721491869 /nfs/dbraw/zinc/49/18/69/721491869.db2.gz QXLMSHAIDQCKHX-UHFFFAOYSA-N 1 1 434.544 3.411 20 0 IGADMO COC(OC)c1c(CO)ccnc1N1CCC2(CC([N@@H+](C)Cc3ccncc3)C2)CC1 ZINC001164795017 721498552 /nfs/dbraw/zinc/49/85/52/721498552.db2.gz ANJVVUAJZWRRTF-UHFFFAOYSA-N 1 1 426.561 3.141 20 0 IGADMO CCOC(=O)c1nc2ccccc2c(N2C[C@H]([N@H+](C)Cc3cccnc3)[C@H]3OCCC[C@@H]32)n1 ZINC001164811179 721531992 /nfs/dbraw/zinc/53/19/92/721531992.db2.gz ZFOIWVLOUPMTAQ-FKBYEOEOSA-N 1 1 447.539 3.070 20 0 IGADMO CCOC(=O)c1nc2ccccc2c(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@H]3OCCC[C@@H]32)n1 ZINC001164811179 721531996 /nfs/dbraw/zinc/53/19/96/721531996.db2.gz ZFOIWVLOUPMTAQ-FKBYEOEOSA-N 1 1 447.539 3.070 20 0 IGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2nnc(Cl)cc2-c2ccncc2)[C@H]2CCCO[C@@H]12 ZINC001164807803 721534576 /nfs/dbraw/zinc/53/45/76/721534576.db2.gz RJFACWKGVZZSSE-TUNNFDKTSA-N 1 1 436.947 3.455 20 0 IGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2nnc(Cl)cc2-c2ccncc2)[C@H]2CCCO[C@@H]12 ZINC001164807803 721534579 /nfs/dbraw/zinc/53/45/79/721534579.db2.gz RJFACWKGVZZSSE-TUNNFDKTSA-N 1 1 436.947 3.455 20 0 IGADMO COC(=O)c1ccc2c(ccnc2N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@H]32)c1 ZINC001164806648 721547903 /nfs/dbraw/zinc/54/79/03/721547903.db2.gz PPKMAKVOXOOVRH-XPWALMASSA-N 1 1 432.524 3.285 20 0 IGADMO COC(=O)c1ccc2nc(N3C[C@H]([N@@H+](C)Cc4cccnc4)[C@H]4OCCC[C@H]43)ccc2c1 ZINC001164804589 721548420 /nfs/dbraw/zinc/54/84/20/721548420.db2.gz KOPFAIJVRONYSN-GPXNEJASSA-N 1 1 432.524 3.285 20 0 IGADMO CN(C)c1cc(C(F)(F)N2CC[N@H+]3C[C@@H](Oc4cccc(F)c4)C[C@H]3C2)nc(Cl)n1 ZINC001164904243 721564823 /nfs/dbraw/zinc/56/48/23/721564823.db2.gz DOCVIWQNWDUYHD-HOCLYGCPSA-N 1 1 441.885 3.222 20 0 IGADMO COc1ccccc1-c1ccc(N2C[C@H]([N@H+](C)Cc3cccnc3)[C@H]3OCCC[C@H]32)nn1 ZINC001164808941 721578689 /nfs/dbraw/zinc/57/86/89/721578689.db2.gz RVKCMTDUHRVIII-SLSDLSHTSA-N 1 1 431.540 3.415 20 0 IGADMO COc1ccccc1-c1ccc(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@H]3OCCC[C@H]32)nn1 ZINC001164808941 721578693 /nfs/dbraw/zinc/57/86/93/721578693.db2.gz RVKCMTDUHRVIII-SLSDLSHTSA-N 1 1 431.540 3.415 20 0 IGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(C(F)(F)c2c3c(nnc2Cl)CCC3)[C@@H]2CCCO[C@@H]12 ZINC001164807649 721580479 /nfs/dbraw/zinc/58/04/79/721580479.db2.gz PBSUMZRQPUKOEA-QWFCFKBJSA-N 1 1 449.933 3.427 20 0 IGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(C(F)(F)c2c3c(nnc2Cl)CCC3)[C@@H]2CCCO[C@@H]12 ZINC001164807649 721580483 /nfs/dbraw/zinc/58/04/83/721580483.db2.gz PBSUMZRQPUKOEA-QWFCFKBJSA-N 1 1 449.933 3.427 20 0 IGADMO Cc1nc(-c2ccccn2)nc(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@H]32)c1C ZINC001164802573 721585069 /nfs/dbraw/zinc/58/50/69/721585069.db2.gz GMKVJAPKSYFLDR-XPWALMASSA-N 1 1 430.556 3.419 20 0 IGADMO Cc1cccc(CN2CCO[C@H]3C[N@@H+](C(C)(C)c4ccnc(Cl)c4)CC[C@@H]3C2=O)n1 ZINC001164798876 721603443 /nfs/dbraw/zinc/60/34/43/721603443.db2.gz JKRSLDXIIFLCKI-PMACEKPBSA-N 1 1 428.964 3.423 20 0 IGADMO Cc1cccc(CN2CCO[C@H]3C[N@H+](C(C)(C)c4ccnc(Cl)c4)CC[C@@H]3C2=O)n1 ZINC001164798876 721603444 /nfs/dbraw/zinc/60/34/44/721603444.db2.gz JKRSLDXIIFLCKI-PMACEKPBSA-N 1 1 428.964 3.423 20 0 IGADMO Cc1nc2nc(Cl)nc(N3CCC(F)(F)[C@]4(CC[N@@H+](Cc5ccccn5)C4)C3)c2[nH]1 ZINC001164907403 721696429 /nfs/dbraw/zinc/69/64/29/721696429.db2.gz SGMWBYIRQKXUHH-IBGZPJMESA-N 1 1 433.894 3.447 20 0 IGADMO COCCn1ccc2c1ncnc2N1CCC(F)(F)[C@]2(CC[N@@H+](Cc3ccccn3)C2)C1 ZINC001164906011 721708848 /nfs/dbraw/zinc/70/88/48/721708848.db2.gz JFRUKHUOZCCXTL-QFIPXVFZSA-N 1 1 442.514 3.210 20 0 IGADMO O=C1NCc2c1cc(Cl)nc2N1CCC(F)(F)[C@]2(CC[N@@H+](Cc3ccccn3)C2)C1 ZINC001164906081 721712334 /nfs/dbraw/zinc/71/23/34/721712334.db2.gz JSCUMFOCLKCQQW-FQEVSTJZSA-N 1 1 433.890 3.111 20 0 IGADMO F[C@@H](Oc1ccc(Cl)nn1)N1CCC(F)(F)[C@]2(CC[N@@H+](Cc3ccccn3)C2)C1 ZINC001164910509 721738860 /nfs/dbraw/zinc/73/88/60/721738860.db2.gz FPPFHZZBKICEPP-MSOLQXFVSA-N 1 1 427.858 3.390 20 0 IGADMO CN(C)C(=O)C[NH+]1CCC2(CCCN2C(F)(F)c2nc3ccccc3nc2Cl)CC1 ZINC001165010448 721740570 /nfs/dbraw/zinc/74/05/70/721740570.db2.gz MMXLEBQGIDGSDS-UHFFFAOYSA-N 1 1 437.922 3.351 20 0 IGADMO CN(C)C(=O)C[NH+]1CCC2(CCCN2C(F)(F)Oc2cc(Cl)nc(Cl)c2)CC1 ZINC001165013115 721749437 /nfs/dbraw/zinc/74/94/37/721749437.db2.gz UUWQWECCFCLWOJ-UHFFFAOYSA-N 1 1 437.318 3.336 20 0 IGADMO COC(=O)c1nc(Cl)cnc1N1CCc2c(C[N@H+](C)Cc3ccco3)cncc2C1 ZINC001164908970 721755662 /nfs/dbraw/zinc/75/56/62/721755662.db2.gz AOWCEYDQXJCYBY-UHFFFAOYSA-N 1 1 427.892 3.099 20 0 IGADMO COC(=O)c1nc(Cl)cnc1N1CCc2c(C[N@@H+](C)Cc3ccco3)cncc2C1 ZINC001164908970 721755665 /nfs/dbraw/zinc/75/56/65/721755665.db2.gz AOWCEYDQXJCYBY-UHFFFAOYSA-N 1 1 427.892 3.099 20 0 IGADMO Clc1cc(N2CCO[C@@]3(C2)COCC[N@H+](Cc2cccnc2)C3)c2sccc2n1 ZINC001164911975 721778329 /nfs/dbraw/zinc/77/83/29/721778329.db2.gz IYUXSNJBPIKRFL-NRFANRHFSA-N 1 1 430.961 3.453 20 0 IGADMO Clc1cc(N2CCO[C@@]3(C2)COCC[N@@H+](Cc2cccnc2)C3)c2sccc2n1 ZINC001164911975 721778331 /nfs/dbraw/zinc/77/83/31/721778331.db2.gz IYUXSNJBPIKRFL-NRFANRHFSA-N 1 1 430.961 3.453 20 0 IGADMO O=C1N(c2cncnc2)CC[C@]12CCCN(c1nc(Cl)ccc1C[NH+]1CCCC1)C2 ZINC001165016962 721784504 /nfs/dbraw/zinc/78/45/04/721784504.db2.gz FSMMPMOUEDHICD-QFIPXVFZSA-N 1 1 426.952 3.144 20 0 IGADMO CCC[N@H+]1CCCC[C@H]1c1ccc(N2CCOC[C@]3(CN(C(=O)C(C)C)CCO3)C2)nc1 ZINC001165025675 721788149 /nfs/dbraw/zinc/78/81/49/721788149.db2.gz WGSSCQZWAVIDCV-WIOPSUGQSA-N 1 1 444.620 3.109 20 0 IGADMO COC(=O)c1cc2c(OC)[nH]c(N3C[C@@H]4CCC[C@@H]([N@@H+](C)Cc5ccccn5)[C@H]4C3)cc-2n1 ZINC001165027087 721811210 /nfs/dbraw/zinc/81/12/10/721811210.db2.gz SARAZBPAYUIDJS-XWFZLUIHSA-N 1 1 449.555 3.490 20 0 IGADMO CCc1cc(N2C[C@@H]3CCC[C@H]([N@H+](C)Cc4ccccn4)[C@H]3C2)nc(N2CCOCC2)n1 ZINC001165025348 721818087 /nfs/dbraw/zinc/81/80/87/721818087.db2.gz MRYDJIVJBJAURT-VJBMBRPKSA-N 1 1 436.604 3.008 20 0 IGADMO CCc1cc(N2C[C@@H]3CCC[C@H]([N@@H+](C)Cc4ccccn4)[C@H]3C2)nc(N2CCOCC2)n1 ZINC001165025348 721818089 /nfs/dbraw/zinc/81/80/89/721818089.db2.gz MRYDJIVJBJAURT-VJBMBRPKSA-N 1 1 436.604 3.008 20 0 IGADMO C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@@H]2CN(c3ccc(C(=O)NC4CCCC4)nn3)C[C@@H]21 ZINC001165023126 721827016 /nfs/dbraw/zinc/82/70/16/721827016.db2.gz HSJDWKKMXIHFMT-RZFNWQHOSA-N 1 1 434.588 3.281 20 0 IGADMO COc1cc(N2CCO[C@]3(C2)COCCN(Cc2csc(C)n2)C3)[nH+]c2ccccc21 ZINC001164921174 721830366 /nfs/dbraw/zinc/83/03/66/721830366.db2.gz IRKNCHSPYYVWKL-HSZRJFAPSA-N 1 1 440.569 3.116 20 0 IGADMO C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@@H]2CN(c3nc(Cl)cc(O[C@H]4CCOC4)n3)C[C@@H]21 ZINC001165025204 721831418 /nfs/dbraw/zinc/83/14/18/721831418.db2.gz MFPKKAZHAASVBV-BTHPGYMESA-N 1 1 443.979 3.430 20 0 IGADMO c1cnn(Cc2ncn3c2CN(c2ccc4c(n2)CC[N@H+](Cc2ccccc2)C4)CCC3)c1 ZINC001164937547 721915246 /nfs/dbraw/zinc/91/52/46/721915246.db2.gz OLBJHDYFQFSJIS-UHFFFAOYSA-N 1 1 439.567 3.492 20 0 IGADMO COCCn1ccc2c1ncnc2N1CCC2(CC1)C[N@@H+](Cc1ccc(C)cc1)CCO2 ZINC001164940916 721927222 /nfs/dbraw/zinc/92/72/22/721927222.db2.gz WNCVEGWSTZRBQO-UHFFFAOYSA-N 1 1 435.572 3.258 20 0 IGADMO COCCOC(=O)c1ccnc(N2CCC3(CC2)C[N@@H+](Cc2ccc(C)cc2)CCO3)c1 ZINC001164945267 721933234 /nfs/dbraw/zinc/93/32/34/721933234.db2.gz VLCRVBNDEHNJNK-UHFFFAOYSA-N 1 1 439.556 3.065 20 0 IGADMO CCOC(=O)c1cnc(SC)nc1N1CCC2(CC[N@@H+](Cc3cccnc3)C2)CC1 ZINC001164952753 722012577 /nfs/dbraw/zinc/01/25/77/722012577.db2.gz BBSJEGQPSQPSDE-UHFFFAOYSA-N 1 1 427.574 3.263 20 0 IGADMO FC(F)(c1nc2[nH]cnc2c(Cl)n1)N1CCC2(CC[N@@H+](Cc3cccnc3)C2)CC1 ZINC001164955493 722022345 /nfs/dbraw/zinc/02/23/45/722022345.db2.gz JIPXIOZVFYOCNJ-UHFFFAOYSA-N 1 1 433.894 3.390 20 0 IGADMO CCCNC(=O)c1cc(Cl)nc(N2CCC3(CC[N@@H+](Cc4cccnc4)C3)CC2)n1 ZINC001164963972 722025074 /nfs/dbraw/zinc/02/50/74/722025074.db2.gz UWMCRXCXUUOUEB-UHFFFAOYSA-N 1 1 428.968 3.157 20 0 IGADMO COC(=O)c1c(Cl)ccnc1N1CCC2(CC1)COCC[N@@H+](Cc1ccncc1)C2 ZINC001164961953 722052771 /nfs/dbraw/zinc/05/27/71/722052771.db2.gz ZRQQHSCYAHJKJI-UHFFFAOYSA-N 1 1 430.936 3.036 20 0 IGADMO Fc1cccc(-c2ncnc(N3CCC4(CC3)COCC[N@@H+](Cc3ccncc3)C4)n2)c1 ZINC001164960741 722060207 /nfs/dbraw/zinc/06/02/07/722060207.db2.gz KGTFETUJWYCACI-UHFFFAOYSA-N 1 1 434.519 3.192 20 0 IGADMO Cc1nc(-c2ccncc2)cc(N2CCC3(CC2)COCC[N@@H+](Cc2ccncc2)C3)n1 ZINC001164962516 722060517 /nfs/dbraw/zinc/06/05/17/722060517.db2.gz SXWOUEPWFFWBON-UHFFFAOYSA-N 1 1 430.556 3.361 20 0 IGADMO CCOC(=O)c1cc(Cl)nc(N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)c1 ZINC001164982847 722099460 /nfs/dbraw/zinc/09/94/60/722099460.db2.gz PJVARSORUXQIKZ-PKOBYXMFSA-N 1 1 430.936 3.034 20 0 IGADMO O=C(Nc1ccccc1)c1ccnc(N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)c1 ZINC001164979780 722120159 /nfs/dbraw/zinc/12/01/59/722120159.db2.gz PYAGGKIQONQCRN-ISKFKSNPSA-N 1 1 443.551 3.456 20 0 IGADMO COc1cccc2nc(Cl)nc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)c21 ZINC001164972439 722123138 /nfs/dbraw/zinc/12/31/38/722123138.db2.gz FJQPCRMFCWBHHD-FXAWDEMLSA-N 1 1 439.947 3.414 20 0 IGADMO COC(=O)c1ccc2cc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)ncc2c1 ZINC001164984601 722136995 /nfs/dbraw/zinc/13/69/95/722136995.db2.gz XNLBGVYARAMAHL-GMAHTHKFSA-N 1 1 432.524 3.144 20 0 IGADMO COc1ccccc1-c1cc(N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)ncn1 ZINC001164980883 722144868 /nfs/dbraw/zinc/14/48/68/722144868.db2.gz NHPJZEXDYSHTPV-GBXCKJPGSA-N 1 1 431.540 3.275 20 0 IGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(-n2c([C@H]3COCCN3)nccc2=NCc2ccco2)nc1 ZINC001164987855 722173116 /nfs/dbraw/zinc/17/31/16/722173116.db2.gz OZRSTGCGYAMDNT-FGZHOGPDSA-N 1 1 448.571 3.169 20 0 IGADMO Cc1nc(CN2CCO[C@H]3CCN(c4nc(N5CCCCC5)cc[nH+]4)CC[C@H]32)cs1 ZINC001164987157 722184034 /nfs/dbraw/zinc/18/40/34/722184034.db2.gz GWLHHMBEZOUECV-UXHICEINSA-N 1 1 428.606 3.102 20 0 IGADMO COC(=O)c1ccc(N2CCC[C@]3(CC[N@H+]3Cc3cccc(F)c3)C2)nc1C(=O)OC ZINC001164993990 722193514 /nfs/dbraw/zinc/19/35/14/722193514.db2.gz KIOYXBMHIGFYNK-QHCPKHFHSA-N 1 1 427.476 3.039 20 0 IGADMO COc1cnc(N2CCc3ncnc(N4CC[NH+](C)CC4)c3CC2)c2cc(Cl)ccc12 ZINC001164996724 722233661 /nfs/dbraw/zinc/23/36/61/722233661.db2.gz IKUWBUAXPSBIAN-UHFFFAOYSA-N 1 1 438.963 3.044 20 0 IGADMO C[NH+]1CCN(c2ncnc3c2CCN(c2c(Cl)ccc4c(Cl)ncnc42)CC3)CC1 ZINC001165006358 722240181 /nfs/dbraw/zinc/24/01/81/722240181.db2.gz YGEKQIRLSIKHTF-UHFFFAOYSA-N 1 1 444.370 3.084 20 0 IGADMO O=C(c1ccco1)N1CCC[C@@]2(C1)CN(c1nc(Cl)ccc1C[NH+]1CCCC1)CCO2 ZINC001165000187 722249269 /nfs/dbraw/zinc/24/92/69/722249269.db2.gz FONUXAISGQRUJM-QHCPKHFHSA-N 1 1 444.963 3.435 20 0 IGADMO CC(C)C[C@H](CNC(=O)c1cn(-c2ccccc2)nc1-c1cccnc1)[NH+]1CCOCC1 ZINC000022898118 519351291 /nfs/dbraw/zinc/35/12/91/519351291.db2.gz NGBQWQUZPOYNJY-JOCHJYFZSA-N 1 1 433.556 3.411 20 0 IGADMO O=C1COC2(C1)CCN(c1nc(C[NH+]3CCCCC3)nc3sc4c(c31)CCC4)CC2 ZINC001164389070 718827662 /nfs/dbraw/zinc/82/76/62/718827662.db2.gz GNNYXADVNQXLIY-UHFFFAOYSA-N 1 1 426.586 3.494 20 0 IGADMO O=C1COC2(C1)CCN(c1nc(C[NH+]3CCCC3)nc3sc4c(c31)CCCC4)CC2 ZINC001164390788 718827865 /nfs/dbraw/zinc/82/78/65/718827865.db2.gz QYBFSVYDXORTJJ-UHFFFAOYSA-N 1 1 426.586 3.494 20 0 IGADMO O=C(c1cnc(N2CCC[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)c(Cl)c1)N1CCOCC1 ZINC001164629592 719099241 /nfs/dbraw/zinc/09/92/41/719099241.db2.gz STZUSANDUXOYBE-SIKLNZKXSA-N 1 1 440.975 3.308 20 0 IGADMO CC(C)n1nc(C[NH+](C)C)c2c1CN([C@](F)(COc1cncc(Cl)n1)C(F)F)CC2 ZINC001164651272 719315861 /nfs/dbraw/zinc/31/58/61/719315861.db2.gz ISWRDJNIDHZPFT-LJQANCHMSA-N 1 1 446.905 3.337 20 0 IGADMO CCN1CCn2c(-c3ccccc3)cnc2C12CCN(c1[nH+]ccc3c1NC(=O)CO3)CC2 ZINC001164658998 719350592 /nfs/dbraw/zinc/35/05/92/719350592.db2.gz PEXDJPHCOPOWAG-UHFFFAOYSA-N 1 1 444.539 3.107 20 0 IGADMO COC(=O)[C@@]1(C)C[C@H]([NH+]2CCOCC2)CCN1c1cc(Cl)nc2cc(OC)ccc21 ZINC001164701999 719853516 /nfs/dbraw/zinc/85/35/16/719853516.db2.gz MJJXWSCDKGDLOY-IVZQSRNASA-N 1 1 433.936 3.130 20 0 IGADMO CCOC(=O)c1ncnc(Cl)c1N1CCC2(CC1)C[N@H+](Cc1cccs1)CCO2 ZINC001164699301 719896892 /nfs/dbraw/zinc/89/68/92/719896892.db2.gz ZLGTZJVTOXFSES-UHFFFAOYSA-N 1 1 436.965 3.240 20 0 IGADMO CCOC(=O)c1ncnc(Cl)c1N1CCC2(CC1)C[N@@H+](Cc1cccs1)CCO2 ZINC001164699301 719896893 /nfs/dbraw/zinc/89/68/93/719896893.db2.gz ZLGTZJVTOXFSES-UHFFFAOYSA-N 1 1 436.965 3.240 20 0 IGADMO O=C(NC1CCCC1)c1ccc(N2CCC3(CC2)C[N@@H+](Cc2cccs2)CCO3)nn1 ZINC001164707491 719901577 /nfs/dbraw/zinc/90/15/77/719901577.db2.gz RLLQZOFJADMILK-UHFFFAOYSA-N 1 1 441.601 3.082 20 0 IGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2CCOC[C@@]3(CC[C@@H](Cn4cccn4)O3)C2)nc1 ZINC001164804531 720051734 /nfs/dbraw/zinc/05/17/34/720051734.db2.gz LLXHHQOMDYWQAK-WMTXJRDZSA-N 1 1 425.577 3.280 20 0 IGADMO CCOC(=O)c1sc2ncnc(N3CC[C@@]4(C3)C[N@@H+](CC3CC3)C[C@H]4COC)c2c1C ZINC001164806435 720069287 /nfs/dbraw/zinc/06/92/87/720069287.db2.gz CSUPREQOMKIWHF-SBUREZEXSA-N 1 1 444.601 3.361 20 0 IGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1ncccc1C(=O)NCc1ccccc1)C2 ZINC001164808453 720079151 /nfs/dbraw/zinc/07/91/51/720079151.db2.gz HKSJWVIZDICBAU-ATIYNZHBSA-N 1 1 434.584 3.196 20 0 IGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(C(F)(F)c1ccc(C(=O)OC)c(Cl)n1)C2 ZINC001164813074 720091582 /nfs/dbraw/zinc/09/15/82/720091582.db2.gz SDKYRFXAKYIHJY-MGPUTAFESA-N 1 1 443.922 3.251 20 0 IGADMO COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1cc(C(=O)OC)cc(Cl)n1)CC2 ZINC001164711514 720098443 /nfs/dbraw/zinc/09/84/43/720098443.db2.gz QGRNHTSTNIBKAO-LJQANCHMSA-N 1 1 444.963 3.424 20 0 IGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1nc3cc(OC)c(OC)cc3nc1Cl)C2 ZINC001164813866 720120799 /nfs/dbraw/zinc/12/07/99/720120799.db2.gz RJANTIGZXCVRJH-MWTRTKDXSA-N 1 1 446.979 3.485 20 0 IGADMO CCOc1c(Cl)ncnc1N1CCC2(C[C@@H](COC)[N@@H+](Cc3ccccn3)C2)CC1 ZINC001164716880 720121196 /nfs/dbraw/zinc/12/11/96/720121196.db2.gz LEAIKSVBTGZANF-SFHVURJKSA-N 1 1 431.968 3.431 20 0 IGADMO COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1ncc3ncn(C(C)C)c3n1)CC2 ZINC001164713944 720143247 /nfs/dbraw/zinc/14/32/47/720143247.db2.gz UGWXVNTUCPXVLQ-FQEVSTJZSA-N 1 1 435.576 3.310 20 0 IGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(C(F)(F)c1cnc3c(Cl)ncnc3c1)C2 ZINC001164818009 720153141 /nfs/dbraw/zinc/15/31/41/720153141.db2.gz REPNNYZTXQZADO-OXJNMPFZSA-N 1 1 437.922 3.408 20 0 IGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1cc([C@H](CC(=O)OC)C3CC3)ccn1)C2 ZINC001164817886 720157962 /nfs/dbraw/zinc/15/79/62/720157962.db2.gz QQYPQMRSSNGWGR-FBLLAGFSSA-N 1 1 427.589 3.323 20 0 IGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1cc(C)nc(NC(=O)c3ccccc3)n1)C2 ZINC001164818401 720188467 /nfs/dbraw/zinc/18/84/67/720188467.db2.gz SLYXDXDXLZWPRP-SQJMNOBHSA-N 1 1 435.572 3.222 20 0 IGADMO CC(C)[N@@H+](C)Cc1cc(=O)n2c(n1)CN(c1ncnc3c1ccn3C1CCCC1)CCC2 ZINC001164814735 720225837 /nfs/dbraw/zinc/22/58/37/720225837.db2.gz XHTFBJNHNKIWGS-UHFFFAOYSA-N 1 1 435.576 3.354 20 0 IGADMO CC(C)[N@@H+](C)Cc1cc(=O)n2c(n1)CN(c1cccc(OCc3ccccc3)n1)CCC2 ZINC001164812340 720230776 /nfs/dbraw/zinc/23/07/76/720230776.db2.gz FXDDJRLNDLMMPE-UHFFFAOYSA-N 1 1 433.556 3.468 20 0 IGADMO CC(C)[N@@H+](C)Cc1cc(=O)n2c(n1)CN(c1ccc(-c3c(F)cccc3F)nn1)CCC2 ZINC001164811869 720239884 /nfs/dbraw/zinc/23/98/84/720239884.db2.gz AGUGQNIEMTVONR-UHFFFAOYSA-N 1 1 440.498 3.229 20 0 IGADMO CNC(=O)C[N@@H+]1CCOC[C@@]2(CCCN(c3cc(-c4ccccc4)cc(Cl)n3)C2)C1 ZINC001164720644 720246787 /nfs/dbraw/zinc/24/67/87/720246787.db2.gz ZJEPKKQWEPKMMI-QHCPKHFHSA-N 1 1 428.964 3.067 20 0 IGADMO CNC(=O)C[N@H+]1CCOC[C@@]2(CCCN(c3cc(-c4ccccc4)cc(Cl)n3)C2)C1 ZINC001164720644 720246802 /nfs/dbraw/zinc/24/68/02/720246802.db2.gz ZJEPKKQWEPKMMI-QHCPKHFHSA-N 1 1 428.964 3.067 20 0 IGADMO CNC(=O)C[N@@H+]1CCOC[C@]2(CCCN(c3c(Cl)ccc4ccc(Cl)nc43)C2)C1 ZINC001164721013 720304199 /nfs/dbraw/zinc/30/41/99/720304199.db2.gz CPXTYZMEVINOAC-OAQYLSRUSA-N 1 1 437.371 3.206 20 0 IGADMO CNC(=O)C[N@H+]1CCOC[C@]2(CCCN(c3c(Cl)ccc4ccc(Cl)nc43)C2)C1 ZINC001164721013 720304204 /nfs/dbraw/zinc/30/42/04/720304204.db2.gz CPXTYZMEVINOAC-OAQYLSRUSA-N 1 1 437.371 3.206 20 0 IGADMO CNC(=O)C[N@@H+]1CCOC[C@@]2(CCCN(c3ccc4c(Cl)ccc(Cl)c4n3)C2)C1 ZINC001164720830 720304817 /nfs/dbraw/zinc/30/48/17/720304817.db2.gz ATCNRVGCVBRLQU-NRFANRHFSA-N 1 1 437.371 3.206 20 0 IGADMO CNC(=O)C[N@H+]1CCOC[C@@]2(CCCN(c3ccc4c(Cl)ccc(Cl)c4n3)C2)C1 ZINC001164720830 720304821 /nfs/dbraw/zinc/30/48/21/720304821.db2.gz ATCNRVGCVBRLQU-NRFANRHFSA-N 1 1 437.371 3.206 20 0 IGADMO CCOC(=O)c1c2ccccn2c2ncnc(N3CC[C@@H]4[C@@H]3CC[N@H+]4Cc3cccnc3)c12 ZINC001164721739 720331366 /nfs/dbraw/zinc/33/13/66/720331366.db2.gz DGRDENDXLMIEGJ-MOPGFXCFSA-N 1 1 442.523 3.307 20 0 IGADMO Clc1nc2c(ncn2[C@@H]2CCCCO2)c(N2CC[C@@H]3[C@@H]2CC[N@H+]3Cc2cccnc2)n1 ZINC001164721663 720379974 /nfs/dbraw/zinc/37/99/74/720379974.db2.gz AIGLEGLJFDEPIA-SQNIBIBYSA-N 1 1 439.951 3.427 20 0 IGADMO Cc1nc(CO[C@@H]2CN(c3cc(OC4CC[NH+](C)CC4)ccn3)[C@H]3CCCO[C@H]23)cs1 ZINC001164821777 720392585 /nfs/dbraw/zinc/39/25/85/720392585.db2.gz IMKQLUQPAIDVJQ-XJUOHMSHSA-N 1 1 444.601 3.273 20 0 IGADMO O=C(Nc1nncs1)c1cnc(N2CC[C@H]3[C@H]2CC[N@@H+]3Cc2cccnc2)c(Cl)c1 ZINC001164735919 720451735 /nfs/dbraw/zinc/45/17/35/720451735.db2.gz ZNFCUBTUXHUZRG-DLBZAZTESA-N 1 1 441.948 3.087 20 0 IGADMO O=C(Nc1nncs1)c1cnc(N2CC[C@H]3[C@H]2CC[N@H+]3Cc2cccnc2)c(Cl)c1 ZINC001164735919 720451743 /nfs/dbraw/zinc/45/17/43/720451743.db2.gz ZNFCUBTUXHUZRG-DLBZAZTESA-N 1 1 441.948 3.087 20 0 IGADMO CCOC(=O)c1cnc(C2CC2)nc1N1CC[C@@H]2[C@@H](C[C@H](Cn3cccn3)[N@H+]2C(C)C)C1 ZINC001164835024 720544135 /nfs/dbraw/zinc/54/41/35/720544135.db2.gz GTJGMRKEALXJJU-QKNQBKEWSA-N 1 1 438.576 3.105 20 0 IGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@H]2CN(C(F)(F)COc3ccc(Cl)nn3)CC[C@@H]21 ZINC001164836640 720602880 /nfs/dbraw/zinc/60/28/80/720602880.db2.gz GAPJYQGVTRLKES-ULQDDVLXSA-N 1 1 440.926 3.172 20 0 IGADMO COC(=O)CSc1cncc(N2CCC3(C[C@H]([N@@H+](C)Cc4ccccc4)CO3)CC2)n1 ZINC001164839014 720717891 /nfs/dbraw/zinc/71/78/91/720717891.db2.gz KHCGIGLHIVWIEJ-IBGZPJMESA-N 1 1 442.585 3.002 20 0 IGADMO Clc1cc(OCc2ccccc2)cnc1N1CC[N@H+]2C[C@H](Oc3cncnc3)C[C@H]2C1 ZINC001164745920 720745202 /nfs/dbraw/zinc/74/52/02/720745202.db2.gz WUXBJTIDIJOOIU-AZUAARDMSA-N 1 1 437.931 3.446 20 0 IGADMO C[C@@H]1CCCCN1c1nc2ccccc2nc1N1CC[N@H+]2C[C@@H](Oc3cncnc3)C[C@H]2C1 ZINC001164740443 720760962 /nfs/dbraw/zinc/76/09/62/720760962.db2.gz LERCUOKJVHZKBG-AABGKKOBSA-N 1 1 445.571 3.141 20 0 IGADMO Fc1ccc(-c2ccc(Cl)nn2)cc1N1CC[N@H+]2C[C@@H](Oc3cncnc3)C[C@@H]2C1 ZINC001164737522 720780063 /nfs/dbraw/zinc/78/00/63/720780063.db2.gz CDLADTVAJNBBFO-CVEARBPZSA-N 1 1 426.883 3.068 20 0 IGADMO Clc1nnc(N2CC[C@@H]3[C@@H](C[C@H](Cn4cncn4)[N@H+]3CC3CC3)C2)c2sccc21 ZINC001164737713 720818463 /nfs/dbraw/zinc/81/84/63/720818463.db2.gz CFHDUENENYXPNN-ZMSDIMECSA-N 1 1 429.981 3.316 20 0 IGADMO c1ncn(C[C@H]2C[C@H]3CN(c4nccc(Oc5ccccc5)n4)CC[C@H]3[N@H+]2CC2CC2)n1 ZINC001164745053 720819370 /nfs/dbraw/zinc/81/93/70/720819370.db2.gz VZLLTZYJMNJOAJ-TUNNFDKTSA-N 1 1 431.544 3.240 20 0 IGADMO CC(C)(C)OC(=O)c1ccc(N2CC[C@@H]3[C@@H](C[C@H](Cn4cncn4)[N@H+]3CC3CC3)C2)nc1 ZINC001164743836 720827683 /nfs/dbraw/zinc/82/76/83/720827683.db2.gz SSIJZNLBVPEPNB-PWRODBHTSA-N 1 1 438.576 3.008 20 0 IGADMO CC(C)(C)OC(=O)c1ccc(N2CC[C@@H]3[C@@H](C[C@@H](Cn4cncn4)[N@H+]3CC3CC3)C2)nc1 ZINC001164743834 720828073 /nfs/dbraw/zinc/82/80/73/720828073.db2.gz SSIJZNLBVPEPNB-PCCBWWKXSA-N 1 1 438.576 3.008 20 0 IGADMO COc1cccc(-c2ccc(N3CC[C@@H]4[C@@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)nn2)c1 ZINC001164739954 720847620 /nfs/dbraw/zinc/84/76/20/720847620.db2.gz BDAOGOJTTQTVHH-AWRGLXIESA-N 1 1 445.571 3.123 20 0 IGADMO COc1ccccc1-c1ccc(N2CC[C@@H]3[C@@H](C[C@H](Cn4cncn4)[N@H+]3CC3CC3)C2)nn1 ZINC001164745202 720847933 /nfs/dbraw/zinc/84/79/33/720847933.db2.gz MRCPYIBNQVUGKT-MIZPHKNDSA-N 1 1 445.571 3.123 20 0 IGADMO COc1ccccc1-c1cc(N2CC[C@@H]3[C@@H](C[C@H](Cn4cncn4)[N@H+]3CC3CC3)C2)ncn1 ZINC001164748779 720850206 /nfs/dbraw/zinc/85/02/06/720850206.db2.gz UXHSSUIANOWOFH-MIZPHKNDSA-N 1 1 445.571 3.123 20 0 IGADMO COc1ccc(-c2cc(N3CC[C@@H]4[C@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)ncn2)cc1 ZINC001164750329 720850390 /nfs/dbraw/zinc/85/03/90/720850390.db2.gz XGVDMKIUFPIZFA-PQNGQFLHSA-N 1 1 445.571 3.123 20 0 IGADMO Cc1nc(-c2ccncc2)nc(N2CC[C@@H]3[C@@H](C[C@@H](Cn4cncn4)[N@H+]3CC3CC3)C2)c1C ZINC001164745536 720852640 /nfs/dbraw/zinc/85/26/40/720852640.db2.gz DXDOJETWNPHVQX-RJGXRXQPSA-N 1 1 444.587 3.126 20 0 IGADMO Cc1nc(-c2ccncc2)nc(N2CC[C@@H]3[C@@H](C[C@H](Cn4cncn4)[N@H+]3CC3CC3)C2)c1C ZINC001164745540 720852949 /nfs/dbraw/zinc/85/29/49/720852949.db2.gz DXDOJETWNPHVQX-YTFSRNRJSA-N 1 1 444.587 3.126 20 0 IGADMO COCC[N@H+]1CCO[C@H]2CN(c3cc(Oc4ccc(SC)cc4)ncn3)CC[C@H]2C1 ZINC001164862127 720868999 /nfs/dbraw/zinc/86/89/99/720868999.db2.gz ZCVUTNMAZBQOOS-PXNSSMCTSA-N 1 1 430.574 3.164 20 0 IGADMO COC(=O)c1cccc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COCc2cccnc2)n1 ZINC001164754944 720871606 /nfs/dbraw/zinc/87/16/06/720871606.db2.gz UUIHVQWOKHYISX-SQJMNOBHSA-N 1 1 436.556 3.018 20 0 IGADMO COCC[N@H+]1CCO[C@H]2CN(c3ncnc4c3c(C)c(C)n4Cc3ccccc3)CC[C@@H]2C1 ZINC001164858357 720875603 /nfs/dbraw/zinc/87/56/03/720875603.db2.gz KSIDLUKERCBJIO-PKTZIBPZSA-N 1 1 449.599 3.270 20 0 IGADMO COCC[N@H+]1CCO[C@H]2CN(c3nc(C)nc4sc5c(c43)CCCCC5)CC[C@H]2C1 ZINC001164862310 720877369 /nfs/dbraw/zinc/87/73/69/720877369.db2.gz ROTDFWSXAZBTLV-HKUYNNGSSA-N 1 1 430.618 3.442 20 0 IGADMO COCC[N@H+]1CCO[C@@H]2CN(c3ncnc4cc(OCc5ccccc5)ccc43)CC[C@@H]2C1 ZINC001164863801 720888216 /nfs/dbraw/zinc/88/82/16/720888216.db2.gz UICRVPMMCTZADK-PXDATVDWSA-N 1 1 448.567 3.382 20 0 IGADMO COCOc1ccc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COCc2cccnc2)nc1 ZINC001164753869 720892125 /nfs/dbraw/zinc/89/21/25/720892125.db2.gz HJWNDWZHPUIRDZ-RCZVLFRGSA-N 1 1 438.572 3.214 20 0 IGADMO c1cncc(COC[C@H]2C[N@@H+](CC3CC3)C[C@@]23CCN(c2ncc4cccnc4n2)C3)c1 ZINC001164755968 720892373 /nfs/dbraw/zinc/89/23/73/720892373.db2.gz NVADXEXWOBEBHG-RCZVLFRGSA-N 1 1 430.556 3.175 20 0 IGADMO c1cncc(COC[C@@H]2C[N@H+](CC3CC3)C[C@]23CCN(c2cc(OCC4CC4)ncn2)C3)c1 ZINC001164755713 720895452 /nfs/dbraw/zinc/89/54/52/720895452.db2.gz NBVWHMPNUFYNCC-OZXSUGGESA-N 1 1 449.599 3.416 20 0 IGADMO CSc1ccc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COCc2cccnc2)nn1 ZINC001164747247 720910588 /nfs/dbraw/zinc/91/05/88/720910588.db2.gz CJAAAACJEXWTPI-NFBKMPQASA-N 1 1 425.602 3.349 20 0 IGADMO CCC(C)(C)NS(=O)(=O)c1ccc(N2CCn3c(C[N@@H+](C)C(C)C)cnc3[C@@H]2C)nc1 ZINC001164856316 721006491 /nfs/dbraw/zinc/00/64/91/721006491.db2.gz BIQKWQUUDIFVEL-KRWDZBQOSA-N 1 1 448.637 3.166 20 0 IGADMO FC(F)(c1ccc2c(Cl)ncnc2c1)N1CCc2[nH+]cc(Cn3cccn3)n2CC1 ZINC001164862004 721031803 /nfs/dbraw/zinc/03/18/03/721031803.db2.gz JSJNWNGHVZXQCZ-UHFFFAOYSA-N 1 1 429.862 3.332 20 0 IGADMO FC(F)(c1nc(Cl)ncc1Cl)N1CC[N@H+]2C[C@H](OCc3cccnc3)C[C@H]2C1 ZINC001164868650 721064990 /nfs/dbraw/zinc/06/49/90/721064990.db2.gz OZXIMYBUEUIGFD-UONOGXRCSA-N 1 1 430.286 3.203 20 0 IGADMO CCOC(=O)c1c(C)nc(Cl)cc1N1CC[N@H+]2C[C@@H](OCc3cccnc3)C[C@@H]2C1 ZINC001164871539 721070786 /nfs/dbraw/zinc/07/07/86/721070786.db2.gz ZNWRAUKWXMVPPL-MSOLQXFVSA-N 1 1 430.936 3.095 20 0 IGADMO CCOC(=O)c1c(C)cc(Cl)nc1N1CC[N@H+]2C[C@H](OCc3cccnc3)C[C@@H]2C1 ZINC001164871475 721072115 /nfs/dbraw/zinc/07/21/15/721072115.db2.gz YYZSWKMLQMFWGW-QZTJIDSGSA-N 1 1 430.936 3.095 20 0 IGADMO O=C(Nc1ccccc1)c1ccnc(N2CC[N@H+]3C[C@H](OCc4cccnc4)C[C@@H]3C2)c1 ZINC001164865027 721093131 /nfs/dbraw/zinc/09/31/31/721093131.db2.gz IBYCSXMKJWDQMV-DHIUTWEWSA-N 1 1 429.524 3.209 20 0 IGADMO CCOC(=O)c1cc2ccccc2nc1N1CC[N@H+]2C[C@@H](OCc3cccnc3)C[C@H]2C1 ZINC001164864399 721112715 /nfs/dbraw/zinc/11/27/15/721112715.db2.gz FSXRFSCVOKHTKO-SFTDATJTSA-N 1 1 432.524 3.286 20 0 IGADMO COc1cccc(Oc2cncc(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@@H]4C3)n2)c1 ZINC001164865439 721116812 /nfs/dbraw/zinc/11/68/12/721116812.db2.gz LIVCORMLIBVJBK-KNQAVFIVSA-N 1 1 433.512 3.152 20 0 IGADMO CN(C)c1ccc(-c2ccnc(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@H]4C3)n2)cc1 ZINC001164880719 721124070 /nfs/dbraw/zinc/12/40/70/721124070.db2.gz XFLHOJYQPBHHGL-GOTSBHOMSA-N 1 1 430.556 3.084 20 0 IGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(C(F)(F)Oc4ccc5c(Cl)ncnc5c4)C[C@@H]3C2)cn1 ZINC001164774425 721173346 /nfs/dbraw/zinc/17/33/46/721173346.db2.gz ZCJIVRWNSSCUKQ-CVEARBPZSA-N 1 1 448.905 3.400 20 0 IGADMO Cc1ccc(-c2nc3c(ncnc3N3C[C@@H]4CC[N@H+](Cc5cnn(C)c5)C[C@@H]4C3)o2)cc1 ZINC001164771844 721205596 /nfs/dbraw/zinc/20/55/96/721205596.db2.gz REJLZNOWLDLNMZ-VQTJNVASSA-N 1 1 429.528 3.285 20 0 IGADMO COc1ccc(Cc2c(C)nc(N3C[C@H]4CC[N@@H+](Cc5cnn(C)c5)C[C@@H]4C3)nc2C)cc1 ZINC001164763894 721234961 /nfs/dbraw/zinc/23/49/61/721234961.db2.gz NXABHXSIDUSKEM-DHIUTWEWSA-N 1 1 446.599 3.385 20 0 IGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2C[C@@H]3OCC[C@@H]3[C@H](C(=O)NCc3cccnc3)C2)nc1 ZINC001164873374 721305068 /nfs/dbraw/zinc/30/50/68/721305068.db2.gz BEQDIDBHBXVLSE-YCAMKHIRSA-N 1 1 449.599 3.181 20 0 IGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@]2(CCCN(c3nccc4c3C(=O)OC4(C)C)C2)C1 ZINC001164779299 721346117 /nfs/dbraw/zinc/34/61/17/721346117.db2.gz SBQCUIQJLXYYCQ-XMMPIXPASA-N 1 1 440.544 3.211 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@]2(CCCN(c3nccc4c3C(=O)OC4(C)C)C2)C1 ZINC001164779299 721346119 /nfs/dbraw/zinc/34/61/19/721346119.db2.gz SBQCUIQJLXYYCQ-XMMPIXPASA-N 1 1 440.544 3.211 20 0 IGADMO O=C(c1ccccc1)N1CCO[C@@H]2CN(c3nc(Cl)ccc3C[NH+]3CCCC3)C[C@H]2C1 ZINC001164885851 721350158 /nfs/dbraw/zinc/35/01/58/721350158.db2.gz QMYZPBHWNQZSNO-NHCUHLMSSA-N 1 1 440.975 3.308 20 0 IGADMO CCOC(=O)c1cc(N2CCC[C@@]3(C2)COCC[N@H+](Cc2c(C)noc2C)C3)ncc1C ZINC001164777871 721353198 /nfs/dbraw/zinc/35/31/98/721353198.db2.gz JUGATGIJJLTXIB-XMMPIXPASA-N 1 1 442.560 3.291 20 0 IGADMO CCOC(=O)c1cc(N2CCC[C@@]3(C2)COCC[N@@H+](Cc2c(C)noc2C)C3)ncc1C ZINC001164777871 721353201 /nfs/dbraw/zinc/35/32/01/721353201.db2.gz JUGATGIJJLTXIB-XMMPIXPASA-N 1 1 442.560 3.291 20 0 IGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@@]2(CCCN(c3nc4nc[nH]c4cc3Cl)C2)C1 ZINC001164780763 721356750 /nfs/dbraw/zinc/35/67/50/721356750.db2.gz HEUSTXHOBCSZIZ-NRFANRHFSA-N 1 1 430.940 3.335 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@@]2(CCCN(c3nc4nc[nH]c4cc3Cl)C2)C1 ZINC001164780763 721356755 /nfs/dbraw/zinc/35/67/55/721356755.db2.gz HEUSTXHOBCSZIZ-NRFANRHFSA-N 1 1 430.940 3.335 20 0 IGADMO O=C1CO[C@H]2CN(c3nc(Cl)ccc3C[NH+]3CCCC3)C[C@H]2N1c1cccc(F)c1 ZINC001164882609 721364865 /nfs/dbraw/zinc/36/48/65/721364865.db2.gz KFWCRMBCOHATSX-MOPGFXCFSA-N 1 1 430.911 3.091 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@]2(CCCN(c3cncc(OCC(C)C)n3)C2)C1 ZINC001164785259 721367881 /nfs/dbraw/zinc/36/78/81/721367881.db2.gz SUCVOMKNRSGZKN-HSZRJFAPSA-N 1 1 429.565 3.235 20 0 IGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@]2(CCCN(c3cncc(OCC(C)C)n3)C2)C1 ZINC001164785259 721367886 /nfs/dbraw/zinc/36/78/86/721367886.db2.gz SUCVOMKNRSGZKN-HSZRJFAPSA-N 1 1 429.565 3.235 20 0 IGADMO C[NH+]1CCN(C[C@@H]2CCC[C@]3(CCN(c4nc(Cl)nc5[nH]cc(Cl)c54)C3)O2)CC1 ZINC001164884992 721382086 /nfs/dbraw/zinc/38/20/86/721382086.db2.gz BLDFVBCHNDQGJV-VBKZILBWSA-N 1 1 439.391 3.030 20 0 IGADMO Cc1cc(C(F)(F)N2CC[C@]3(C2)CCC[C@@H](CN2CC[NH+](C)CC2)O3)cc(Cl)n1 ZINC001164894059 721384276 /nfs/dbraw/zinc/38/42/76/721384276.db2.gz XBBOZBIIUKMSAS-ICSRJNTNSA-N 1 1 428.955 3.354 20 0 IGADMO C[NH+]1CCN(C[C@@H]2CCC[C@@]3(CCN(c4nc(Cl)nc5c4CCCCC5)C3)O2)CC1 ZINC001164887748 721408107 /nfs/dbraw/zinc/40/81/07/721408107.db2.gz NEVMGADYTPBGCA-MBSDFSHPSA-N 1 1 434.028 3.164 20 0 IGADMO CCOC(Cc1c(Cl)ncnc1N1C[C@H]2C[NH+](Cc3nccs3)C[C@@H]2C1)OCC ZINC001164780577 721410591 /nfs/dbraw/zinc/41/05/91/721410591.db2.gz BGADPTKXJVGXSB-HUUCEWRRSA-N 1 1 437.997 3.096 20 0 IGADMO COc1cc2c(cc1Cl)ncnc2N1CC[C@@]2(C1)CCC[C@H](CN1CC[NH+](C)CC1)O2 ZINC001164886585 721413319 /nfs/dbraw/zinc/41/33/19/721413319.db2.gz KGOOIEZBTMZDFN-UZUQRXQVSA-N 1 1 445.995 3.057 20 0 IGADMO Cc1ccc(C(F)(F)N2CC[C@@]3(C2)CCC[C@@H](CN2CC[NH+](C)CC2)O3)nc1Cl ZINC001164892859 721415665 /nfs/dbraw/zinc/41/56/65/721415665.db2.gz YZAQPNCUFHDTFE-FXAWDEMLSA-N 1 1 428.955 3.354 20 0 IGADMO Cc1nc(C(F)(F)N2CC[C@]3(C2)CCC[C@H](CN2CC[NH+](C)CC2)O3)nc(Cl)c1C ZINC001164883894 721421439 /nfs/dbraw/zinc/42/14/39/721421439.db2.gz CKGCDUDYJCLBDA-XLIONFOSSA-N 1 1 443.970 3.057 20 0 IGADMO CCOC(=O)c1ccc2nc(Cl)nc(N3C[C@H]4C[NH+](Cc5nccs5)C[C@@H]4C3)c2c1 ZINC001164783542 721423459 /nfs/dbraw/zinc/42/34/59/721423459.db2.gz IYDOCCZHSWPNJH-HUUCEWRRSA-N 1 1 443.960 3.485 20 0 IGADMO C[NH+]1CCN(C[C@H]2CCC[C@@]3(CCN(c4cc(F)cc5ncnc(Cl)c54)C3)O2)CC1 ZINC001164892367 721428283 /nfs/dbraw/zinc/42/82/83/721428283.db2.gz IGVOPBSYAMKHRQ-VGSWGCGISA-N 1 1 433.959 3.188 20 0 IGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1ncc(C)c(NCC3CC3)n1)CC2 ZINC001164783830 721447716 /nfs/dbraw/zinc/44/77/16/721447716.db2.gz CPABGGFRLPFGBU-QFIPXVFZSA-N 1 1 443.636 3.341 20 0 IGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1ncc(C)c(NC3CC3)n1)CC2 ZINC001164787713 721447799 /nfs/dbraw/zinc/44/77/99/721447799.db2.gz PYCZNUPQFSCDCP-OAQYLSRUSA-N 1 1 429.609 3.093 20 0 IGADMO C[NH+]1CCN(C[C@@H]2CCC[C@]3(CCN(c4c(Cl)nc(Cl)nc4C4CC4)C3)O2)CC1 ZINC001164886472 721451146 /nfs/dbraw/zinc/45/11/46/721451146.db2.gz GSCGXCHICQIDGV-HRAATJIYSA-N 1 1 440.419 3.426 20 0 IGADMO C[NH+]1CCN(C[C@H]2CCC[C@]3(CCN(c4c(F)ccc5c(Cl)ncnc54)C3)O2)CC1 ZINC001164891646 721451672 /nfs/dbraw/zinc/45/16/72/721451672.db2.gz VDEUEHNTJAXGBK-OPAMFIHVSA-N 1 1 433.959 3.188 20 0 IGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(C(F)(F)c1cnc(Cl)cn1)CC2 ZINC001164783234 721452025 /nfs/dbraw/zinc/45/20/25/721452025.db2.gz AOAAAGGJGUVKED-KRWDZBQOSA-N 1 1 444.954 3.409 20 0 IGADMO CCOC(=O)c1cc(F)cnc1N1CCC2(C[C@H](COCC3CC3)[N@@H+](CCOC)C2)CC1 ZINC001164788694 721453368 /nfs/dbraw/zinc/45/33/68/721453368.db2.gz SQEFOIBRRHIACY-HXUWFJFHSA-N 1 1 449.567 3.131 20 0 IGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(C(F)(F)c1ccc(Cl)nn1)CC2 ZINC001164790294 721454043 /nfs/dbraw/zinc/45/40/43/721454043.db2.gz XXOTUTSAZVOXRG-QGZVFWFLSA-N 1 1 444.954 3.409 20 0 IGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1nc(C)c(F)cc1C(=O)OC)CC2 ZINC001164790234 721459948 /nfs/dbraw/zinc/45/99/48/721459948.db2.gz ZVKGMOVPNNSUCJ-IBGZPJMESA-N 1 1 449.567 3.050 20 0 IGADMO CCOC(=O)c1cc(N2CCC3(C[C@@H](COCC4CC4)[N@@H+](CCOC)C3)CC2)ncc1C ZINC001164782348 721460759 /nfs/dbraw/zinc/46/07/59/721460759.db2.gz AIDUBVJCWBPWCN-NRFANRHFSA-N 1 1 445.604 3.301 20 0 IGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1cncc(N3CCCCC3)n1)CC2 ZINC001164787723 721463484 /nfs/dbraw/zinc/46/34/84/721463484.db2.gz RWJPLUPCHKVKLN-JOCHJYFZSA-N 1 1 443.636 3.201 20 0 IGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1cc(-c3ncc[nH]3)ccn1)CC2 ZINC001164789231 721463734 /nfs/dbraw/zinc/46/37/34/721463734.db2.gz VXZGUERGLRZVHY-OAQYLSRUSA-N 1 1 425.577 3.206 20 0 IGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1ccnc(N3CCCCC3)n1)CC2 ZINC001164790666 721467004 /nfs/dbraw/zinc/46/70/04/721467004.db2.gz UHVMNYKUFSYLHV-JOCHJYFZSA-N 1 1 443.636 3.201 20 0 IGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1nccnc1OC1CCC1)CC2 ZINC001164787406 721470690 /nfs/dbraw/zinc/47/06/90/721470690.db2.gz FNYXQMPQZBCWOB-HXUWFJFHSA-N 1 1 430.593 3.142 20 0 IGADMO CCOC(=O)c1nc2ccccc2c(N2CC[N@H+]3C[C@H](Oc4cccc(F)c4)C[C@H]3C2)n1 ZINC001164900066 721514351 /nfs/dbraw/zinc/51/43/51/721514351.db2.gz NRPHPFZUFYMFTO-PKOBYXMFSA-N 1 1 436.487 3.288 20 0 IGADMO COc1cc2nc(C)nc(N3CC[N@H+]4C[C@H](Oc5cccc(F)c5)C[C@@H]4C3)c2cc1OC ZINC001164910340 721534574 /nfs/dbraw/zinc/53/45/74/721534574.db2.gz UJCVGGROCRGKCO-IEBWSBKVSA-N 1 1 438.503 3.436 20 0 IGADMO CN(C)c1nc(-c2ccccc2)nc(N2CC[N@H+]3C[C@H](Oc4cccc(F)c4)C[C@H]3C2)n1 ZINC001164911172 721541445 /nfs/dbraw/zinc/54/14/45/721541445.db2.gz VPPRUKSVCWTMPF-PZJWPPBQSA-N 1 1 434.519 3.086 20 0 IGADMO COc1nc(Cl)ncc1C(F)(F)N1CC[N@H+]2C[C@@H](Oc3cccc(F)c3)C[C@@H]2C1 ZINC001164902673 721549590 /nfs/dbraw/zinc/54/95/90/721549590.db2.gz AWNSGBYMHMJIRZ-HIFRSBDPSA-N 1 1 428.842 3.165 20 0 IGADMO CSc1nc2c(c(N3C[C@H]([N@@H+](C)Cc4cccnc4)[C@H]4OCCC[C@H]43)n1)CCCC2 ZINC001164803010 721551039 /nfs/dbraw/zinc/55/10/39/721551039.db2.gz HDZRXNUOCJGCPV-HKBOAZHASA-N 1 1 425.602 3.341 20 0 IGADMO CCOC(=O)c1cc2cccnc2nc1N1C[C@H]([N@H+](C)Cc2cccnc2)[C@H]2OCCC[C@@H]21 ZINC001164805645 721553045 /nfs/dbraw/zinc/55/30/45/721553045.db2.gz MNIARKONSVEOHN-FKBYEOEOSA-N 1 1 447.539 3.070 20 0 IGADMO CCOC(=O)c1cc2cccnc2nc1N1C[C@H]([N@@H+](C)Cc2cccnc2)[C@H]2OCCC[C@@H]21 ZINC001164805645 721553046 /nfs/dbraw/zinc/55/30/46/721553046.db2.gz MNIARKONSVEOHN-FKBYEOEOSA-N 1 1 447.539 3.070 20 0 IGADMO CC1CCN(C(=O)c2ccc(N3CC[N@H+]4C[C@@H](Oc5cccc(F)c5)C[C@@H]4C3)nc2)CC1 ZINC001164908576 721553428 /nfs/dbraw/zinc/55/34/28/721553428.db2.gz QMOUICJBLRZCLN-GGAORHGYSA-N 1 1 438.547 3.435 20 0 IGADMO COc1cc2nc(C)nc(N3C[C@H]([N@@H+](C)Cc4cccnc4)[C@H]4OCCC[C@H]43)c2cc1OC ZINC001164810525 721555862 /nfs/dbraw/zinc/55/58/62/721555862.db2.gz YQQJXZFHXJTLTI-DPLHUUCSSA-N 1 1 449.555 3.219 20 0 IGADMO COC(=O)c1nc(Cl)c(N2CC[N@@H+]3C[C@H](Oc4cccc(F)c4)C[C@@H]3C2)c(Cl)n1 ZINC001164906108 721566132 /nfs/dbraw/zinc/56/61/32/721566132.db2.gz ITWUUAUFPWXDOA-TZMCWYRMSA-N 1 1 441.290 3.051 20 0 IGADMO COC(=O)c1nc(Cl)c(N2CC[N@H+]3C[C@H](Oc4cccc(F)c4)C[C@@H]3C2)c(Cl)n1 ZINC001164906108 721566134 /nfs/dbraw/zinc/56/61/34/721566134.db2.gz ITWUUAUFPWXDOA-TZMCWYRMSA-N 1 1 441.290 3.051 20 0 IGADMO COc1nnc(Cl)cc1C(F)(F)N1CC[N@H+]2C[C@@H](Oc3cccc(F)c3)C[C@@H]2C1 ZINC001164907206 721566223 /nfs/dbraw/zinc/56/62/23/721566223.db2.gz MRVSKHBCEHVOHI-HIFRSBDPSA-N 1 1 428.842 3.165 20 0 IGADMO CCOC(=O)c1cc2ccc(N3C[C@H]([N@@H+](C)Cc4cccnc4)[C@H]4OCCC[C@@H]43)[nH]c-2n1 ZINC001164798128 721567263 /nfs/dbraw/zinc/56/72/63/721567263.db2.gz AIMXKWAUHHFEFM-ONTIZHBOSA-N 1 1 435.528 3.003 20 0 IGADMO CCOC(=O)c1cc2ccc(N3C[C@H]([N@H+](C)Cc4cccnc4)[C@H]4OCCC[C@@H]43)nc2[nH]1 ZINC001164798128 721567271 /nfs/dbraw/zinc/56/72/71/721567271.db2.gz AIMXKWAUHHFEFM-ONTIZHBOSA-N 1 1 435.528 3.003 20 0 IGADMO CCOC(=O)c1cc2ccc(N3C[C@H]([N@@H+](C)Cc4cccnc4)[C@H]4OCCC[C@@H]43)nc2[nH]1 ZINC001164798128 721567276 /nfs/dbraw/zinc/56/72/76/721567276.db2.gz AIMXKWAUHHFEFM-ONTIZHBOSA-N 1 1 435.528 3.003 20 0 IGADMO CCc1cc2c(nc(Cl)nc2N2C[C@H]([N@H+](C)Cc3cccnc3)[C@H]3OCCC[C@H]32)[nH]1 ZINC001164806052 721573249 /nfs/dbraw/zinc/57/32/49/721573249.db2.gz PFJQCNXTRFULHT-QYZOEREBSA-N 1 1 426.952 3.437 20 0 IGADMO CCc1cc2c(nc(Cl)nc2N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@H]3OCCC[C@H]32)[nH]1 ZINC001164806052 721573252 /nfs/dbraw/zinc/57/32/52/721573252.db2.gz PFJQCNXTRFULHT-QYZOEREBSA-N 1 1 426.952 3.437 20 0 IGADMO COc1ccc(-c2ccc(N3C[C@H]([N@H+](C)Cc4cccnc4)[C@H]4OCCC[C@H]43)nn2)cc1 ZINC001164800728 721576959 /nfs/dbraw/zinc/57/69/59/721576959.db2.gz FODNHHIURZKTSU-CUYJMHBOSA-N 1 1 431.540 3.415 20 0 IGADMO COc1ccc(-c2ccc(N3C[C@H]([N@@H+](C)Cc4cccnc4)[C@H]4OCCC[C@H]43)nn2)cc1 ZINC001164800728 721576964 /nfs/dbraw/zinc/57/69/64/721576964.db2.gz FODNHHIURZKTSU-CUYJMHBOSA-N 1 1 431.540 3.415 20 0 IGADMO COC(=O)c1cc2ccccc2c(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@H]32)n1 ZINC001164806990 721581368 /nfs/dbraw/zinc/58/13/68/721581368.db2.gz OHRKNZYOKKDKMB-XPWALMASSA-N 1 1 432.524 3.285 20 0 IGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2nc(-c3cccnc3)nc3c2CCC3)[C@H]2CCCO[C@@H]12 ZINC001164807529 721586104 /nfs/dbraw/zinc/58/61/04/721586104.db2.gz OIZMJHGXGTWZLW-RBZQAINGSA-N 1 1 442.567 3.291 20 0 IGADMO CCOC(=O)Cc1cccnc1N1CCC(F)(F)[C@]2(CC[N@@H+](Cc3ccccn3)C2)C1 ZINC001164904960 721587392 /nfs/dbraw/zinc/58/73/92/721587392.db2.gz IJQIANFJXPPRMU-QFIPXVFZSA-N 1 1 430.499 3.320 20 0 IGADMO Cn1cnc2c1nc(Cl)nc2N1CCC(F)(F)[C@@]2(CC[N@@H+](Cc3ccccn3)C2)C1 ZINC001164905975 721698441 /nfs/dbraw/zinc/69/84/41/721698441.db2.gz KLTNWXYSCZJQCG-LJQANCHMSA-N 1 1 433.894 3.149 20 0 IGADMO COCc1cc(N2CCC(F)(F)[C@@]3(CC[N@@H+](Cc4ccccn4)C3)C2)nc(SC)n1 ZINC001164904255 721702517 /nfs/dbraw/zinc/70/25/17/721702517.db2.gz DYPZVVDBLANKBJ-HXUWFJFHSA-N 1 1 435.544 3.478 20 0 IGADMO CN(C)C(=O)C[NH+]1CCC2(CCCN2C(F)(F)c2ccc3ncc(Cl)nc3c2)CC1 ZINC001165009130 721732982 /nfs/dbraw/zinc/73/29/82/721732982.db2.gz UTXKWBRCGNCCJH-UHFFFAOYSA-N 1 1 437.922 3.351 20 0 IGADMO CN(C)C(=O)C[NH+]1CCC2(CCCN2C(F)(F)c2cccc3c(Cl)ncnc32)CC1 ZINC001165009651 721745936 /nfs/dbraw/zinc/74/59/36/721745936.db2.gz HLQGEWSKCIYTCD-UHFFFAOYSA-N 1 1 437.922 3.351 20 0 IGADMO Cc1cc2c(nc(Cl)nc2N2CCO[C@]3(C2)COCC[N@H+](Cc2cccnc2)C3)s1 ZINC001164910801 721777313 /nfs/dbraw/zinc/77/73/13/721777313.db2.gz CFNNGNINPRECKL-OAQYLSRUSA-N 1 1 445.976 3.156 20 0 IGADMO Cc1cc2c(nc(Cl)nc2N2CCO[C@]3(C2)COCC[N@@H+](Cc2cccnc2)C3)s1 ZINC001164910801 721777316 /nfs/dbraw/zinc/77/73/16/721777316.db2.gz CFNNGNINPRECKL-OAQYLSRUSA-N 1 1 445.976 3.156 20 0 IGADMO Clc1ccc(C[NH+]2CCCC2)c(N2CCO[C@@H]3[C@H](OCCCn4cccn4)CC[C@H]32)n1 ZINC001165024547 721780857 /nfs/dbraw/zinc/78/08/57/721780857.db2.gz XWEWZBQZWYFWIX-SJBKTWHCSA-N 1 1 445.995 3.370 20 0 IGADMO CCOC(=O)c1cnc(Cl)nc1N1C[C@@H]2CCC[C@H]([N@@H+](C)Cc3ccccn3)[C@H]2C1 ZINC001165025414 721800252 /nfs/dbraw/zinc/80/02/52/721800252.db2.gz NZPKHJXKUOMJBO-SNRMKQJTSA-N 1 1 429.952 3.439 20 0 IGADMO CCOC(=O)c1ncnc(Cl)c1N1C[C@@H]2CCC[C@H]([N@@H+](C)Cc3ccccn3)[C@H]2C1 ZINC001165023111 721821586 /nfs/dbraw/zinc/82/15/86/721821586.db2.gz HLFOAGASRMPSBW-SZMVWBNQSA-N 1 1 429.952 3.439 20 0 IGADMO C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@@H]2CN(c3ccc(Cn4ccccc4=O)cn3)C[C@H]21 ZINC001165019877 721825509 /nfs/dbraw/zinc/82/55/09/721825509.db2.gz CJAFJIPQLSLKJF-GMKZXUHWSA-N 1 1 429.568 3.424 20 0 IGADMO CCCNC(=O)c1cc(Cl)nc(N2C[C@@H]3CCC[C@H]([N@@H+](C)Cc4ccccn4)[C@@H]3C2)n1 ZINC001165021377 721832157 /nfs/dbraw/zinc/83/21/57/721832157.db2.gz FFMCCOGIJWUYJH-HQRMLTQVSA-N 1 1 442.995 3.402 20 0 IGADMO CCC[N@H+]1CCCC[C@@H]1c1ccc(N2CCN(Cc3nc(OC)cc(OC)n3)CC2)nc1 ZINC001165030241 721851375 /nfs/dbraw/zinc/85/13/75/721851375.db2.gz SIBZTCCPDLZKCF-HXUWFJFHSA-N 1 1 440.592 3.148 20 0 IGADMO CN(C)CC[N@H+]1CC[C@@H]2[C@@H]1CCN2c1nc(-c2cnccn2)nc2sc3c(c21)CCCC3 ZINC001164931514 721884727 /nfs/dbraw/zinc/88/47/27/721884727.db2.gz GGTKRRFLYOSJFW-RBUKOAKNSA-N 1 1 449.628 3.242 20 0 IGADMO C[NH+](C)CCN1CC[C@@H]2[C@@H]1CCN2c1nc(-c2cnccn2)nc2sc3c(c21)CCCC3 ZINC001164931514 721884728 /nfs/dbraw/zinc/88/47/28/721884728.db2.gz GGTKRRFLYOSJFW-RBUKOAKNSA-N 1 1 449.628 3.242 20 0 IGADMO Cn1ccc(CN2CCOCC23CCN(c2[nH+]cnc4c2ccn4C2CCCC2)CC3)n1 ZINC001164936771 721905971 /nfs/dbraw/zinc/90/59/71/721905971.db2.gz VMCYSRLRRWLHOL-UHFFFAOYSA-N 1 1 435.576 3.151 20 0 IGADMO Cc1noc(C)c1CN1CCO[C@@H]2CN(c3nc(Cl)ccc3C[NH+]3CCCC3)C[C@@H]21 ZINC001164940282 721948716 /nfs/dbraw/zinc/94/87/16/721948716.db2.gz AVQQKFOMEAORBH-VQTJNVASSA-N 1 1 431.968 3.025 20 0 IGADMO COC[C@@]12COC[C@@H]1CN(c1nc(C[NH+]3CCCC3)nc3sc4c(c31)CCCC4)C2 ZINC001164946952 721994819 /nfs/dbraw/zinc/99/48/19/721994819.db2.gz BGHYSDIZZSLIPE-HJPURHCSSA-N 1 1 428.602 3.265 20 0 IGADMO COC(OC)c1ccc(NC(=O)C(C)(C)C)c(N2CC[NH+](CCc3ccccn3)CC2)n1 ZINC001165056624 722015458 /nfs/dbraw/zinc/01/54/58/722015458.db2.gz ZAEMQNKQLZQRFR-UHFFFAOYSA-N 1 1 441.576 3.117 20 0 IGADMO CCOC(=O)Cc1nc(Cl)cc(N2CCC3(CC[N@@H+](Cc4cccnc4)C3)CC2)n1 ZINC001164952615 722016246 /nfs/dbraw/zinc/01/62/46/722016246.db2.gz OOXOTRCYNZOKTN-UHFFFAOYSA-N 1 1 429.952 3.123 20 0 IGADMO O=C(NCc1cccnc1)[C@@H]1C[C@@]12CCN(c1nc(Cl)ccc1C[NH+]1CCCC1)C2 ZINC001164961465 722033951 /nfs/dbraw/zinc/03/39/51/722033951.db2.gz VVGGIEMDLKWHKO-WMZHIEFXSA-N 1 1 425.964 3.259 20 0 IGADMO CC(C)C(=O)N[C@@H]1[C@H]2CN(c3nc(C[NH+]4CCCCC4)nc4sc5c(c43)CCC5)C[C@H]21 ZINC001164962508 722039659 /nfs/dbraw/zinc/03/96/59/722039659.db2.gz NRIWCRBRTHMTIM-LFUKPOHLSA-N 1 1 439.629 3.373 20 0 IGADMO Cc1noc(C[C@@H]2C[C@H]3CN(c4ccc5c(n4)CC[N@H+](Cc4ccccc4)C5)C[C@H]3O2)n1 ZINC001164961832 722040957 /nfs/dbraw/zinc/04/09/57/722040957.db2.gz NJDOTSSNYSKFAS-QNWVGRARSA-N 1 1 431.540 3.168 20 0 IGADMO COC(=O)c1cc(Cl)nc(N2CCC3(CC2)COCC[N@@H+](Cc2ccncc2)C3)c1 ZINC001164960499 722052852 /nfs/dbraw/zinc/05/28/52/722052852.db2.gz PXRCTHBQRMMZTD-UHFFFAOYSA-N 1 1 430.936 3.036 20 0 IGADMO c1cnc(-c2nc3sc4c(c3c(N3C[C@@H]5C[N@@H+](CC6CC6)C[C@H](C3)O5)n2)CCCC4)cn1 ZINC001164967733 722076338 /nfs/dbraw/zinc/07/63/38/722076338.db2.gz KZIFVFZCCHJSHA-CALCHBBNSA-N 1 1 448.596 3.327 20 0 IGADMO FC(F)(c1cnc(Cl)nc1Cl)N1CC[C@H]2C[N@@H+](Cc3cccnc3)CCO[C@@H]2C1 ZINC001164986398 722100984 /nfs/dbraw/zinc/10/09/84/722100984.db2.gz YXVROGVEOCTUSO-GOEBONIOSA-N 1 1 444.313 3.451 20 0 IGADMO COCc1cc(N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)nc(-c2ccccc2)n1 ZINC001164976353 722102406 /nfs/dbraw/zinc/10/24/06/722102406.db2.gz CQJQERGSVJWJPC-VWNXMTODSA-N 1 1 445.567 3.412 20 0 IGADMO FC(F)(COc1ccnc(Cl)c1)N1CC[C@@H]2C[N@@H+](Cc3cccnc3)CCO[C@@H]2C1 ZINC001164972557 722114461 /nfs/dbraw/zinc/11/44/61/722114461.db2.gz GBBRFJDECNXUFN-IEBWSBKVSA-N 1 1 438.906 3.325 20 0 IGADMO FC(F)(COc1cccc(Cl)n1)N1CC[C@@H]2C[N@@H+](Cc3cccnc3)CCO[C@@H]2C1 ZINC001164983078 722128072 /nfs/dbraw/zinc/12/80/72/722128072.db2.gz YAQCVSMLGBUYHE-QZTJIDSGSA-N 1 1 438.906 3.325 20 0 IGADMO Clc1nc2c(Cl)nccc2c(N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)n1 ZINC001164979686 722137562 /nfs/dbraw/zinc/13/75/62/722137562.db2.gz LSYCPITZRFFEAF-WBVHZDCISA-N 1 1 445.354 3.454 20 0 IGADMO COc1ccccc1-c1cc(N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)ncn1 ZINC001164980886 722144634 /nfs/dbraw/zinc/14/46/34/722144634.db2.gz NHPJZEXDYSHTPV-YKSBVNFPSA-N 1 1 431.540 3.275 20 0 IGADMO Cc1nc(-c2ccncc2)nc(N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)c1C ZINC001164975076 722148902 /nfs/dbraw/zinc/14/89/02/722148902.db2.gz DTSWLCUBFNIKTM-XZOQPEGZSA-N 1 1 430.556 3.278 20 0 IGADMO c1cncc(C[N@H+]2CCO[C@@H]3CN(c4cc(-c5nc(C6CC6)no5)ccn4)CC[C@@H]3C2)c1 ZINC001164973925 722151716 /nfs/dbraw/zinc/15/17/16/722151716.db2.gz NNMXDPSPYZTHAQ-NHCUHLMSSA-N 1 1 432.528 3.131 20 0 IGADMO CC[N@H+]1CCCC[C@H]1c1ccc(-n2c([C@@H]3COCCN3)nccc2=NCc2ccco2)nc1 ZINC001164987859 722172959 /nfs/dbraw/zinc/17/29/59/722172959.db2.gz OZRSTGCGYAMDNT-VXKWHMMOSA-N 1 1 448.571 3.169 20 0 IGADMO CCC[N@H+]1CCCC[C@H]1c1ccc(N2CCCn3c(CNC(=O)C(C)C)nnc3C2)nc1 ZINC001164989439 722190454 /nfs/dbraw/zinc/19/04/54/722190454.db2.gz NLUAMTWRKSXXIG-FQEVSTJZSA-N 1 1 439.608 3.293 20 0 IGADMO CCc1cc(N2CCC[C@@]3(CC[N@H+]3Cc3cccc(F)c3)C2)nc(N2CCOCC2)n1 ZINC001164996345 722204634 /nfs/dbraw/zinc/20/46/34/722204634.db2.gz UEIGOFBKUMQHBG-XMMPIXPASA-N 1 1 425.552 3.260 20 0 IGADMO C[NH+]1CCN(c2ncnc3c2CCN(C(F)(F)c2cnc(Cl)c(Cl)c2)CC3)CC1 ZINC001164996998 722229711 /nfs/dbraw/zinc/22/97/11/722229711.db2.gz LTJUVCPELSIDEU-UHFFFAOYSA-N 1 1 443.329 3.080 20 0 IGADMO C[NH+]1CCN(c2ncnc3c2CCN(c2nc4ccc(Cl)cc4nc2Cl)CC3)CC1 ZINC001164998204 722232337 /nfs/dbraw/zinc/23/23/37/722232337.db2.gz ZQRBZRUATPTINI-UHFFFAOYSA-N 1 1 444.370 3.084 20 0 IGADMO C[NH+]1CCN(c2ncnc3c2CCN(c2ncnc4cc(Cl)c(Cl)cc42)CC3)CC1 ZINC001164996783 722236173 /nfs/dbraw/zinc/23/61/73/722236173.db2.gz JBNBTUQEOWHYHF-UHFFFAOYSA-N 1 1 444.370 3.084 20 0 IGADMO CCN(CC)S(=O)(=O)c1ccc(N2CCC[C@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)nc1 ZINC001164626844 719097142 /nfs/dbraw/zinc/09/71/42/719097142.db2.gz JEKMLIAVYZUVHR-UNMCSNQZSA-N 1 1 428.602 3.213 20 0 IGADMO CCOC(=O)c1cc2ncnc(N3CCc4c(C[NH+](C)C)nn(C(C)C)c4C3)c2s1 ZINC001164648298 719313647 /nfs/dbraw/zinc/31/36/47/719313647.db2.gz HRHPAJIUHHDDLO-UHFFFAOYSA-N 1 1 428.562 3.270 20 0 IGADMO CN(C)c1nc(N2CCOC[C@]3(CCCN([C@@H](F)c4ccnc(Cl)c4)C3)C2)cc[nH+]1 ZINC001164663793 719356995 /nfs/dbraw/zinc/35/69/95/719356995.db2.gz HEKCVYBWNUSZCF-TZIWHRDSSA-N 1 1 434.947 3.178 20 0 IGADMO CN(C)c1nccc(N2CCOC[C@@]3(CCC[N@H+](C(C)(C)c4ccnc(Cl)c4)C3)C2)n1 ZINC001164664627 719357529 /nfs/dbraw/zinc/35/75/29/719357529.db2.gz PTDNFBVYKDPOJE-QHCPKHFHSA-N 1 1 445.011 3.445 20 0 IGADMO COC(=O)c1ccc(N2CCC3(CCC[N@H+]3Cc3csc(C)n3)CC2)nc1C(=O)OC ZINC001164692298 719804610 /nfs/dbraw/zinc/80/46/10/719804610.db2.gz MWKQOMJGZNVBSG-UHFFFAOYSA-N 1 1 444.557 3.055 20 0 IGADMO Cc1nc(C[N@@H+]2CCCC23CCN(c2nnc(Cl)c4c2N(C)CCO4)CC3)cs1 ZINC001164693592 719812631 /nfs/dbraw/zinc/81/26/31/719812631.db2.gz WWSMEMZSTAJCGJ-UHFFFAOYSA-N 1 1 434.997 3.359 20 0 IGADMO COC(=O)[C@]1(C)C[C@H]([NH+]2CCOCC2)CCN1c1cc(Cl)nc2cc(OC)ccc21 ZINC001164702006 719853795 /nfs/dbraw/zinc/85/37/95/719853795.db2.gz MJJXWSCDKGDLOY-QRQCRPRQSA-N 1 1 433.936 3.130 20 0 IGADMO CCOC(=O)c1sc2ncnc(N3CC[C@@]4(C3)C[N@@H+](CC3CC3)C[C@@H]4COC)c2c1C ZINC001164806434 720068743 /nfs/dbraw/zinc/06/87/43/720068743.db2.gz CSUPREQOMKIWHF-HXOBKFHXSA-N 1 1 444.601 3.361 20 0 IGADMO COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1cc(C(=O)OC)c(Cl)cn1)CC2 ZINC001164711180 720097502 /nfs/dbraw/zinc/09/75/02/720097502.db2.gz OZHHEYUTYVTYID-SFHVURJKSA-N 1 1 444.963 3.424 20 0 IGADMO COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1nccc(Cl)c1C(=O)OC)CC2 ZINC001164711564 720098493 /nfs/dbraw/zinc/09/84/93/720098493.db2.gz QVXOUVSOGWELFL-SFHVURJKSA-N 1 1 444.963 3.424 20 0 IGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1ncnc3c1CCN(Cc1ccccc1)C3)C2 ZINC001164814396 720105567 /nfs/dbraw/zinc/10/55/67/720105567.db2.gz SFPNURSMNKHEPW-HOFKKMOUSA-N 1 1 447.627 3.220 20 0 IGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1nc(C)nc3cc(OC)c(OC)cc31)C2 ZINC001164808176 720117851 /nfs/dbraw/zinc/11/78/51/720117851.db2.gz DURJFPRZDCWLOY-UUOWRZLLSA-N 1 1 426.561 3.140 20 0 IGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1nc(Cl)nc3cc(C(=O)OC)ccc31)C2 ZINC001164813827 720118742 /nfs/dbraw/zinc/11/87/42/720118742.db2.gz RBNWMQOZFWSADZ-HXOBKFHXSA-N 1 1 444.963 3.255 20 0 IGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1nc3cc(OC)c(OC)cc3nc1Cl)C2 ZINC001164813870 720119788 /nfs/dbraw/zinc/11/97/88/720119788.db2.gz RJANTIGZXCVRJH-WAIKUNEKSA-N 1 1 446.979 3.485 20 0 IGADMO CCOC(=O)c1nc(Cl)nc(Cl)c1N1CC[C@@]2(C1)C[N@@H+](CC1CC1)C[C@H]2COC ZINC001164808691 720128327 /nfs/dbraw/zinc/12/83/27/720128327.db2.gz GBLRPQWGWKEDNE-XOBRGWDASA-N 1 1 443.375 3.145 20 0 IGADMO COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1nccnc1OCC(C)C)CC2 ZINC001164714007 720150709 /nfs/dbraw/zinc/15/07/09/720150709.db2.gz VCLJXHSDAKYAQJ-NRFANRHFSA-N 1 1 425.577 3.414 20 0 IGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(C(F)(F)c1cc(Cl)ncc1C(=O)OC)C2 ZINC001164812418 720164035 /nfs/dbraw/zinc/16/40/35/720164035.db2.gz AMSKCXBCXLMONE-MGPUTAFESA-N 1 1 443.922 3.251 20 0 IGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1ncccc1C(=O)N1CCc3ccccc31)C2 ZINC001164815556 720165448 /nfs/dbraw/zinc/16/54/48/720165448.db2.gz IDPCDQJFUNNDCT-WXVAWEFUSA-N 1 1 446.595 3.469 20 0 IGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1ccc(C(=O)N3CCC(C)CC3)cn1)C2 ZINC001164819550 720166804 /nfs/dbraw/zinc/16/68/04/720166804.db2.gz XSZBMYFEABWQPS-RCZVLFRGSA-N 1 1 426.605 3.138 20 0 IGADMO Cc1ccc2nc(N3CCCn4c(=O)cc(C[N@H+](C)C(C)C)nc4C3)c(Cl)nc2c1 ZINC001164814755 720220774 /nfs/dbraw/zinc/22/07/74/720220774.db2.gz YFPYJRHZANOKHE-UHFFFAOYSA-N 1 1 426.952 3.399 20 0 IGADMO CC(C)[N@@H+](C)Cc1cc(=O)n2c(n1)CN(c1nc(Cl)nc3c(F)cccc31)CCC2 ZINC001164813966 720220859 /nfs/dbraw/zinc/22/08/59/720220859.db2.gz QJJLJTZYSJCMMX-UHFFFAOYSA-N 1 1 430.915 3.230 20 0 IGADMO CCOC(=O)c1cc(N2CCCn3c(=O)cc(C[N@@H+](C)C(C)C)nc3C2)nc2ccccc21 ZINC001164814095 720221671 /nfs/dbraw/zinc/22/16/71/720221671.db2.gz SYBHUDQEOJSECJ-UHFFFAOYSA-N 1 1 449.555 3.219 20 0 IGADMO Cc1cc(Cl)ncc1C(F)(F)N1CCCn2c(=O)cc(C[N@H+](C)C(C)C)nc2C1 ZINC001164814736 720223410 /nfs/dbraw/zinc/22/34/10/720223410.db2.gz XJDHMDKMTLUSEE-UHFFFAOYSA-N 1 1 425.911 3.396 20 0 IGADMO CCOC(=O)c1cnc(Cl)c(C)c1N1CCCn2c(=O)cc(C[N@@H+](C)C(C)C)nc2C1 ZINC001164812175 720227642 /nfs/dbraw/zinc/22/76/42/720227642.db2.gz GDZWYAFUOSBVNT-UHFFFAOYSA-N 1 1 447.967 3.027 20 0 IGADMO CC(C)[N@@H+](C)Cc1cc(=O)n2c(n1)CN(C(F)(F)COc1cccc(Cl)n1)CCC2 ZINC001164812854 720229699 /nfs/dbraw/zinc/22/96/99/720229699.db2.gz JGHUYMQGMRDUBT-UHFFFAOYSA-N 1 1 441.910 3.009 20 0 IGADMO COC(=O)c1ccc(NC(=O)C(C)(C)C)c(N2CC[C@@H]3[C@H]2CC[N@H+]3Cc2cccnc2)n1 ZINC001164730970 720416332 /nfs/dbraw/zinc/41/63/32/720416332.db2.gz KNOFKPFZGGMFPS-WOJBJXKFSA-N 1 1 437.544 3.101 20 0 IGADMO FC(F)[C@](F)(COc1cncc(Cl)n1)N1CC[C@@H]2[C@H]1CC[N@@H+]2Cc1cccnc1 ZINC001164730161 720452890 /nfs/dbraw/zinc/45/28/90/720452890.db2.gz IDDHRZBATAYNOR-CLCXKQKWSA-N 1 1 427.858 3.184 20 0 IGADMO FC(F)[C@](F)(COc1cncc(Cl)n1)N1CC[C@@H]2[C@H]1CC[N@H+]2Cc1cccnc1 ZINC001164730161 720452899 /nfs/dbraw/zinc/45/28/99/720452899.db2.gz IDDHRZBATAYNOR-CLCXKQKWSA-N 1 1 427.858 3.184 20 0 IGADMO COc1ccc(-c2ccc(N3CC[C@@H]4[C@H]3CC[N@H+]4Cc3cccnc3)nn2)c(OC)c1OC ZINC001164728901 720466013 /nfs/dbraw/zinc/46/60/13/720466013.db2.gz PKDWRFZMYCYYMD-NHCUHLMSSA-N 1 1 447.539 3.418 20 0 IGADMO CCOC(=O)c1cc2ccc(N3CC[C@@H]4[C@H](C[C@H](Cn5cccn5)[N@H+]4C(C)C)C3)[nH]c-2n1 ZINC001164840143 720573194 /nfs/dbraw/zinc/57/31/94/720573194.db2.gz RTSPFWZUXJTEIE-SFHLNBCPSA-N 1 1 436.560 3.314 20 0 IGADMO CCOC(=O)c1cc2ccc(N3CC[C@@H]4[C@H](C[C@H](Cn5cccn5)[N@@H+]4C(C)C)C3)nc2[nH]1 ZINC001164840143 720573205 /nfs/dbraw/zinc/57/32/05/720573205.db2.gz RTSPFWZUXJTEIE-SFHLNBCPSA-N 1 1 436.560 3.314 20 0 IGADMO CCOC(=O)c1cc2ccc(N3CC[C@@H]4[C@H](C[C@H](Cn5cccn5)[N@H+]4C(C)C)C3)nc2[nH]1 ZINC001164840143 720573219 /nfs/dbraw/zinc/57/32/19/720573219.db2.gz RTSPFWZUXJTEIE-SFHLNBCPSA-N 1 1 436.560 3.314 20 0 IGADMO CC(C)[N@@H+]1[C@@H]2CCN(c3ncc(C(=O)N(C)C)cc3Cl)C[C@@H]2C[C@H]1Cn1cccn1 ZINC001164839247 720612491 /nfs/dbraw/zinc/61/24/91/720612491.db2.gz MWFMJUANGCTMEV-CMKODMSKSA-N 1 1 430.984 3.011 20 0 IGADMO c1sc2ncnc(N3CC[N@@H+]4C[C@@H](Oc5cncnc5)C[C@H]4C3)c2c1-c1ccccc1 ZINC001164744402 720658288 /nfs/dbraw/zinc/65/82/88/720658288.db2.gz ZTPVKGDOOIEJDO-ROUUACIJSA-N 1 1 430.537 3.490 20 0 IGADMO COC(=O)c1cc(OC)cnc1N1CCC2(C[C@@H]([N@@H+](C)Cc3ccccc3)CO2)CC1 ZINC001164844845 720679873 /nfs/dbraw/zinc/67/98/73/720679873.db2.gz VMWHAPBJPJVCGG-LJQANCHMSA-N 1 1 425.529 3.137 20 0 IGADMO CON(C)C(=O)c1cc(C)cnc1N1CCC2(C[C@@H]([N@@H+](C)Cc3ccccc3)CO2)CC1 ZINC001164841598 720705328 /nfs/dbraw/zinc/70/53/28/720705328.db2.gz UXURWXWVEQVDRW-OAQYLSRUSA-N 1 1 438.572 3.283 20 0 IGADMO CCOC(=O)c1cnc(CC)nc1N1CCC2(C[C@H]([N@@H+](C)Cc3ccccc3)CO2)CC1 ZINC001164838328 720722727 /nfs/dbraw/zinc/72/27/27/720722727.db2.gz HZUCAFHOESVKQW-FQEVSTJZSA-N 1 1 438.572 3.476 20 0 IGADMO Fc1ccc(-c2ccc(Cl)nn2)c(N2CC[N@H+]3C[C@@H](Oc4cncnc4)C[C@@H]3C2)c1 ZINC001164741867 720781603 /nfs/dbraw/zinc/78/16/03/720781603.db2.gz NGAYRIOUFHXUAL-CVEARBPZSA-N 1 1 426.883 3.068 20 0 IGADMO Cc1ccc(Oc2nc(Cl)ncc2N2CC[N@H+]3C[C@H](Oc4cncnc4)C[C@@H]3C2)cc1 ZINC001164742293 720803195 /nfs/dbraw/zinc/80/31/95/720803195.db2.gz CTKNNFCPVXSFTI-SJLPKXTDSA-N 1 1 438.919 3.363 20 0 IGADMO O=C1[C@H]2CN(c3ccc4c(n3)CC[N@H+](Cc3ccccc3)C4)C[C@@H]2CN1Cc1ccncc1 ZINC001164851983 720810410 /nfs/dbraw/zinc/81/04/10/720810410.db2.gz MEYKJBQCEPRYAJ-RPWUZVMVSA-N 1 1 439.563 3.130 20 0 IGADMO CC(C)(C)OC(=O)c1ccnc(N2CC[C@@H]3[C@H](C[C@@H](Cn4cncn4)[N@H+]3CC3CC3)C2)c1 ZINC001164742057 720815505 /nfs/dbraw/zinc/81/55/05/720815505.db2.gz PGIIPIJCLJLPTE-QHAWAJNXSA-N 1 1 438.576 3.008 20 0 IGADMO Fc1cccc2c1nc(Cl)nc2N1CC[C@@H]2[C@@H](C[C@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164737970 720824944 /nfs/dbraw/zinc/82/49/44/720824944.db2.gz CTJYLAGEEANGOM-FRQCXROJSA-N 1 1 441.942 3.393 20 0 IGADMO Fc1ccc(-c2ccnc(N3CC[C@@H]4[C@@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)n2)cc1 ZINC001164742671 720826035 /nfs/dbraw/zinc/82/60/35/720826035.db2.gz QKWRQZXFVNRMPG-IEIRFRATSA-N 1 1 433.535 3.254 20 0 IGADMO COc1cc2ccnc(N3CC[C@@H]4[C@@H](C[C@H](Cn5cncn5)[N@@H+]4CC4CC4)C3)c2cc1OC ZINC001164745573 720832315 /nfs/dbraw/zinc/83/23/15/720832315.db2.gz WVNJZCOGBKSZTQ-TUNNFDKTSA-N 1 1 448.571 3.223 20 0 IGADMO COc1cc2ccnc(N3CC[C@@H]4[C@@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)c2cc1OC ZINC001164745573 720832318 /nfs/dbraw/zinc/83/23/18/720832318.db2.gz WVNJZCOGBKSZTQ-TUNNFDKTSA-N 1 1 448.571 3.223 20 0 IGADMO CSc1nc2ccccc2c(N2CC[C@@H]3[C@H](C[C@@H](Cn4cncn4)[N@H+]3CC3CC3)C2)n1 ZINC001164750224 720832783 /nfs/dbraw/zinc/83/27/83/720832783.db2.gz WSDUWUOFCFJQOY-LVCYWYKZSA-N 1 1 435.601 3.323 20 0 IGADMO c1ncn(C[C@H]2C[C@H]3CN(c4cc(OCc5ccccc5)cnn4)CC[C@H]3[N@@H+]2CC2CC2)n1 ZINC001164751000 720835037 /nfs/dbraw/zinc/83/50/37/720835037.db2.gz XOOUABRHCFDCFD-WMTXJRDZSA-N 1 1 445.571 3.027 20 0 IGADMO COCC[N@H+]1CCO[C@@H]2CN(C(F)(F)c3ccc4ncc(Cl)nc4c3)CC[C@H]2C1 ZINC001164849644 720842328 /nfs/dbraw/zinc/84/23/28/720842328.db2.gz CENNBMYQEUIQPI-KBXCAEBGSA-N 1 1 426.895 3.002 20 0 IGADMO CCc1cc2c(nc(Cl)nc2N2CC[C@@H]3[C@@H](C[C@@H](Cn4cncn4)[N@H+]3CC3CC3)C2)[nH]1 ZINC001164747541 720843109 /nfs/dbraw/zinc/84/31/09/720843109.db2.gz REFRBANKHGUSLX-VDZJLULYSA-N 1 1 440.983 3.145 20 0 IGADMO c1ncn(C[C@H]2C[C@H]3CN(c4ncnc5sc6c(c54)CCC6)CC[C@H]3[N@H+]2CC2CC2)n1 ZINC001164740531 720845757 /nfs/dbraw/zinc/84/57/57/720845757.db2.gz CHRWTJXHYAPTIM-YQVWRLOYSA-N 1 1 435.601 3.151 20 0 IGADMO Fc1ccc(Oc2ccnc(N3CC[C@@H]4[C@@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)n2)cc1 ZINC001164749346 720851651 /nfs/dbraw/zinc/85/16/51/720851651.db2.gz NBGHPEXFUSPUJI-RCZSKKKRSA-N 1 1 449.534 3.379 20 0 IGADMO COCC[N@H+]1CCO[C@@H]2CN(c3nc(-c4ccccc4)nc(-c4ccccc4)n3)CC[C@H]2C1 ZINC001164850162 720851948 /nfs/dbraw/zinc/85/19/48/720851948.db2.gz DPIVGAHUOFTCEX-XZOQPEGZSA-N 1 1 445.567 3.379 20 0 IGADMO COc1cc2ccnc(N3CC[C@@H]4[C@@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)c2cc1F ZINC001164744692 720858441 /nfs/dbraw/zinc/85/84/41/720858441.db2.gz CFGHZSZCAPEJGJ-NNMXDRDESA-N 1 1 436.535 3.353 20 0 IGADMO c1ncn(C[C@@H]2C[C@@H]3CN(c4cncc(OCC5CCCC5)n4)CC[C@@H]3[N@@H+]2CC2CC2)n1 ZINC001164752010 720858600 /nfs/dbraw/zinc/85/86/00/720858600.db2.gz SHZPGRJICZKWTM-FSSWDIPSSA-N 1 1 437.592 3.017 20 0 IGADMO c1cncc(COC[C@@H]2C[N@@H+](CC3CC3)C[C@@]23CCN(c2nccc(N4CCCC4)n2)C3)c1 ZINC001164747174 720867390 /nfs/dbraw/zinc/86/73/90/720867390.db2.gz AIBYVNLISMTSTQ-JYFHCDHNSA-N 1 1 448.615 3.227 20 0 IGADMO c1cncc(COC[C@@H]2C[N@@H+](CC3CC3)C[C@]23CCN(c2nccc(NC4CC4)n2)C3)c1 ZINC001164754413 720868346 /nfs/dbraw/zinc/86/83/46/720868346.db2.gz RRPBCNTZEZCEJJ-OFVILXPXSA-N 1 1 434.588 3.201 20 0 IGADMO CCOC(=O)c1c(Cl)c2ccccc2nc1N1CC[C@H]2C[N@@H+](CCOC)CCO[C@H]2C1 ZINC001164855149 720874360 /nfs/dbraw/zinc/87/43/60/720874360.db2.gz GKEGQYCJBZZVBM-LPHOPBHVSA-N 1 1 447.963 3.238 20 0 IGADMO COCC[N@H+]1CCO[C@@H]2CN(c3ccc(C(=O)Nc4cccc(Cl)c4)cn3)CC[C@H]2C1 ZINC001164859217 720876561 /nfs/dbraw/zinc/87/65/61/720876561.db2.gz MAZLXCQGHKRDFO-GHTZIAJQSA-N 1 1 444.963 3.161 20 0 IGADMO COCC[N@H+]1CCO[C@H]2CN(c3cnc(Cl)nc3Oc3ccc(F)cc3)CC[C@@H]2C1 ZINC001164864241 720878022 /nfs/dbraw/zinc/87/80/22/720878022.db2.gz VFQYKGDKMNYEKM-BEFAXECRSA-N 1 1 436.915 3.235 20 0 IGADMO Clc1nc(Cl)nc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COCc2cccnc2)n1 ZINC001164752896 720881229 /nfs/dbraw/zinc/88/12/29/720881229.db2.gz NIPYBWPAYOZTRO-UWJYYQICSA-N 1 1 449.386 3.329 20 0 IGADMO COCc1cc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COCc2cccnc2)nc(C)n1 ZINC001164758818 720885379 /nfs/dbraw/zinc/88/53/79/720885379.db2.gz ZQQRSYAHHSGSOS-RCZVLFRGSA-N 1 1 437.588 3.082 20 0 IGADMO FC(F)Oc1cnc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COCc2cccnc2)nc1 ZINC001164754496 720896535 /nfs/dbraw/zinc/89/65/35/720896535.db2.gz JCOPTCNFTKFMAQ-AUSIDOKSSA-N 1 1 445.514 3.228 20 0 IGADMO c1cncc(COC[C@@H]2C[N@@H+](CC3CC3)C[C@@]23CCN(c2cncc(N4CCCC4)n2)C3)c1 ZINC001164751618 720898484 /nfs/dbraw/zinc/89/84/84/720898484.db2.gz CZAWJCHYSXXORW-JYFHCDHNSA-N 1 1 448.615 3.227 20 0 IGADMO Cc1noc2ncnc(N3CC[C@]4(C3)C[N@@H+](CC3CC3)C[C@H]4COCc3cccnc3)c12 ZINC001164749102 720924901 /nfs/dbraw/zinc/92/49/01/720924901.db2.gz HSZVOYVNZOBXBQ-GBXCKJPGSA-N 1 1 434.544 3.076 20 0 IGADMO Cc1noc2ncnc(N3CC[C@]4(C3)C[N@@H+](CC3CC3)C[C@@H]4COCc3cccnc3)c12 ZINC001164749104 720925973 /nfs/dbraw/zinc/92/59/73/720925973.db2.gz HSZVOYVNZOBXBQ-HYBUGGRVSA-N 1 1 434.544 3.076 20 0 IGADMO CC(C)[N@@H+](C)Cc1cnc2n1CCN(c1nc(CO)ccc1NC(=O)C(C)(C)C)[C@@H]2C ZINC001164859683 720988424 /nfs/dbraw/zinc/98/84/24/720988424.db2.gz LHXMDXSOYUAUKD-MRXNPFEDSA-N 1 1 428.581 3.176 20 0 IGADMO COc1ccc2nc(Cl)nc(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@H]4C3)c2c1 ZINC001164870649 721042284 /nfs/dbraw/zinc/04/22/84/721042284.db2.gz WNMZATPDQAMCCH-WMZOPIPTSA-N 1 1 425.920 3.167 20 0 IGADMO CCOC(=O)c1c(Cl)cc(C)nc1N1CC[N@H+]2C[C@@H](OCc3cccnc3)C[C@@H]2C1 ZINC001164869566 721050853 /nfs/dbraw/zinc/05/08/53/721050853.db2.gz UICNZFCOLOSGFS-MSOLQXFVSA-N 1 1 430.936 3.095 20 0 IGADMO CCOC(=O)c1c(C)cc(Cl)nc1N1CC[N@H+]2C[C@@H](OCc3cccnc3)C[C@H]2C1 ZINC001164871476 721072425 /nfs/dbraw/zinc/07/24/25/721072425.db2.gz YYZSWKMLQMFWGW-ROUUACIJSA-N 1 1 430.936 3.095 20 0 IGADMO CCOC(=O)c1cc(N2CC[N@H+]3C[C@@H](OCc4cccnc4)C[C@@H]3C2)nc2ccccc21 ZINC001164865631 721085278 /nfs/dbraw/zinc/08/52/78/721085278.db2.gz NSHABPHKAALRDO-UXHICEINSA-N 1 1 432.524 3.286 20 0 IGADMO CCOC(=O)c1cnc(Cl)c(C)c1N1CC[N@H+]2C[C@H](OCc3cccnc3)C[C@@H]2C1 ZINC001164862856 721098399 /nfs/dbraw/zinc/09/83/99/721098399.db2.gz BGLUOQUMWXBJKJ-QZTJIDSGSA-N 1 1 430.936 3.095 20 0 IGADMO FC(F)(c1ccc2ncnc(Cl)c2n1)N1CC[N@H+]2C[C@@H](OCc3cccnc3)C[C@@H]2C1 ZINC001164864567 721107377 /nfs/dbraw/zinc/10/73/77/721107377.db2.gz GLWNMVOGAOKLET-CVEARBPZSA-N 1 1 446.889 3.098 20 0 IGADMO FC(F)(c1cnc2c(Cl)ncnc2c1)N1CC[N@H+]2C[C@@H](OCc3cccnc3)C[C@@H]2C1 ZINC001164870383 721127843 /nfs/dbraw/zinc/12/78/43/721127843.db2.gz CROLJLXBKFCXJS-SJORKVTESA-N 1 1 446.889 3.098 20 0 IGADMO CCOc1cc2ncnc(N3C[C@@H]4CC[N@@H+](Cc5cnn(C)c5)C[C@@H]4C3)c2cc1OCC ZINC001164763392 721134278 /nfs/dbraw/zinc/13/42/78/721134278.db2.gz FLKCUZKMUOKLTO-RBUKOAKNSA-N 1 1 436.560 3.119 20 0 IGADMO CC(C)(C)OC(=O)Nc1ccc(N2CC[N@H+]3C[C@@H](OCc4cccnc4)C[C@@H]3C2)nc1 ZINC001164873609 721135011 /nfs/dbraw/zinc/13/50/11/721135011.db2.gz IYVINUVDWGGSQR-UXHICEINSA-N 1 1 425.533 3.303 20 0 IGADMO FC(F)(c1cc(C2CC2)nnc1Cl)N1CC[N@H+]2C[C@@H](OCc3cccnc3)C[C@@H]2C1 ZINC001164879836 721150312 /nfs/dbraw/zinc/15/03/12/721150312.db2.gz UJQRTYJWQQQVGS-SJORKVTESA-N 1 1 435.906 3.427 20 0 IGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(C(F)(F)Cc4nc(Cl)cc(Cl)n4)C[C@H]3C2)cn1 ZINC001164772341 721182348 /nfs/dbraw/zinc/18/23/48/721182348.db2.gz SJCHWWDZBSRMGJ-ZIAGYGMSSA-N 1 1 431.318 3.106 20 0 IGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4ccc(C(=O)OCc5ccccc5)cn4)C[C@H]3C2)cn1 ZINC001164762530 721212877 /nfs/dbraw/zinc/21/28/77/721212877.db2.gz CRYWEGVCCFVROO-DHIUTWEWSA-N 1 1 431.540 3.130 20 0 IGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(C(F)(F)c4nc(-c5ccc(Cl)nc5)no4)C[C@H]3C2)cn1 ZINC001164764793 721228373 /nfs/dbraw/zinc/22/83/73/721228373.db2.gz QESUZVSGNXIZDQ-JKSUJKDBSA-N 1 1 449.893 3.022 20 0 IGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(C(F)(F)c4nc(-c5ccc(Cl)nc5)no4)C[C@H]3C2)cn1 ZINC001164764790 721228907 /nfs/dbraw/zinc/22/89/07/721228907.db2.gz QESUZVSGNXIZDQ-HZPDHXFCSA-N 1 1 449.893 3.022 20 0 IGADMO Cc1sc2nc(C[NH+]3CCCC3)nc(N3CC4CC3(C(=O)N3CCCC3)C4)c2c1C ZINC001164873025 721237808 /nfs/dbraw/zinc/23/78/08/721237808.db2.gz OYDVHSGHRZVBMZ-UHFFFAOYSA-N 1 1 425.602 3.495 20 0 IGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@]2(CCCN(C(F)(F)c3cnnc(Cl)c3)C2)C1 ZINC001164780093 721350293 /nfs/dbraw/zinc/35/02/93/721350293.db2.gz ZNRNPLYEALUXNH-LJQANCHMSA-N 1 1 441.910 3.399 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@]2(CCCN(C(F)(F)c3cnnc(Cl)c3)C2)C1 ZINC001164780093 721350295 /nfs/dbraw/zinc/35/02/95/721350295.db2.gz ZNRNPLYEALUXNH-LJQANCHMSA-N 1 1 441.910 3.399 20 0 IGADMO O=C1C[C@H]2[C@H](CCN2c2ncnc3c2CC[N@H+](Cc2ccccc2)C3)N1c1ccsc1 ZINC001164883206 721355567 /nfs/dbraw/zinc/35/55/67/721355567.db2.gz ODFGCKFAKNYPQX-VXKWHMMOSA-N 1 1 431.565 3.481 20 0 IGADMO O=C1C[C@H]2[C@H](CCN2c2ncnc3c2CC[N@@H+](Cc2ccccc2)C3)N1c1ccsc1 ZINC001164883206 721355572 /nfs/dbraw/zinc/35/55/72/721355572.db2.gz ODFGCKFAKNYPQX-VXKWHMMOSA-N 1 1 431.565 3.481 20 0 IGADMO COc1cccc2ncnc(N3CCC[C@@]4(C3)COCC[N@@H+](Cc3c(C)noc3C)C4)c21 ZINC001164786064 721367343 /nfs/dbraw/zinc/36/73/43/721367343.db2.gz VNXAGEPRHAKCEV-XMMPIXPASA-N 1 1 437.544 3.362 20 0 IGADMO C[NH+]1CCN(C[C@H]2CCC[C@@]3(CCN(c4nc(Cl)nc5ccc(F)cc54)C3)O2)CC1 ZINC001164891857 721389029 /nfs/dbraw/zinc/38/90/29/721389029.db2.gz QXUMQXJEQZZDFM-VGSWGCGISA-N 1 1 433.959 3.188 20 0 IGADMO c1csc(C[NH+]2C[C@H]3CN(c4ncnc5c4CN(Cc4ccccc4)CC5)C[C@@H]3C2)n1 ZINC001164782822 721395708 /nfs/dbraw/zinc/39/57/08/721395708.db2.gz FVWPHYAOHARLPG-PMACEKPBSA-N 1 1 432.597 3.060 20 0 IGADMO Cc1cc2c(nc(Cl)nc2N2CC[C@]3(C2)CCC[C@H](CN2CC[NH+](C)CC2)O3)s1 ZINC001164886103 721400318 /nfs/dbraw/zinc/40/03/18/721400318.db2.gz HUPLYWYCJBNIDY-IERDGZPVSA-N 1 1 436.025 3.419 20 0 IGADMO COc1cc2nc(Cl)nc(N3C[C@@H]4C[N@@H+](Cc5nccs5)C[C@@H]4C3)c2cc1OC ZINC001164789888 721404009 /nfs/dbraw/zinc/40/40/09/721404009.db2.gz VBLMODRAPVUDES-BETUJISGSA-N 1 1 431.949 3.325 20 0 IGADMO COc1cc2nc(Cl)nc(N3C[C@@H]4C[N@H+](Cc5nccs5)C[C@@H]4C3)c2cc1OC ZINC001164789888 721404012 /nfs/dbraw/zinc/40/40/12/721404012.db2.gz VBLMODRAPVUDES-BETUJISGSA-N 1 1 431.949 3.325 20 0 IGADMO Cc1cc(Cl)ncc1C(F)(F)N1CC[C@]2(C1)CCC[C@@H](CN1CC[NH+](C)CC1)O2 ZINC001164886187 721412829 /nfs/dbraw/zinc/41/28/29/721412829.db2.gz IBIMWKZQEPSLBH-PXNSSMCTSA-N 1 1 428.955 3.354 20 0 IGADMO Cc1cc(Cl)ncc1C(F)(F)N1CC[C@@]2(C1)CCC[C@H](CN1CC[NH+](C)CC1)O2 ZINC001164886193 721412886 /nfs/dbraw/zinc/41/28/86/721412886.db2.gz IBIMWKZQEPSLBH-YLJYHZDGSA-N 1 1 428.955 3.354 20 0 IGADMO Cc1cc(Cl)ncc1C(F)(F)N1CC[C@@]2(C1)CCC[C@@H](CN1CC[NH+](C)CC1)O2 ZINC001164886179 721412935 /nfs/dbraw/zinc/41/29/35/721412935.db2.gz IBIMWKZQEPSLBH-FXAWDEMLSA-N 1 1 428.955 3.354 20 0 IGADMO Cc1nc2c3ccccc3oc2c(N2CC[C@]3(C2)CCC[C@@H](CN2CC[NH+](C)CC2)O3)n1 ZINC001164884013 721422052 /nfs/dbraw/zinc/42/20/52/721422052.db2.gz CXOZDJWSYGGZTG-DFBJGRDBSA-N 1 1 435.572 3.450 20 0 IGADMO C[NH+]1CCN(C[C@H]2CCC[C@@]3(CCN(c4cc(-c5ccc(F)cc5)ncn4)C3)O2)CC1 ZINC001164888706 721437882 /nfs/dbraw/zinc/43/78/82/721437882.db2.gz ANOSFJSWVZTQGR-QPPBQGQZSA-N 1 1 425.552 3.048 20 0 IGADMO Cc1cc(N2CC[C@@]3(C2)CCC[C@H](CN2CC[NH+](C)CC2)O3)nc(-c2cccs2)n1 ZINC001164899508 721440225 /nfs/dbraw/zinc/44/02/25/721440225.db2.gz YSNJLXWGWJSVJX-AUSIDOKSSA-N 1 1 427.618 3.279 20 0 IGADMO C[NH+]1CCN(C[C@H]2CCC[C@]3(CCN(c4nnc(Cl)c5ccc(F)cc54)C3)O2)CC1 ZINC001164899773 721443610 /nfs/dbraw/zinc/44/36/10/721443610.db2.gz YYYYHYSJIHJOBQ-VGOFRKELSA-N 1 1 433.959 3.188 20 0 IGADMO Cc1cc(-c2ccccc2F)nnc1N1CC[C@@]2(C1)CCC[C@@H](CN1CC[NH+](C)CC1)O2 ZINC001164891324 721447108 /nfs/dbraw/zinc/44/71/08/721447108.db2.gz UILCLGJUKAKKHB-NBGIEHNGSA-N 1 1 439.579 3.357 20 0 IGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(C(F)(F)c1cc(Cl)ncn1)CC2 ZINC001164786789 721448427 /nfs/dbraw/zinc/44/84/27/721448427.db2.gz NNRGZVDRXVIXOU-QGZVFWFLSA-N 1 1 444.954 3.409 20 0 IGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1nc(Cl)nc3cc[nH]c31)CC2 ZINC001164788716 721448488 /nfs/dbraw/zinc/44/84/88/721448488.db2.gz SXXWUEVQUDQZOE-KRWDZBQOSA-N 1 1 433.984 3.345 20 0 IGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1nc(Cl)nc3[nH]ccc31)CC2 ZINC001164787780 721448545 /nfs/dbraw/zinc/44/85/45/721448545.db2.gz QLMNGGFIUVLQJF-QGZVFWFLSA-N 1 1 433.984 3.345 20 0 IGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1ncnc3ccc(OC)cc31)CC2 ZINC001164783553 721454769 /nfs/dbraw/zinc/45/47/69/721454769.db2.gz CHJPCGIOIXXHRQ-FQEVSTJZSA-N 1 1 440.588 3.372 20 0 IGADMO CCN(CC)c1cc(N2CCC3(C[C@H](COCC4CC4)[N@@H+](CCOC)C3)CC2)ncn1 ZINC001164786830 721463724 /nfs/dbraw/zinc/46/37/24/721463724.db2.gz PQQLEVRBKJJNIY-OAQYLSRUSA-N 1 1 431.625 3.057 20 0 IGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1nc[nH]c3nc(=S)sc1-3)CC2 ZINC001164787164 721465180 /nfs/dbraw/zinc/46/51/80/721465180.db2.gz CWKRREVNTLEUGY-INIZCTEOSA-N 1 1 449.646 3.109 20 0 IGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2cncc(OCc3ccccc3)n2)[C@@H]2CCCO[C@H]12 ZINC001164807830 721537571 /nfs/dbraw/zinc/53/75/71/721537571.db2.gz RMAASUDDHKJVIM-RQTOMXEWSA-N 1 1 431.540 3.319 20 0 IGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2cncc(OCc3ccccc3)n2)[C@@H]2CCCO[C@H]12 ZINC001164807830 721537572 /nfs/dbraw/zinc/53/75/72/721537572.db2.gz RMAASUDDHKJVIM-RQTOMXEWSA-N 1 1 431.540 3.319 20 0 IGADMO Cc1cc(NC(=O)c2cccnc2N2CC[N@H+]3C[C@H](Oc4cccc(F)c4)C[C@@H]3C2)no1 ZINC001164903537 721552199 /nfs/dbraw/zinc/55/21/99/721552199.db2.gz CCMCEVFYFKYXPB-IEBWSBKVSA-N 1 1 437.475 3.111 20 0 IGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2nccc(OCc3ccccc3)n2)[C@H]2CCCO[C@@H]12 ZINC001164803128 721553598 /nfs/dbraw/zinc/55/35/98/721553598.db2.gz IFHQUEMPHCJXQW-WMTXJRDZSA-N 1 1 431.540 3.319 20 0 IGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2nccc(OCc3ccccc3)n2)[C@H]2CCCO[C@@H]12 ZINC001164803128 721553604 /nfs/dbraw/zinc/55/36/04/721553604.db2.gz IFHQUEMPHCJXQW-WMTXJRDZSA-N 1 1 431.540 3.319 20 0 IGADMO Cc1nc2c(nc(Cl)nc2N2C[C@H]([N@H+](C)Cc3cccnc3)[C@H]3OCCC[C@@H]32)s1 ZINC001164798183 721558952 /nfs/dbraw/zinc/55/89/52/721558952.db2.gz ANRJESDIEJAJEC-ZOBUZTSGSA-N 1 1 430.965 3.311 20 0 IGADMO Cc1nc2c(nc(Cl)nc2N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@H]3OCCC[C@@H]32)s1 ZINC001164798183 721558953 /nfs/dbraw/zinc/55/89/53/721558953.db2.gz ANRJESDIEJAJEC-ZOBUZTSGSA-N 1 1 430.965 3.311 20 0 IGADMO CN(C)c1ccc(-c2ccnc(N3C[C@H]([N@H+](C)Cc4cccnc4)[C@H]4OCCC[C@H]43)n2)cc1 ZINC001164806650 721570997 /nfs/dbraw/zinc/57/09/97/721570997.db2.gz QKGMWQHVERIKON-DSITVLBTSA-N 1 1 444.583 3.473 20 0 IGADMO CN(C)c1ccc(-c2ccnc(N3C[C@H]([N@@H+](C)Cc4cccnc4)[C@H]4OCCC[C@H]43)n2)cc1 ZINC001164806650 721571001 /nfs/dbraw/zinc/57/10/01/721571001.db2.gz QKGMWQHVERIKON-DSITVLBTSA-N 1 1 444.583 3.473 20 0 IGADMO CCOC(=O)c1cnc2cc(N3C[C@H]([N@@H+](C)Cc4cccnc4)[C@@H]4OCCC[C@@H]43)[nH]cc1-2 ZINC001164801187 721573704 /nfs/dbraw/zinc/57/37/04/721573704.db2.gz GJQIXASIRQKTNE-QNWVGRARSA-N 1 1 435.528 3.003 20 0 IGADMO CCOC(=O)c1cnc2cc(N3C[C@H]([N@@H+](C)Cc4cccnc4)[C@H]4OCCC[C@H]43)[nH]cc1-2 ZINC001164801185 721573733 /nfs/dbraw/zinc/57/37/33/721573733.db2.gz GJQIXASIRQKTNE-GIWBLDEGSA-N 1 1 435.528 3.003 20 0 IGADMO CC1CCN(C(=O)c2ccc(N3C[C@H]([N@@H+](C)Cc4cccnc4)[C@@H]4OCCC[C@@H]43)nc2)CC1 ZINC001164800224 721577113 /nfs/dbraw/zinc/57/71/13/721577113.db2.gz DJYACUULDWLNFO-SONWIMMPSA-N 1 1 449.599 3.217 20 0 IGADMO COc1ccccc1-c1ccc(N2C[C@H]([N@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@@H]32)nn1 ZINC001164808943 721578540 /nfs/dbraw/zinc/57/85/40/721578540.db2.gz RVKCMTDUHRVIII-WRALFONMSA-N 1 1 431.540 3.415 20 0 IGADMO COc1ccccc1-c1ccc(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@@H]32)nn1 ZINC001164808943 721578541 /nfs/dbraw/zinc/57/85/41/721578541.db2.gz RVKCMTDUHRVIII-WRALFONMSA-N 1 1 431.540 3.415 20 0 IGADMO CCOC(=O)Cc1ccc(N2CCC(F)(F)[C@]3(CC[N@@H+](Cc4ccccn4)C3)C2)nc1 ZINC001164904977 721705465 /nfs/dbraw/zinc/70/54/65/721705465.db2.gz GEBWWVILFMZYMN-QFIPXVFZSA-N 1 1 430.499 3.320 20 0 IGADMO CON(C)C(=O)c1cc(C)cnc1N1CCC(F)(F)[C@]2(CC[N@@H+](Cc3ccccn3)C2)C1 ZINC001164908555 721718573 /nfs/dbraw/zinc/71/85/73/721718573.db2.gz XYXPMWQLLYDJAN-QFIPXVFZSA-N 1 1 445.514 3.156 20 0 IGADMO F[C@@H](Oc1ccc(Cl)nn1)N1CCC(F)(F)[C@@]2(CC[N@@H+](Cc3ccccn3)C2)C1 ZINC001164910510 721738838 /nfs/dbraw/zinc/73/88/38/721738838.db2.gz FPPFHZZBKICEPP-QZTJIDSGSA-N 1 1 427.858 3.390 20 0 IGADMO CCOC(=O)c1cc(Cl)nnc1N1C[C@@H]2CCC[C@H]([N@@H+](C)Cc3ccccn3)[C@@H]2C1 ZINC001165027324 721806230 /nfs/dbraw/zinc/80/62/30/721806230.db2.gz VNJMPTJNILSLKR-IPELMVKDSA-N 1 1 429.952 3.439 20 0 IGADMO CCOC(=O)Cc1c(Cl)ncnc1N1C[C@@H]2CCC[C@H]([N@@H+](C)Cc3ccccn3)[C@H]2C1 ZINC001165022687 721813249 /nfs/dbraw/zinc/81/32/49/721813249.db2.gz GPYIUAHYDZFNNW-VDGAXYAQSA-N 1 1 443.979 3.368 20 0 IGADMO CCOC(=O)c1ncnc(Cl)c1N1C[C@@H]2CCC[C@@H]([N@@H+](C)Cc3ccccn3)[C@@H]2C1 ZINC001165023103 721821281 /nfs/dbraw/zinc/82/12/81/721821281.db2.gz HLFOAGASRMPSBW-CGTJXYLNSA-N 1 1 429.952 3.439 20 0 IGADMO C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@H]2CN(c3nc(Cl)ccc3S(C)(=O)=O)C[C@H]21 ZINC001165021437 721821703 /nfs/dbraw/zinc/82/17/03/721821703.db2.gz FPVJBFFPRCVBNW-CGTJXYLNSA-N 1 1 434.993 3.270 20 0 IGADMO Cc1nc2c(nc(Cl)nc2N2C[C@@H]3CCC[C@@H]([N@@H+](C)Cc4ccccn4)[C@@H]3C2)n1C ZINC001165026021 721822672 /nfs/dbraw/zinc/82/26/72/721822672.db2.gz OBSGFTQWVBLHCY-CGTJXYLNSA-N 1 1 425.968 3.457 20 0 IGADMO CN1CCc2nc(Cl)nc(N3C[C@@H]4CCC[C@H]([N@@H+](C)Cc5ccccn5)[C@H]4C3)c2C1 ZINC001165021329 721829955 /nfs/dbraw/zinc/82/99/55/721829955.db2.gz DYQUQKHAYPVNRV-MDKPJZGXSA-N 1 1 426.996 3.250 20 0 IGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2CC[C@@]3(C[C@@H](OCC(=O)N4CCCC4)CO3)C2)nc1 ZINC001164937300 721919276 /nfs/dbraw/zinc/91/92/76/721919276.db2.gz BEPKSTIBEXEZSW-TZBSWOFLSA-N 1 1 442.604 3.005 20 0 IGADMO COC(=O)c1cnc(N2CCC3(CC2)C[N@@H+](Cc2ccc(C)cc2)CCO3)cc1OC ZINC001164939378 721921899 /nfs/dbraw/zinc/92/18/99/721921899.db2.gz KQTHIFVYRHVLSZ-UHFFFAOYSA-N 1 1 425.529 3.057 20 0 IGADMO O=C1NCC[N@@H+](Cc2ccccc2)C12CCN(c1nnc(Cl)c3ccsc31)CC2 ZINC001164946912 721971206 /nfs/dbraw/zinc/97/12/06/721971206.db2.gz YXGUZXBOVNXOQA-UHFFFAOYSA-N 1 1 427.961 3.316 20 0 IGADMO O=C1NCC[N@H+](Cc2ccccc2)C12CCN(c1nnc(Cl)c3ccsc31)CC2 ZINC001164946912 721971208 /nfs/dbraw/zinc/97/12/08/721971208.db2.gz YXGUZXBOVNXOQA-UHFFFAOYSA-N 1 1 427.961 3.316 20 0 IGADMO COc1cc2ccnc(N3CCC4(CC3)C(=O)NCC[N@H+]4Cc3ccccc3)c2cc1F ZINC001164951422 721981237 /nfs/dbraw/zinc/98/12/37/721981237.db2.gz ZLXUWEOAINGVBQ-UHFFFAOYSA-N 1 1 434.515 3.354 20 0 IGADMO COc1cc2ccnc(N3CCC4(CC3)C(=O)NCC[N@@H+]4Cc3ccccc3)c2cc1F ZINC001164951422 721981238 /nfs/dbraw/zinc/98/12/38/721981238.db2.gz ZLXUWEOAINGVBQ-UHFFFAOYSA-N 1 1 434.515 3.354 20 0 IGADMO CC[N@H+]1CCCC[C@H]1c1ccc(N2CCN(C(=O)[C@H]3COc4ccccc4O3)CC2)nc1 ZINC001165049875 721981805 /nfs/dbraw/zinc/98/18/05/721981805.db2.gz NEKBDVYFPMXMPS-NZQKXSOJSA-N 1 1 436.556 3.117 20 0 IGADMO COC[C@]12COC[C@H]1CN(c1nc(C[NH+]3CCCC3)nc3sc4c(c31)CCCC4)C2 ZINC001164946960 721994871 /nfs/dbraw/zinc/99/48/71/721994871.db2.gz BGHYSDIZZSLIPE-WAIKUNEKSA-N 1 1 428.602 3.265 20 0 IGADMO Clc1nc2c(c(N3CC[NH+](CCc4ccccn4)CC3)n1)CN(Cc1ccccc1)CC2 ZINC001165053848 722009946 /nfs/dbraw/zinc/00/99/46/722009946.db2.gz MTXHSZQSIKJXMY-UHFFFAOYSA-N 1 1 449.002 3.448 20 0 IGADMO CCC[N@H+]1CCCC[C@@H]1c1ccc(N2CC[C@@]3(C2)C[C@H](NC(=O)N(C)C)CCO3)nc1 ZINC001164952737 722010927 /nfs/dbraw/zinc/01/09/27/722010927.db2.gz AYVOMEQFLLYTOT-LGVFNWMJSA-N 1 1 429.609 3.418 20 0 IGADMO Cc1cc(C(F)(F)N2CCC3(CC2)COCC[N@@H+](Cc2ccncc2)C3)nc(Cl)n1 ZINC001164963186 722054811 /nfs/dbraw/zinc/05/48/11/722054811.db2.gz HZTGUJAAZJKNOX-UHFFFAOYSA-N 1 1 437.922 3.497 20 0 IGADMO COC(=O)c1nc(N2CCC3(CC2)COCC[N@@H+](Cc2ccncc2)C3)ccc1Cl ZINC001164962960 722055682 /nfs/dbraw/zinc/05/56/82/722055682.db2.gz GDBJBFLKBRUSHF-UHFFFAOYSA-N 1 1 430.936 3.036 20 0 IGADMO COc1ccc2nc(N3CCC4(CC3)COCC[N@@H+](Cc3ccncc3)C4)nc(C)c2c1 ZINC001164964165 722057405 /nfs/dbraw/zinc/05/74/05/722057405.db2.gz SESFKXCWILZCAZ-UHFFFAOYSA-N 1 1 433.556 3.461 20 0 IGADMO Cc1cc(N2CCC3(CC2)COCC[N@@H+](Cc2ccncc2)C3)nc(-c2ccccn2)n1 ZINC001164960672 722059443 /nfs/dbraw/zinc/05/94/43/722059443.db2.gz GRCJQRQPAKDXID-UHFFFAOYSA-N 1 1 430.556 3.361 20 0 IGADMO Clc1cc(-c2ccncc2)c(N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)nn1 ZINC001164986055 722104241 /nfs/dbraw/zinc/10/42/41/722104241.db2.gz XVBHFCVJPBNTNM-TZIWHRDSSA-N 1 1 436.947 3.314 20 0 IGADMO FC(F)(c1nc(Cl)ncc1Cl)N1CC[C@@H]2C[N@@H+](Cc3cccnc3)CCO[C@H]2C1 ZINC001164983885 722107133 /nfs/dbraw/zinc/10/71/33/722107133.db2.gz QVPICWBEIXZBQV-ZBFHGGJFSA-N 1 1 444.313 3.451 20 0 IGADMO COC(=O)c1ccc2ccnc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)c2c1 ZINC001164979257 722110976 /nfs/dbraw/zinc/11/09/76/722110976.db2.gz PQWABNJBLSFCFN-JTHBVZDNSA-N 1 1 432.524 3.144 20 0 IGADMO COc1cc2c(cc1Cl)ncnc2N1CC[C@H]2C[N@@H+](Cc3cccnc3)CCO[C@H]2C1 ZINC001164981997 722120096 /nfs/dbraw/zinc/12/00/96/722120096.db2.gz VPYILDWYERGWRF-JTSKRJEESA-N 1 1 439.947 3.414 20 0 IGADMO c1ccc(COc2cnc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)cn2)cc1 ZINC001164984936 722133690 /nfs/dbraw/zinc/13/36/90/722133690.db2.gz YLFWGWCCMKDCJO-XZOQPEGZSA-N 1 1 431.540 3.178 20 0 IGADMO C[C@@H]1CCCN(C(=O)c2ccc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)nc2)C1 ZINC001164972729 722139516 /nfs/dbraw/zinc/13/95/16/722139516.db2.gz AKTAITRQUUCABO-HUVFLSCGSA-N 1 1 449.599 3.076 20 0 IGADMO CC1CCN(C(=O)c2ccc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)nc2)CC1 ZINC001164972636 722141009 /nfs/dbraw/zinc/14/10/09/722141009.db2.gz AFUJHLQGHDJWOY-RPWUZVMVSA-N 1 1 449.599 3.076 20 0 IGADMO COc1ccccc1-c1ccc(N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)nn1 ZINC001164985088 722141438 /nfs/dbraw/zinc/14/14/38/722141438.db2.gz ZELPULJERNHFIM-RDPSFJRHSA-N 1 1 431.540 3.275 20 0 IGADMO c1cncc(C[N@H+]2CCO[C@H]3CN(c4nc(-c5cccnc5)nc5c4CCC5)CC[C@H]3C2)c1 ZINC001164985499 722149354 /nfs/dbraw/zinc/14/93/54/722149354.db2.gz ZQZGBWZKPWXCFG-URXFXBBRSA-N 1 1 442.567 3.150 20 0 IGADMO COc1cc2nc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)ccc2c(OC)c1 ZINC001164976362 722153329 /nfs/dbraw/zinc/15/33/29/722153329.db2.gz WTGSGRYNXYZDEJ-DVECYGJZSA-N 1 1 434.540 3.374 20 0 IGADMO CCCSc1ncnc(N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)c1OC ZINC001164971682 722156343 /nfs/dbraw/zinc/15/63/43/722156343.db2.gz CYQNMYVLXWQYHN-MOPGFXCFSA-N 1 1 429.590 3.110 20 0 IGADMO C[NH+]1CCN(c2ncnc3c2CCN(C(F)(F)c2ccnc(Cl)c2Cl)CC3)CC1 ZINC001164997733 722230275 /nfs/dbraw/zinc/23/02/75/722230275.db2.gz UZRVZOCWYQOIQE-UHFFFAOYSA-N 1 1 443.329 3.080 20 0 IGADMO C[NH+]1CCN(c2ncnc3c2CCN(c2ncnc4cc(C(C)(C)C)sc42)CC3)CC1 ZINC001164996083 722231262 /nfs/dbraw/zinc/23/12/62/722231262.db2.gz DFNSHFIFGIFZES-UHFFFAOYSA-N 1 1 437.617 3.136 20 0 IGADMO Cc1cccc(Sc2cncc(N3CCc4ncnc(N5CC[NH+](C)CC5)c4CC3)n2)c1 ZINC001164997135 722235935 /nfs/dbraw/zinc/23/59/35/722235935.db2.gz LNGVAAVTMLFHSZ-UHFFFAOYSA-N 1 1 447.612 3.083 20 0 IGADMO CC(=O)c1ccc(NC(=O)CC[NH+]2CCN(c3ccc(Br)cn3)CC2)cc1 ZINC000029555729 534858033 /nfs/dbraw/zinc/85/80/33/534858033.db2.gz TUGIYBSWNCLKBY-UHFFFAOYSA-N 1 1 431.334 3.198 20 0 IGADMO O=C(c1cnc(N2CCC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)c(Cl)c1)N1CCOCC1 ZINC001164629590 719099817 /nfs/dbraw/zinc/09/98/17/719099817.db2.gz STZUSANDUXOYBE-KNQAVFIVSA-N 1 1 440.975 3.308 20 0 IGADMO CC1CC[NH+](Cc2nc3scc(-c4cccs4)c3c(N(C)C[C@H](O)CO)n2)CC1 ZINC001164670055 719366242 /nfs/dbraw/zinc/36/62/42/719366242.db2.gz SMBQKRVAFJSEIR-HNNXBMFYSA-N 1 1 432.615 3.441 20 0 IGADMO c1csc(CN2CCOC3(CCN(c4ccc(OCC5CC[NH2+]CC5)cn4)CC3)C2)c1 ZINC001164705935 719907021 /nfs/dbraw/zinc/90/70/21/719907021.db2.gz GADUMLAAIOGGCL-UHFFFAOYSA-N 1 1 442.629 3.393 20 0 IGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2CCOC[C@@]3(CC[C@H](Cn4cccn4)O3)C2)nc1 ZINC001164804526 720051861 /nfs/dbraw/zinc/05/18/61/720051861.db2.gz LLXHHQOMDYWQAK-CQOQZXRMSA-N 1 1 425.577 3.280 20 0 IGADMO CC[NH+](CC)Cc1nc2sc(C)c(C)c2c(N2C[C@@H]3COC[C@]3(c3nc(C)no3)C2)n1 ZINC001164801024 720060431 /nfs/dbraw/zinc/06/04/31/720060431.db2.gz FMBZGGBERPEHDS-OPAMFIHVSA-N 1 1 442.589 3.246 20 0 IGADMO COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1ncc(Cl)cc1C(=O)OC)CC2 ZINC001164712618 720097624 /nfs/dbraw/zinc/09/76/24/720097624.db2.gz XITHFKJCWSPUAQ-LJQANCHMSA-N 1 1 444.963 3.424 20 0 IGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1ncnc3c1CCN(Cc1ccccc1)C3)C2 ZINC001164814400 720105719 /nfs/dbraw/zinc/10/57/19/720105719.db2.gz SFPNURSMNKHEPW-WNCULLNHSA-N 1 1 447.627 3.220 20 0 IGADMO CCOC(=O)c1cnc(N2CCC3(C[C@H](COC)[N@@H+](Cc4ccccn4)C3)CC2)c(C)c1 ZINC001164714168 720108122 /nfs/dbraw/zinc/10/81/22/720108122.db2.gz AJKGMLADWJWCNM-JOCHJYFZSA-N 1 1 438.572 3.469 20 0 IGADMO COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1nc(Cl)nc3nc(C)[nH]c31)CC2 ZINC001164719465 720108707 /nfs/dbraw/zinc/10/87/07/720108707.db2.gz XJTVXGFCJANAEC-QGZVFWFLSA-N 1 1 441.967 3.217 20 0 IGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(C(F)(F)c1ccc(C(=O)OC)nc1Cl)C2 ZINC001164807489 720110284 /nfs/dbraw/zinc/11/02/84/720110284.db2.gz CNIKMTQZTCDODC-YWZLYKJASA-N 1 1 443.922 3.251 20 0 IGADMO COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1nccc3c1C(=O)OC3(C)C)CC2 ZINC001164716892 720113867 /nfs/dbraw/zinc/11/38/67/720113867.db2.gz LHEQVTPKGZTRLR-IBGZPJMESA-N 1 1 436.556 3.390 20 0 IGADMO COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1nc(C)cc(C)c1C(=O)OC)CC2 ZINC001164718579 720116725 /nfs/dbraw/zinc/11/67/25/720116725.db2.gz SPULZXJSOJIQML-OAQYLSRUSA-N 1 1 438.572 3.388 20 0 IGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1nc(C)nc3cc(OC)c(OC)cc31)C2 ZINC001164808174 720117527 /nfs/dbraw/zinc/11/75/27/720117527.db2.gz DURJFPRZDCWLOY-MHECFPHRSA-N 1 1 426.561 3.140 20 0 IGADMO CCOC(=O)c1c(C)ccnc1N1CCC2(C[C@@H](COC)[N@@H+](Cc3ccccn3)C2)CC1 ZINC001164712234 720132673 /nfs/dbraw/zinc/13/26/73/720132673.db2.gz LLHGHKGUVAUHNM-NRFANRHFSA-N 1 1 438.572 3.469 20 0 IGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(C(F)(F)c1cc(C(=O)OC)cnc1Cl)C2 ZINC001164819742 720154897 /nfs/dbraw/zinc/15/48/97/720154897.db2.gz XYKFVCPDNMXPHO-OXJNMPFZSA-N 1 1 443.922 3.251 20 0 IGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1nc(C(=O)OC)c(OC)c3ccccc31)C2 ZINC001164818343 720183631 /nfs/dbraw/zinc/18/36/31/720183631.db2.gz SKIRQTPZBVCNSA-BVZFJXPGSA-N 1 1 439.556 3.215 20 0 IGADMO Cc1nc(CN2C(=O)CC[C@@H]3[C@@H]2CCN3c2cc(OC3CC[NH+](C)CC3)ccn2)cs1 ZINC001164815138 720259393 /nfs/dbraw/zinc/25/93/93/720259393.db2.gz BBIVACZEUAHEJV-RTWAWAEBSA-N 1 1 441.601 3.089 20 0 IGADMO CCC[N@H+]1CCCC[C@H]1c1ccc(N2Cc3ccnn3C[C@@H](C(=O)N3CCCC3)C2)nc1 ZINC001164820232 720267902 /nfs/dbraw/zinc/26/79/02/720267902.db2.gz VETZKWLZNMOMGH-GMAHTHKFSA-N 1 1 436.604 3.474 20 0 IGADMO CC(C)(C)C(=O)OCn1ccc2c1ncnc2N1CC[C@H]2[C@@H]1CC[N@H+]2Cc1cccnc1 ZINC001164727783 720384435 /nfs/dbraw/zinc/38/44/35/720384435.db2.gz RLFPSRBDTOFCOH-PMACEKPBSA-N 1 1 434.544 3.226 20 0 IGADMO COC(=O)c1ccc(NC(=O)C(C)(C)C)c(N2CC[C@H]3[C@H]2CC[N@H+]3Cc2cccnc2)n1 ZINC001164730969 720415181 /nfs/dbraw/zinc/41/51/81/720415181.db2.gz KNOFKPFZGGMFPS-VQTJNVASSA-N 1 1 437.544 3.101 20 0 IGADMO CC(C)NC(=O)C[C@@H]1COC[C@H]2CN(c3ccc4c(n3)CC[N@H+](Cc3ccccc3)C4)C[C@@H]21 ZINC001164827074 720417433 /nfs/dbraw/zinc/41/74/33/720417433.db2.gz QSQFJHKNAFEMSX-WXFUMESZSA-N 1 1 448.611 3.253 20 0 IGADMO c1ccc(N2CCN(c3cc(N4CC[C@H]5[C@@H]4CC[N@@H+]5Cc4cccnc4)ncn3)CC2)cc1 ZINC001164730089 720461039 /nfs/dbraw/zinc/46/10/39/720461039.db2.gz HQQCJQFGVPEYCW-ZEQRLZLVSA-N 1 1 441.583 3.051 20 0 IGADMO COc1cc2ncc(N3CC[C@@H]4[C@H](C[C@@H](Cn5cccn5)[N@H+]4C(C)C)C3)nc2cc1OC ZINC001164841436 720537878 /nfs/dbraw/zinc/53/78/78/720537878.db2.gz VUBRADZCXYRKDM-LVCYWYKZSA-N 1 1 436.560 3.221 20 0 IGADMO CC(C)[N@@H+]1[C@@H]2CCN(c3ccc(NC(=O)C(C)(C)C)nn3)C[C@H]2C[C@H]1Cn1cccn1 ZINC001164842965 720543612 /nfs/dbraw/zinc/54/36/12/720543612.db2.gz ZGWOBTSBYQMBSS-CEXWTWQISA-N 1 1 425.581 3.036 20 0 IGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@@H]2CN(C(F)(F)COc3ccc(Cl)nn3)CC[C@@H]21 ZINC001164836635 720602280 /nfs/dbraw/zinc/60/22/80/720602280.db2.gz GAPJYQGVTRLKES-IKGGRYGDSA-N 1 1 440.926 3.172 20 0 IGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@H]2CN(c3nc(Cl)nc4c(Cl)ncnc43)CC[C@@H]21 ZINC001164844206 720630489 /nfs/dbraw/zinc/63/04/89/720630489.db2.gz ZYRUXIOPPLQQMH-KKUMJFAQSA-N 1 1 447.374 3.301 20 0 IGADMO COC(=O)c1cc(Cl)c(N2CC[C@@H]3[C@@H](C[C@@H](Cn4cccn4)[N@H+]3C(C)C)C2)nc1C ZINC001164840231 720638915 /nfs/dbraw/zinc/63/89/15/720638915.db2.gz PFOKWATWBPGEJR-ABSDTBQOSA-N 1 1 431.968 3.404 20 0 IGADMO COC(OC)c1c(CO)ccnc1N1CCC2(C[C@H]([N@@H+](C)Cc3ccccc3)CO2)CC1 ZINC001164839336 720704203 /nfs/dbraw/zinc/70/42/03/720704203.db2.gz LCRXCPGABVBLLZ-NRFANRHFSA-N 1 1 441.572 3.125 20 0 IGADMO COC(=O)c1nc(Cl)cc(N2CCC3(C[C@H]([N@@H+](C)Cc4ccccc4)CO3)CC2)n1 ZINC001164842351 720720861 /nfs/dbraw/zinc/72/08/61/720720861.db2.gz YSIGMCWHMRTCMS-KRWDZBQOSA-N 1 1 430.936 3.177 20 0 IGADMO Fc1ccc(-c2nc(Cl)cc(N3CC[N@H+]4C[C@H](Oc5cncnc5)C[C@@H]4C3)n2)cc1 ZINC001164738901 720775106 /nfs/dbraw/zinc/77/51/06/720775106.db2.gz GYEXXMRSCRMSRJ-IAGOWNOFSA-N 1 1 426.883 3.068 20 0 IGADMO Cc1cccc(Oc2nc(Cl)ncc2N2CC[N@H+]3C[C@@H](Oc4cncnc4)C[C@H]3C2)c1 ZINC001164741429 720803093 /nfs/dbraw/zinc/80/30/93/720803093.db2.gz BHMANDRMPBQRKJ-WMZOPIPTSA-N 1 1 438.919 3.363 20 0 IGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2C[C@H]3COC[C@@]3(C(=O)NCCc3ccccc3)C2)nc1 ZINC001164848608 720817546 /nfs/dbraw/zinc/81/75/46/720817546.db2.gz DEZOGPFPGSSFRU-XFAFFCHDSA-N 1 1 448.611 3.440 20 0 IGADMO CCC[N@H+]1CCCC[C@@H]1c1ccc(N2CC[C@@H]3O[C@@H](C(=O)N4CCCO4)CC[C@H]32)nc1 ZINC001164848845 720823032 /nfs/dbraw/zinc/82/30/32/720823032.db2.gz NKVWGKLJAMYJJF-YUMYIRISSA-N 1 1 428.577 3.309 20 0 IGADMO COc1cc2ccnc(N3CC[C@@H]4[C@@H](C[C@@H](Cn5cncn5)[N@@H+]4CC4CC4)C3)c2cc1OC ZINC001164745570 720831455 /nfs/dbraw/zinc/83/14/55/720831455.db2.gz WVNJZCOGBKSZTQ-JAXLGGSGSA-N 1 1 448.571 3.223 20 0 IGADMO COc1cc2ccnc(N3CC[C@@H]4[C@@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)c2cc1OC ZINC001164745570 720831456 /nfs/dbraw/zinc/83/14/56/720831456.db2.gz WVNJZCOGBKSZTQ-JAXLGGSGSA-N 1 1 448.571 3.223 20 0 IGADMO COc1ccccc1-c1ccc(N2CC[C@@H]3[C@@H](C[C@@H](Cn4cncn4)[N@H+]3CC3CC3)C2)nn1 ZINC001164745203 720847566 /nfs/dbraw/zinc/84/75/66/720847566.db2.gz MRCPYIBNQVUGKT-SXWKCWPCSA-N 1 1 445.571 3.123 20 0 IGADMO COCC[N@H+]1CCO[C@@H]2CN(C(F)(F)c3ccc4ncnc(Cl)c4c3)CC[C@H]2C1 ZINC001164853713 720848047 /nfs/dbraw/zinc/84/80/47/720848047.db2.gz OROWGZXWSANHIO-KBXCAEBGSA-N 1 1 426.895 3.002 20 0 IGADMO COCC[N@H+]1CCO[C@H]2CN(C(F)(F)c3ccc4nc(Cl)cnc4c3)CC[C@H]2C1 ZINC001164853728 720851403 /nfs/dbraw/zinc/85/14/03/720851403.db2.gz OTALPLACKPLMPD-KSSFIOAISA-N 1 1 426.895 3.002 20 0 IGADMO c1ncn(C[C@@H]2C[C@@H]3CN(c4nccnc4Oc4ccccc4)CC[C@H]3[N@H+]2CC2CC2)n1 ZINC001164751170 720854374 /nfs/dbraw/zinc/85/43/74/720854374.db2.gz QMWQWBZPBRWIOY-RZUBCFFCSA-N 1 1 431.544 3.240 20 0 IGADMO Fc1ccc2c(c1)[nH]c1ncnc(N3CC[C@@H]4[C@@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)c21 ZINC001164746209 720861255 /nfs/dbraw/zinc/86/12/55/720861255.db2.gz GMFWGWGROLKNLM-DJPFJPOOSA-N 1 1 446.534 3.221 20 0 IGADMO c1cncc(COC[C@@H]2C[N@@H+](CC3CC3)C[C@@]23CCN(c2ncnc4ncccc42)C3)c1 ZINC001164754523 720876177 /nfs/dbraw/zinc/87/61/77/720876177.db2.gz RZJNJKNKJVOZNS-SQJMNOBHSA-N 1 1 430.556 3.175 20 0 IGADMO CSc1ccnc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COCc2cccnc2)n1 ZINC001164750529 720876374 /nfs/dbraw/zinc/87/63/74/720876374.db2.gz JGWHZOLSGBVHAB-NZQKXSOJSA-N 1 1 425.602 3.349 20 0 IGADMO c1cncc(COC[C@H]2C[N@@H+](CC3CC3)C[C@]23CCN(c2ncnc4ncccc42)C3)c1 ZINC001164754507 720876632 /nfs/dbraw/zinc/87/66/32/720876632.db2.gz RZJNJKNKJVOZNS-BWKNWUBXSA-N 1 1 430.556 3.175 20 0 IGADMO COCC[N@H+]1CCO[C@H]2CN(c3ccc(C(=O)Nc4cccc(Cl)c4)cn3)CC[C@H]2C1 ZINC001164859226 720876727 /nfs/dbraw/zinc/87/67/27/720876727.db2.gz MAZLXCQGHKRDFO-RXVVDRJESA-N 1 1 444.963 3.161 20 0 IGADMO c1cncc(COC[C@@H]2C[N@@H+](CC3CC3)C[C@]23CCN(c2ncnc4cnccc42)C3)c1 ZINC001164750135 720877984 /nfs/dbraw/zinc/87/79/84/720877984.db2.gz JAVCCWCBGHHMGC-OFVILXPXSA-N 1 1 430.556 3.175 20 0 IGADMO COCC[N@H+]1CCO[C@H]2CN(c3cc(-c4nc(-c5cccs5)no4)ccn3)CC[C@H]2C1 ZINC001164859111 720883152 /nfs/dbraw/zinc/88/31/52/720883152.db2.gz LPZHQPVJBFPTND-ROUUACIJSA-N 1 1 441.557 3.034 20 0 IGADMO Nc1cc(Cl)nc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COCc2cccnc2)c1 ZINC001164758450 720884444 /nfs/dbraw/zinc/88/44/44/720884444.db2.gz YDQRKWJHJRSPIU-XXBNENTESA-N 1 1 427.980 3.467 20 0 IGADMO COCC[N@H+]1CCO[C@H]2CN(c3cnc(Cl)nc3Oc3ccccc3F)CC[C@H]2C1 ZINC001164854397 720888914 /nfs/dbraw/zinc/88/89/14/720888914.db2.gz FFBXIEAUNXWMMM-KXBFYZLASA-N 1 1 436.915 3.235 20 0 IGADMO COCC[N@H+]1CCO[C@H]2CN(c3cnc(Cl)nc3Oc3cccc(C)c3)CC[C@@H]2C1 ZINC001164865088 720889027 /nfs/dbraw/zinc/88/90/27/720889027.db2.gz YERVUBFAMHEJGU-XLIONFOSSA-N 1 1 432.952 3.404 20 0 IGADMO c1cncc(COC[C@H]2C[N@@H+](CC3CC3)C[C@]23CCN(c2cncc(N4CCCC4)n2)C3)c1 ZINC001164751617 720898841 /nfs/dbraw/zinc/89/88/41/720898841.db2.gz CZAWJCHYSXXORW-BVAGGSTKSA-N 1 1 448.615 3.227 20 0 IGADMO Cc1nc2c(c(N3CC[C@@]4(C3)C[N@@H+](CC3CC3)C[C@@H]4COCc3cccnc3)n1)CCC2 ZINC001164758165 720901451 /nfs/dbraw/zinc/90/14/51/720901451.db2.gz XIFHYUVPSDUEEK-GJZUVCINSA-N 1 1 433.600 3.424 20 0 IGADMO Nc1nc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COCc2cccnc2)ccc1Cl ZINC001164754676 720936128 /nfs/dbraw/zinc/93/61/28/720936128.db2.gz XFNJGHIXNXFNCL-XXBNENTESA-N 1 1 427.980 3.467 20 0 IGADMO CCC[N@H+]1CCCC[C@@H]1c1ccc(N2CC[C@@H]3CO[C@@H](CNC(=O)N(C)C)[C@@H]3C2)nc1 ZINC001164757354 721000234 /nfs/dbraw/zinc/00/02/34/721000234.db2.gz OMBPJWPRANFFRE-YSFYHYPLSA-N 1 1 429.609 3.131 20 0 IGADMO CSc1nc(Cl)cc(C(F)(F)N2C[C@@H]3C[N@H+](Cc4cnn(C)c4)CC[C@@H]3C2)n1 ZINC001164767389 721081088 /nfs/dbraw/zinc/08/10/88/721081088.db2.gz LPJXHAYWZWVAHU-KGLIPLIRSA-N 1 1 428.940 3.089 20 0 IGADMO CCOC(=O)c1cc(N2CC[N@H+]3C[C@H](OCc4cccnc4)C[C@H]3C2)nc2ccccc21 ZINC001164865632 721085028 /nfs/dbraw/zinc/08/50/28/721085028.db2.gz NSHABPHKAALRDO-VQTJNVASSA-N 1 1 432.524 3.286 20 0 IGADMO COc1cccc2c1nc(Cl)nc2N1CC[N@H+]2C[C@@H](OCc3cccnc3)C[C@H]2C1 ZINC001164863350 721086730 /nfs/dbraw/zinc/08/67/30/721086730.db2.gz CBQNYWWBGAXRHQ-IRXDYDNUSA-N 1 1 425.920 3.167 20 0 IGADMO Clc1nc2c(Cl)nccc2c(N2CC[N@H+]3C[C@@H](OCc4cccnc4)C[C@@H]3C2)n1 ZINC001164871032 721136456 /nfs/dbraw/zinc/13/64/56/721136456.db2.gz DARPSMGLARGFJO-CABCVRRESA-N 1 1 431.327 3.206 20 0 IGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4nc(Cl)nc(Oc5cccc(F)c5)n4)C[C@H]3C2)cn1 ZINC001164762100 721164587 /nfs/dbraw/zinc/16/45/87/721164587.db2.gz BXKQILDPTGODJA-HZPDHXFCSA-N 1 1 443.914 3.148 20 0 IGADMO CC[N@H+]1CCCC[C@H]1c1ccc(N2CCn3cc(CNC(=O)c4cccn4C)nc3C2)nc1 ZINC001164867189 721200459 /nfs/dbraw/zinc/20/04/59/721200459.db2.gz FHGXQHHVKQMAIJ-NRFANRHFSA-N 1 1 447.587 3.114 20 0 IGADMO COc1ccc(Oc2cc(N3C[C@@H]4CC[N@@H+](Cc5cnn(C)c5)C[C@H]4C3)nc(C)n2)cc1 ZINC001164760666 721231100 /nfs/dbraw/zinc/23/11/00/721231100.db2.gz FRPQYRCVYMCWJA-PMACEKPBSA-N 1 1 434.544 3.278 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@@]2(CCCN(c3nc(Cl)nc4cc[nH]c43)C2)C1 ZINC001164776588 721330797 /nfs/dbraw/zinc/33/07/97/721330797.db2.gz GQSWXJOALYAEDB-NRFANRHFSA-N 1 1 430.940 3.335 20 0 IGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@]2(CCCN(c3ncc(C)c(NCC4CC4)n3)C2)C1 ZINC001164778121 721331136 /nfs/dbraw/zinc/33/11/36/721331136.db2.gz UNQVHVMQXUHIJB-XMMPIXPASA-N 1 1 440.592 3.331 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@]2(CCCN(c3ncc(C)c(NCC4CC4)n3)C2)C1 ZINC001164778121 721331140 /nfs/dbraw/zinc/33/11/40/721331140.db2.gz UNQVHVMQXUHIJB-XMMPIXPASA-N 1 1 440.592 3.331 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@]2(CCCN(c3cc(Cl)nc4nc[nH]c43)C2)C1 ZINC001164779485 721347316 /nfs/dbraw/zinc/34/73/16/721347316.db2.gz UGIMYDPJJVFUKA-OAQYLSRUSA-N 1 1 430.940 3.335 20 0 IGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@]2(CCCN(c3cc(Cl)nc4[nH]cnc43)C2)C1 ZINC001164779485 721347320 /nfs/dbraw/zinc/34/73/20/721347320.db2.gz UGIMYDPJJVFUKA-OAQYLSRUSA-N 1 1 430.940 3.335 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@]2(CCCN(c3cc(Cl)nc4[nH]cnc43)C2)C1 ZINC001164779485 721347322 /nfs/dbraw/zinc/34/73/22/721347322.db2.gz UGIMYDPJJVFUKA-OAQYLSRUSA-N 1 1 430.940 3.335 20 0 IGADMO O=C(c1ccccc1)N1CCO[C@H]2CN(c3nc(Cl)ccc3C[NH+]3CCCC3)C[C@@H]2C1 ZINC001164885859 721349906 /nfs/dbraw/zinc/34/99/06/721349906.db2.gz QMYZPBHWNQZSNO-SFTDATJTSA-N 1 1 440.975 3.308 20 0 IGADMO COC(=O)c1cc(F)c(C)nc1N1CCC[C@@]2(C1)COCC[N@H+](Cc1c(C)noc1C)C2 ZINC001164778692 721350811 /nfs/dbraw/zinc/35/08/11/721350811.db2.gz NUIAVMBQCBYQKY-HSZRJFAPSA-N 1 1 446.523 3.040 20 0 IGADMO COC(=O)c1cc(F)c(C)nc1N1CCC[C@@]2(C1)COCC[N@@H+](Cc1c(C)noc1C)C2 ZINC001164778692 721350815 /nfs/dbraw/zinc/35/08/15/721350815.db2.gz NUIAVMBQCBYQKY-HSZRJFAPSA-N 1 1 446.523 3.040 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@@]2(CCCN(c3nc(Cl)nc4ncsc43)C2)C1 ZINC001164778285 721351470 /nfs/dbraw/zinc/35/14/70/721351470.db2.gz LZBHNZDNFLLVML-FQEVSTJZSA-N 1 1 448.980 3.464 20 0 IGADMO CCOc1c(Cl)ncnc1N1CCC[C@@]2(C1)COCC[N@H+](Cc1c(C)noc1C)C2 ZINC001164780012 721353369 /nfs/dbraw/zinc/35/33/69/721353369.db2.gz YHEDHLQDHZOQBW-OAQYLSRUSA-N 1 1 435.956 3.253 20 0 IGADMO CCOc1c(Cl)ncnc1N1CCC[C@@]2(C1)COCC[N@@H+](Cc1c(C)noc1C)C2 ZINC001164780012 721353374 /nfs/dbraw/zinc/35/33/74/721353374.db2.gz YHEDHLQDHZOQBW-OAQYLSRUSA-N 1 1 435.956 3.253 20 0 IGADMO Cc1noc(C)c1CN1CCOC[C@]2(CCCN(c3cc(N4CCCC4)cc[nH+]3)C2)C1 ZINC001164780067 721359073 /nfs/dbraw/zinc/35/90/73/721359073.db2.gz CUMJQIVQNGKQKY-XMMPIXPASA-N 1 1 425.577 3.406 20 0 IGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@]2(CCCN(c3nc[nH]c4nc(=S)sc3-4)C2)C1 ZINC001164780663 721364447 /nfs/dbraw/zinc/36/44/47/721364447.db2.gz GEVMOUJEZHDMDX-HXUWFJFHSA-N 1 1 446.602 3.099 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@]2(CCCN(c3nc[nH]c4nc(=S)sc3-4)C2)C1 ZINC001164780663 721364455 /nfs/dbraw/zinc/36/44/55/721364455.db2.gz GEVMOUJEZHDMDX-HXUWFJFHSA-N 1 1 446.602 3.099 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@@]2(CCCN(c3ncc4ncn(C(C)C)c4n3)C2)C1 ZINC001164780729 721366897 /nfs/dbraw/zinc/36/68/97/721366897.db2.gz GVJMGAXJBYCQFU-QHCPKHFHSA-N 1 1 439.564 3.131 20 0 IGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@@]2(CCCN(c3ncc4ncn(C(C)C)c4n3)C2)C1 ZINC001164780729 721366899 /nfs/dbraw/zinc/36/68/99/721366899.db2.gz GVJMGAXJBYCQFU-QHCPKHFHSA-N 1 1 439.564 3.131 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@@]2(CCCN(c3cncc(OCC(C)C)n3)C2)C1 ZINC001164785261 721367928 /nfs/dbraw/zinc/36/79/28/721367928.db2.gz SUCVOMKNRSGZKN-QHCPKHFHSA-N 1 1 429.565 3.235 20 0 IGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@@]2(CCCN(c3cncc(OCC(C)C)n3)C2)C1 ZINC001164785261 721367931 /nfs/dbraw/zinc/36/79/31/721367931.db2.gz SUCVOMKNRSGZKN-QHCPKHFHSA-N 1 1 429.565 3.235 20 0 IGADMO Cn1cc(N2C[C@@]3(CCN(c4ccc5c(n4)CC[N@H+](Cc4ccccc4)C5)C3)CC2=O)cn1 ZINC001164887410 721370512 /nfs/dbraw/zinc/37/05/12/721370512.db2.gz QXMVZQLVTJIOIV-SANMLTNESA-N 1 1 442.567 3.007 20 0 IGADMO C[NH+]1CCN(C[C@@H]2CCC[C@@]3(CCN(c4nc(Cl)nc5ccc(F)cc54)C3)O2)CC1 ZINC001164891855 721388540 /nfs/dbraw/zinc/38/85/40/721388540.db2.gz QXUMQXJEQZZDFM-JTSKRJEESA-N 1 1 433.959 3.188 20 0 IGADMO CCOC(=O)c1cnc2ccc(Cl)nc2c1N1C[C@H]2C[NH+](Cc3nccs3)C[C@@H]2C1 ZINC001164782433 721408185 /nfs/dbraw/zinc/40/81/85/721408185.db2.gz GKMIMADKSKZOTA-ZIAGYGMSSA-N 1 1 443.960 3.485 20 0 IGADMO C[NH+]1CCN(C[C@@H]2CCC[C@@]3(CCN(c4nccc(-c5c[nH]c6ccccc56)n4)C3)O2)CC1 ZINC001164888951 721408775 /nfs/dbraw/zinc/40/87/75/721408775.db2.gz PUVWHGDTTMWMDE-FNZWTVRRSA-N 1 1 446.599 3.390 20 0 IGADMO Clc1nc2c(ncn2[C@@H]2CCCCO2)c(N2C[C@@H]3C[NH+](Cc4nccs4)C[C@H]3C2)n1 ZINC001164786254 721409492 /nfs/dbraw/zinc/40/94/92/721409492.db2.gz OQHBSMJIVNGSIF-DZKIICNBSA-N 1 1 445.980 3.204 20 0 IGADMO COc1cccc2c1nc(Cl)nc2N1CC[C@@]2(C1)CCC[C@H](CN1CC[NH+](C)CC1)O2 ZINC001164889999 721410345 /nfs/dbraw/zinc/41/03/45/721410345.db2.gz RYXVHKRHQRQUPG-UZUQRXQVSA-N 1 1 445.995 3.057 20 0 IGADMO COc1ccc(C(F)(F)N2CC[C@@]3(C2)CCC[C@H](CN2CC[NH+](C)CC2)O3)nc1Cl ZINC001164887739 721418010 /nfs/dbraw/zinc/41/80/10/721418010.db2.gz MWDPGDXEWJYCPB-OXQOHEQNSA-N 1 1 444.954 3.054 20 0 IGADMO CC(C)n1ccc2c1nc(Cl)nc2N1CC[C@@]2(C1)CCC[C@H](CN1CC[NH+](C)CC1)O2 ZINC001164891506 721430192 /nfs/dbraw/zinc/43/01/92/721430192.db2.gz GTPINMJMFKOFDK-WZONZLPQSA-N 1 1 447.027 3.431 20 0 IGADMO O=C(Nc1cccnc1Cl)OCC(F)(F)N1C[C@@H]2C[N@@H+](Cc3nccs3)C[C@@H]2C1 ZINC001164786803 721435324 /nfs/dbraw/zinc/43/53/24/721435324.db2.gz PRYDNZQCSAFAPF-BETUJISGSA-N 1 1 443.907 3.397 20 0 IGADMO O=C(Nc1cccnc1Cl)OCC(F)(F)N1C[C@@H]2C[N@H+](Cc3nccs3)C[C@@H]2C1 ZINC001164786803 721435327 /nfs/dbraw/zinc/43/53/27/721435327.db2.gz PRYDNZQCSAFAPF-BETUJISGSA-N 1 1 443.907 3.397 20 0 IGADMO CCc1nc(Cl)c(N2CC[C@@]3(C2)CCC[C@H](CN2CC[NH+](C)CC2)O3)c(Cl)n1 ZINC001164895840 721439884 /nfs/dbraw/zinc/43/98/84/721439884.db2.gz QGWUWAWCVLDCFH-FOIQADDNSA-N 1 1 428.408 3.111 20 0 IGADMO Cc1cc(-c2cccc(F)c2)nnc1N1CC[C@@]2(C1)CCC[C@@H](CN1CC[NH+](C)CC1)O2 ZINC001164886571 721448012 /nfs/dbraw/zinc/44/80/12/721448012.db2.gz HHHVJGYZQMRJSG-WIOPSUGQSA-N 1 1 439.579 3.357 20 0 IGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(C(F)(F)c1ccnc(Cl)n1)CC2 ZINC001164789253 721448041 /nfs/dbraw/zinc/44/80/41/721448041.db2.gz UFCMLVZHTIDITJ-QGZVFWFLSA-N 1 1 444.954 3.409 20 0 IGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1nnc(Cl)c3ccncc31)CC2 ZINC001164785209 721452782 /nfs/dbraw/zinc/45/27/82/721452782.db2.gz HGXBPFRQPNRVRX-SFHVURJKSA-N 1 1 445.995 3.412 20 0 IGADMO CC[C@H](C)c1nc2[nH]ccc2c(N2CC[C@@]3(C2)CCC[C@@H](CN2CC[NH+](C)CC2)O3)n1 ZINC001164889703 721453497 /nfs/dbraw/zinc/45/34/97/721453497.db2.gz PLVGBYRCHBEEGS-AXHZCLLHSA-N 1 1 426.609 3.237 20 0 IGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1ncnc3ccc(OC)cc31)CC2 ZINC001164783560 721454892 /nfs/dbraw/zinc/45/48/92/721454892.db2.gz CHJPCGIOIXXHRQ-HXUWFJFHSA-N 1 1 440.588 3.372 20 0 IGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1nc(Cl)nc3cnccc31)CC2 ZINC001164790456 721455701 /nfs/dbraw/zinc/45/57/01/721455701.db2.gz ZCBVXYYDNCSRLA-SFHVURJKSA-N 1 1 445.995 3.412 20 0 IGADMO CCOc1c(Cl)ncnc1N1CCC2(C[C@H](COCC3CC3)[N@@H+](CCOC)C2)CC1 ZINC001164784634 721460721 /nfs/dbraw/zinc/46/07/21/721460721.db2.gz IXFIMSFIGLSHKP-GOSISDBHSA-N 1 1 439.000 3.263 20 0 IGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1nc3nc[nH]c3cc1Cl)CC2 ZINC001164788682 721462058 /nfs/dbraw/zinc/46/20/58/721462058.db2.gz VNEAILMDCVSPDY-KRWDZBQOSA-N 1 1 433.984 3.345 20 0 IGADMO COCC[N@@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1nc3[nH]cnc3cc1Cl)CC2 ZINC001164788682 721462060 /nfs/dbraw/zinc/46/20/60/721462060.db2.gz VNEAILMDCVSPDY-KRWDZBQOSA-N 1 1 433.984 3.345 20 0 IGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1nc3[nH]cnc3cc1Cl)CC2 ZINC001164788682 721462064 /nfs/dbraw/zinc/46/20/64/721462064.db2.gz VNEAILMDCVSPDY-KRWDZBQOSA-N 1 1 433.984 3.345 20 0 IGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(C(F)(F)c1cncc(Cl)n1)CC2 ZINC001164785489 721464276 /nfs/dbraw/zinc/46/42/76/721464276.db2.gz LOLZSVBYLCGTQX-KRWDZBQOSA-N 1 1 444.954 3.409 20 0 IGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1cncc(OCC(C)C)n1)CC2 ZINC001164787105 721468162 /nfs/dbraw/zinc/46/81/62/721468162.db2.gz CIPCHTALIFIVMH-OAQYLSRUSA-N 1 1 432.609 3.245 20 0 IGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1nccnc1OCC(C)C)CC2 ZINC001164791788 721470099 /nfs/dbraw/zinc/47/00/99/721470099.db2.gz ZEZMRUBWVJMTEA-OAQYLSRUSA-N 1 1 432.609 3.245 20 0 IGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1ccnc(-c3nccs3)n1)CC2 ZINC001164789940 721473155 /nfs/dbraw/zinc/47/31/55/721473155.db2.gz PEYHMSYEVFZHAW-LJQANCHMSA-N 1 1 443.617 3.334 20 0 IGADMO Fc1cccnc1OC[C@@]12COC[C@H]1CN(c1nc(Cl)ccc1C[NH+]1CCCC1)C2 ZINC001164793359 721486696 /nfs/dbraw/zinc/48/66/96/721486696.db2.gz QTMYMBNQYNJZKU-VGOFRKELSA-N 1 1 432.927 3.397 20 0 IGADMO CC(C)(C)OC(=O)Nc1nccc(N2CC[N@H+]3C[C@H](Oc4cccc(F)c4)C[C@H]3C2)n1 ZINC001164902091 721525509 /nfs/dbraw/zinc/52/55/09/721525509.db2.gz ZDDWXKMPKORBCQ-FUHWJXTLSA-N 1 1 429.496 3.305 20 0 IGADMO CN(C)c1nc(-c2ccccc2)nc(N2CC[N@H+]3C[C@H](Oc4cccc(F)c4)C[C@@H]3C2)n1 ZINC001164911174 721541955 /nfs/dbraw/zinc/54/19/55/721541955.db2.gz VPPRUKSVCWTMPF-TZIWHRDSSA-N 1 1 434.519 3.086 20 0 IGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2nc(Cl)nc3c2COC3(C)C)[C@@H]2CCCO[C@H]12 ZINC001164805519 721542388 /nfs/dbraw/zinc/54/23/88/721542388.db2.gz MANFTLHKFQEBRO-KURKYZTESA-N 1 1 429.952 3.159 20 0 IGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2nc(Cl)nc3c2COC3(C)C)[C@@H]2CCCO[C@H]12 ZINC001164805519 721542392 /nfs/dbraw/zinc/54/23/92/721542392.db2.gz MANFTLHKFQEBRO-KURKYZTESA-N 1 1 429.952 3.159 20 0 IGADMO COC(=O)c1ccc2c(ccnc2N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@H]3OCCC[C@H]32)c1 ZINC001164806647 721547409 /nfs/dbraw/zinc/54/74/09/721547409.db2.gz PPKMAKVOXOOVRH-VJBWXMMDSA-N 1 1 432.524 3.285 20 0 IGADMO CCOC(=O)c1cc2ccnc(N3C[C@H]([N@@H+](C)Cc4cccnc4)[C@@H]4OCCC[C@H]43)c2[nH]1 ZINC001164803064 721547414 /nfs/dbraw/zinc/54/74/14/721547414.db2.gz HQFDKIOYRDHLNY-RZUBCFFCSA-N 1 1 435.528 3.003 20 0 IGADMO Fc1cccc(O[C@@H]2C[C@@H]3CN(C(F)(F)COc4ccc(Cl)nn4)CC[N@H+]3C2)c1 ZINC001164903547 721553799 /nfs/dbraw/zinc/55/37/99/721553799.db2.gz CFLPCBYLAUUYIP-GDBMZVCRSA-N 1 1 428.842 3.078 20 0 IGADMO CCOC(=O)c1cnc(Cl)c(C)c1N1C[C@H]([N@@H+](C)Cc2cccnc2)[C@H]2OCCC[C@@H]21 ZINC001164798124 721560800 /nfs/dbraw/zinc/56/08/00/721560800.db2.gz AHNRVQULRPIVRB-ZJOUEHCJSA-N 1 1 444.963 3.483 20 0 IGADMO Fc1cccc(O[C@H]2C[C@@H]3CN(c4nc(Cl)nc5c(Cl)ncnc54)CC[N@H+]3C2)c1 ZINC001164911075 721561560 /nfs/dbraw/zinc/56/15/60/721561560.db2.gz YHFGKRWYOMIASH-OCCSQVGLSA-N 1 1 435.290 3.208 20 0 IGADMO COc1nnc(Cl)cc1C(F)(F)N1CC[N@H+]2C[C@@H](Oc3cccc(F)c3)C[C@H]2C1 ZINC001164907208 721565942 /nfs/dbraw/zinc/56/59/42/721565942.db2.gz MRVSKHBCEHVOHI-ZFWWWQNUSA-N 1 1 428.842 3.165 20 0 IGADMO COc1nnc(Cl)cc1C(F)(F)N1CC[N@H+]2C[C@H](Oc3cccc(F)c3)C[C@H]2C1 ZINC001164907205 721566054 /nfs/dbraw/zinc/56/60/54/721566054.db2.gz MRVSKHBCEHVOHI-DZGCQCFKSA-N 1 1 428.842 3.165 20 0 IGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2cnc(OCc3ccccc3)cn2)[C@@H]2CCCO[C@H]12 ZINC001164805634 721569999 /nfs/dbraw/zinc/56/99/99/721569999.db2.gz OGEPOMVLUUYTOD-RQTOMXEWSA-N 1 1 431.540 3.319 20 0 IGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2nc3ccccc3nc2N2CCCC2)[C@H]2CCCO[C@H]12 ZINC001164805795 721575114 /nfs/dbraw/zinc/57/51/14/721575114.db2.gz OVZPGUMDTXECIJ-VXNXHJTFSA-N 1 1 444.583 3.493 20 0 IGADMO COc1cccc(-c2ccc(N3C[C@H]([N@H+](C)Cc4cccnc4)[C@@H]4OCCC[C@@H]43)nn2)c1 ZINC001164808330 721578194 /nfs/dbraw/zinc/57/81/94/721578194.db2.gz QQEJSAOCLGRSEB-SONWIMMPSA-N 1 1 431.540 3.415 20 0 IGADMO COc1cccc(-c2ccc(N3C[C@H]([N@@H+](C)Cc4cccnc4)[C@@H]4OCCC[C@@H]43)nn2)c1 ZINC001164808330 721578196 /nfs/dbraw/zinc/57/81/96/721578196.db2.gz QQEJSAOCLGRSEB-SONWIMMPSA-N 1 1 431.540 3.415 20 0 IGADMO COc1ccccc1-c1ccnc(N2C[C@H]([N@H+](C)Cc3cccnc3)[C@H]3OCCC[C@H]32)n1 ZINC001164800144 721581694 /nfs/dbraw/zinc/58/16/94/721581694.db2.gz CEKMLFYERPUZET-GPXNEJASSA-N 1 1 431.540 3.415 20 0 IGADMO COc1ccccc1-c1ccnc(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@H]3OCCC[C@H]32)n1 ZINC001164800144 721581695 /nfs/dbraw/zinc/58/16/95/721581695.db2.gz CEKMLFYERPUZET-GPXNEJASSA-N 1 1 431.540 3.415 20 0 IGADMO COc1ccccc1-c1ccnc(N2C[C@H]([N@H+](C)Cc3cccnc3)[C@H]3OCCC[C@@H]32)n1 ZINC001164800143 721581703 /nfs/dbraw/zinc/58/17/03/721581703.db2.gz CEKMLFYERPUZET-FIXSFTCYSA-N 1 1 431.540 3.415 20 0 IGADMO COc1ccccc1-c1ccnc(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@H]3OCCC[C@@H]32)n1 ZINC001164800143 721581705 /nfs/dbraw/zinc/58/17/05/721581705.db2.gz CEKMLFYERPUZET-FIXSFTCYSA-N 1 1 431.540 3.415 20 0 IGADMO Cc1nc(N(C)C)nc2c1COC[C@]21CCN(c2nc(Cl)ccc2C[NH+]2CCCC2)C1 ZINC001164806904 721606292 /nfs/dbraw/zinc/60/62/92/721606292.db2.gz UDWNGFMNIZUFMV-HSZRJFAPSA-N 1 1 442.995 3.174 20 0 IGADMO CCCNC(=O)c1ccc(N2CCC(F)(F)[C@@]3(CC[N@@H+](Cc4ccccn4)C3)C2)nc1 ZINC001164909715 721726043 /nfs/dbraw/zinc/72/60/43/721726043.db2.gz DEBYUQMHHXACHR-JOCHJYFZSA-N 1 1 429.515 3.354 20 0 IGADMO CCOC(=O)Cc1ccnc(N2CCC(F)(F)[C@@]3(CC[N@@H+](Cc4ccccn4)C3)C2)c1 ZINC001164909104 721737270 /nfs/dbraw/zinc/73/72/70/721737270.db2.gz BICGYBMEUXYNKF-JOCHJYFZSA-N 1 1 430.499 3.320 20 0 IGADMO CC(C)(c1ccnc(Cl)c1)[N@H+]1CC[C@@H]2OCC[C@@H](C(=O)NCCc3ccncc3)[C@H]2C1 ZINC001165012583 721754257 /nfs/dbraw/zinc/75/42/57/721754257.db2.gz FDORHSNZGJZMCD-NJYVYQBISA-N 1 1 442.991 3.451 20 0 IGADMO COCCn1ccc2c1nc[nH+]c2N1CCc2c(CN(C)Cc3ccco3)cncc2C1 ZINC001164910087 721756187 /nfs/dbraw/zinc/75/61/87/721756187.db2.gz LQVDCHAVFWIONR-UHFFFAOYSA-N 1 1 432.528 3.260 20 0 IGADMO c1cn(C2CCCC2)c2nc[nH+]c(N3CCO[C@@]4(C3)COCCN(Cc3cccnc3)C4)c12 ZINC001164915601 721785062 /nfs/dbraw/zinc/78/50/62/721785062.db2.gz LVJYWGHUEBKSAK-VWLOTQADSA-N 1 1 448.571 3.049 20 0 IGADMO Clc1ccc(C[NH+]2CCCC2)c(N2C[C@@H]3COC[C@]3(COCc3ccccn3)C2)n1 ZINC001164922159 721839183 /nfs/dbraw/zinc/83/91/83/721839183.db2.gz FWBSGUVUGNMNSC-XXBNENTESA-N 1 1 428.964 3.395 20 0 IGADMO CN1C(=O)CC[C@H]2[C@@H]1CCN2c1nc(C[NH+]2CCCC2)nc2sc3c(c21)CCCC3 ZINC001164933698 721893403 /nfs/dbraw/zinc/89/34/03/721893403.db2.gz NBRGVNFRURYSMJ-IRXDYDNUSA-N 1 1 425.602 3.365 20 0 IGADMO O=C(NCc1cccs1)c1cc(F)c(Cl)nc1N1CC[NH+](C[C@@H]2CCCO2)CC1 ZINC001165039865 721913692 /nfs/dbraw/zinc/91/36/92/721913692.db2.gz WBCYNXQKOKWUCZ-AWEZNQCLSA-N 1 1 438.956 3.167 20 0 IGADMO O=C1NCC[N@H+](Cc2ccccc2)C12CCN(c1ncnc3[nH]c4ccccc4c31)CC2 ZINC001164946770 721974807 /nfs/dbraw/zinc/97/48/07/721974807.db2.gz KUPQEDWYQXGFHU-UHFFFAOYSA-N 1 1 426.524 3.082 20 0 IGADMO O=C1NCC[N@@H+](Cc2ccccc2)C12CCN(c1ncnc3[nH]c4ccccc4c31)CC2 ZINC001164946770 721974811 /nfs/dbraw/zinc/97/48/11/721974811.db2.gz KUPQEDWYQXGFHU-UHFFFAOYSA-N 1 1 426.524 3.082 20 0 IGADMO Cc1nc2c(nc(Cl)nc2N2CCC3(CC2)C(=O)NCC[N@H+]3Cc2ccccc2)s1 ZINC001164948407 721975252 /nfs/dbraw/zinc/97/52/52/721975252.db2.gz YXAPKESJWJIWCS-UHFFFAOYSA-N 1 1 442.976 3.019 20 0 IGADMO Cc1nc2c(nc(Cl)nc2N2CCC3(CC2)C(=O)NCC[N@@H+]3Cc2ccccc2)s1 ZINC001164948407 721975254 /nfs/dbraw/zinc/97/52/54/721975254.db2.gz YXAPKESJWJIWCS-UHFFFAOYSA-N 1 1 442.976 3.019 20 0 IGADMO CC[C@@H](C)c1nc2[nH]ccc2c(N2CCC3(CC2)C(=O)NCC[N@H+]3Cc2ccccc2)n1 ZINC001164951151 721981893 /nfs/dbraw/zinc/98/18/93/721981893.db2.gz YDYCGSKKGMIPEA-GOSISDBHSA-N 1 1 432.572 3.442 20 0 IGADMO CC[C@@H](C)c1nc2[nH]ccc2c(N2CCC3(CC2)C(=O)NCC[N@@H+]3Cc2ccccc2)n1 ZINC001164951151 721981895 /nfs/dbraw/zinc/98/18/95/721981895.db2.gz YDYCGSKKGMIPEA-GOSISDBHSA-N 1 1 432.572 3.442 20 0 IGADMO Cc1sc2nc(CN3CCCC3)nc(N3C[C@@H]4C[N@H+](CC5CC5)C[C@H](C3)O4)c2c1C ZINC001164966673 722075618 /nfs/dbraw/zinc/07/56/18/722075618.db2.gz GBLBFDBPPUCARW-KDURUIRLSA-N 1 1 427.618 3.203 20 0 IGADMO CS(=O)(=O)N1C[C@@H]2CN(c3nc(Cl)ccc3C[NH+]3CCCC3)C[C@@H]2c2ccccc21 ZINC001164972374 722090308 /nfs/dbraw/zinc/09/03/08/722090308.db2.gz GTPRYIIVLWMATK-HKUYNNGSSA-N 1 1 447.004 3.330 20 0 IGADMO COc1ccc2nc(Cl)nc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)c2c1 ZINC001164984338 722099325 /nfs/dbraw/zinc/09/93/25/722099325.db2.gz SQLWPLRRXLOIRR-DYESRHJHSA-N 1 1 439.947 3.414 20 0 IGADMO COc1ccc2nc(Cl)nc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)c2c1 ZINC001164984344 722099431 /nfs/dbraw/zinc/09/94/31/722099431.db2.gz SQLWPLRRXLOIRR-UWJYYQICSA-N 1 1 439.947 3.414 20 0 IGADMO O=C(NC1CCCCC1)c1cccnc1N1CC[C@@H]2C[N@@H+](Cc3cccnc3)CCO[C@H]2C1 ZINC001164986099 722102842 /nfs/dbraw/zinc/10/28/42/722102842.db2.gz YANBDNBJAFLNGK-QPPBQGQZSA-N 1 1 449.599 3.266 20 0 IGADMO FC(F)(c1nc(Cl)cc(Cl)n1)N1CC[C@@H]2C[N@@H+](Cc3cccnc3)CCO[C@H]2C1 ZINC001164983973 722103321 /nfs/dbraw/zinc/10/33/21/722103321.db2.gz RJWUYDHBAYNCHI-CABCVRRESA-N 1 1 444.313 3.451 20 0 IGADMO COc1cc(C(F)(F)N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)cc(Cl)n1 ZINC001164984683 722103447 /nfs/dbraw/zinc/10/34/47/722103447.db2.gz TYWSDEIRVPTOJG-FUHWJXTLSA-N 1 1 438.906 3.411 20 0 IGADMO CCOC(=O)c1c(C)cc(Cl)nc1N1CC[C@H]2C[N@@H+](Cc3cccnc3)CCO[C@H]2C1 ZINC001164971387 722109583 /nfs/dbraw/zinc/10/95/83/722109583.db2.gz BVJNXPHAVUOVEJ-OALUTQOASA-N 1 1 444.963 3.342 20 0 IGADMO FC(F)(COc1ccnc(Cl)c1)N1CC[C@H]2C[N@@H+](Cc3cccnc3)CCO[C@H]2C1 ZINC001164972555 722114722 /nfs/dbraw/zinc/11/47/22/722114722.db2.gz GBBRFJDECNXUFN-HKUYNNGSSA-N 1 1 438.906 3.325 20 0 IGADMO COc1cc2ccnc(N3CC[C@@H]4C[N@H+](Cc5cccnc5)CCO[C@H]4C3)c2cc1OC ZINC001164980565 722122418 /nfs/dbraw/zinc/12/24/18/722122418.db2.gz RVMYKNUHCLZGSO-YKSBVNFPSA-N 1 1 434.540 3.374 20 0 IGADMO COc1cc2ccnc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)c2cc1OC ZINC001164980565 722122420 /nfs/dbraw/zinc/12/24/20/722122420.db2.gz RVMYKNUHCLZGSO-YKSBVNFPSA-N 1 1 434.540 3.374 20 0 IGADMO COc1ccc(-c2ccc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)nn2)cc1 ZINC001164973392 722139836 /nfs/dbraw/zinc/13/98/36/722139836.db2.gz CAYTWHUUAHENNE-ZJSXRUAMSA-N 1 1 431.540 3.275 20 0 IGADMO COc1ccc(-c2ccc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)nn2)cc1 ZINC001164973388 722140001 /nfs/dbraw/zinc/14/00/01/722140001.db2.gz CAYTWHUUAHENNE-XUZZJYLKSA-N 1 1 431.540 3.275 20 0 IGADMO CC1CCN(C(=O)c2cccnc2N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)CC1 ZINC001164982787 722141109 /nfs/dbraw/zinc/14/11/09/722141109.db2.gz SPPHWSJJNZNIOF-ISKFKSNPSA-N 1 1 449.599 3.076 20 0 IGADMO COC(=O)c1cc2ccccc2c(N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)n1 ZINC001164980259 722144463 /nfs/dbraw/zinc/14/44/63/722144463.db2.gz MFZYUVPKVRFQJX-REWPJTCUSA-N 1 1 432.524 3.144 20 0 IGADMO COc1cc2cnc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)cc2cc1OC ZINC001164983279 722145754 /nfs/dbraw/zinc/14/57/54/722145754.db2.gz SXSGLYYWXCSRGD-DVECYGJZSA-N 1 1 434.540 3.374 20 0 IGADMO NC(=S)c1cnc(N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)c2sccc21 ZINC001164972236 722158024 /nfs/dbraw/zinc/15/80/24/722158024.db2.gz HLJREFZNFKBFIU-VQIMIIECSA-N 1 1 439.610 3.053 20 0 IGADMO CC[N@H+]1CCCC[C@H]1c1ccc(-n2c([C@H]3COCCN3)nccc2=NCc2ccco2)nc1 ZINC001164987860 722173157 /nfs/dbraw/zinc/17/31/57/722173157.db2.gz OZRSTGCGYAMDNT-YADHBBJMSA-N 1 1 448.571 3.169 20 0 IGADMO CCOC[C@@H]1C(=O)N(CC)CC12CCN(c1nc(Cl)ccc1C[NH+]1CCCC1)CC2 ZINC001164990823 722187598 /nfs/dbraw/zinc/18/75/98/722187598.db2.gz NNAOQSBPDLVGHM-LJQANCHMSA-N 1 1 435.012 3.432 20 0 IGADMO C[NH+]1CCN(c2ncnc3c2CCN(C(F)(F)c2ccc(Cl)nc2Cl)CC3)CC1 ZINC001164996065 722229574 /nfs/dbraw/zinc/22/95/74/722229574.db2.gz CFEJHWIRXJWJAN-UHFFFAOYSA-N 1 1 443.329 3.080 20 0 IGADMO C[NH+]1CCN(c2ncnc3c2CCN(c2nc(Cl)nc4cc(Cl)ccc42)CC3)CC1 ZINC001164997765 722233474 /nfs/dbraw/zinc/23/34/74/722233474.db2.gz VWDMYOZAVJEGNP-UHFFFAOYSA-N 1 1 444.370 3.084 20 0 IGADMO CCOC(=O)C1CCN(c2ccc(N3CCC[C@@H]4C[N@@H+](Cc5ccccc5)C[C@@H]43)nn2)CC1 ZINC001164629067 719086575 /nfs/dbraw/zinc/08/65/75/719086575.db2.gz QTFGMHYFBSATJF-PKTZIBPZSA-N 1 1 449.599 3.357 20 0 IGADMO Cc1ccc(S(=O)(=O)n2ccc3c2nc(Cl)nc3N2C[C@@H](C)[N@H+](C)C[C@H]2C)cc1 ZINC001164632951 719171079 /nfs/dbraw/zinc/17/10/79/719171079.db2.gz GAIBVQVZWCFKFB-HUUCEWRRSA-N 1 1 433.965 3.159 20 0 IGADMO CC(C)n1nc(C[NH+](C)C)c2c1CN(c1ncnc3c1CN(Cc1ccccc1)CC3)CC2 ZINC001164648749 719307975 /nfs/dbraw/zinc/30/79/75/719307975.db2.gz RBRVLZJVQSBQCN-UHFFFAOYSA-N 1 1 445.615 3.437 20 0 IGADMO CC(C)n1nc(C[NH+](C)C)c2c1CN(C(F)(F)c1nc(Cl)cc(N(C)C)n1)CC2 ZINC001164648697 719308433 /nfs/dbraw/zinc/30/84/33/719308433.db2.gz QRZOQTHJXXVYAJ-UHFFFAOYSA-N 1 1 427.931 3.143 20 0 IGADMO COC(=O)c1ccc2c(c1)nc(Cl)nc2N1CCc2c(C[NH+](C)C)nn(C(C)C)c2C1 ZINC001164650117 719311241 /nfs/dbraw/zinc/31/12/41/719311241.db2.gz UDCMXOSSMXUYQT-UHFFFAOYSA-N 1 1 442.951 3.472 20 0 IGADMO O=C(CC1CC1)N[C@@H]1CN(c2nc(Cl)ccc2C[NH+]2CCCC2)C[C@@H]2CCCO[C@@H]12 ZINC001164656617 719325077 /nfs/dbraw/zinc/32/50/77/719325077.db2.gz YRBVJLFPPVNLHD-LRXVAGHRSA-N 1 1 432.996 3.231 20 0 IGADMO COC(=O)[C@]1(C)C[C@@H]([NH+]2CCOCC2)CCN1c1cc(Cl)nc2c(OC)cccc12 ZINC001164702604 719838379 /nfs/dbraw/zinc/83/83/79/719838379.db2.gz OEWWVBORUQXJPY-NYHFZMIOSA-N 1 1 433.936 3.130 20 0 IGADMO COC(=O)[C@]1(C)C[C@H]([NH+]2CCOCC2)CCN1c1ncc(Cl)nc1-c1ccccc1 ZINC001164701678 719871973 /nfs/dbraw/zinc/87/19/73/719871973.db2.gz GQFSAZCXFCUPOL-VGSWGCGISA-N 1 1 430.936 3.030 20 0 IGADMO CCOC(=O)c1cnc(C2CC2)nc1N1CCC2(CC1)C[N@H+](Cc1cccs1)CCO2 ZINC001164696164 719891963 /nfs/dbraw/zinc/89/19/63/719891963.db2.gz ADFXTYUWSOPYQI-UHFFFAOYSA-N 1 1 442.585 3.464 20 0 IGADMO CCOC(=O)c1cnc(C2CC2)nc1N1CCC2(CC1)C[N@@H+](Cc1cccs1)CCO2 ZINC001164696164 719891964 /nfs/dbraw/zinc/89/19/64/719891964.db2.gz ADFXTYUWSOPYQI-UHFFFAOYSA-N 1 1 442.585 3.464 20 0 IGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1ncccc1C(=O)NC1CCCCC1)C2 ZINC001164805887 720078737 /nfs/dbraw/zinc/07/87/37/720078737.db2.gz AIZFDISIJIQZAZ-NBGIEHNGSA-N 1 1 426.605 3.329 20 0 IGADMO COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1ncc(C)c(N3CCCC3)n1)CC2 ZINC001164710016 720093119 /nfs/dbraw/zinc/09/31/19/720093119.db2.gz FMNYEWNTCXMXCD-JOCHJYFZSA-N 1 1 436.604 3.288 20 0 IGADMO CCOC(=O)c1ccc(C)c(N2CCC3(C[C@@H](COC)[N@@H+](Cc4ccccn4)C3)CC2)n1 ZINC001164710981 720093366 /nfs/dbraw/zinc/09/33/66/720093366.db2.gz MNDDBHKXKFYNLT-NRFANRHFSA-N 1 1 438.572 3.469 20 0 IGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(C(F)(F)c1cnc(Cl)cc1C(=O)OC)C2 ZINC001164810074 720102486 /nfs/dbraw/zinc/10/24/86/720102486.db2.gz JPHKCOHQMKMWAC-FOIQADDNSA-N 1 1 443.922 3.251 20 0 IGADMO CCOC(=O)c1cc(C)cc(N2CCC3(C[C@@H](COC)[N@@H+](Cc4ccccn4)C3)CC2)n1 ZINC001164709674 720103241 /nfs/dbraw/zinc/10/32/41/720103241.db2.gz CDTVUGRJLNGHQB-NRFANRHFSA-N 1 1 438.572 3.469 20 0 IGADMO CCOC(=O)Cc1ccc(N2CCC3(C[C@@H](COC)[N@@H+](Cc4ccccn4)C3)CC2)nc1 ZINC001164719000 720118652 /nfs/dbraw/zinc/11/86/52/720118652.db2.gz UPGIWPVNVRWSDS-QFIPXVFZSA-N 1 1 438.572 3.090 20 0 IGADMO CCN(CC)C(=O)c1cc(Cl)nc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COC)c1 ZINC001164815917 720127737 /nfs/dbraw/zinc/12/77/37/720127737.db2.gz XKYXMPKCULBRIH-AUSIDOKSSA-N 1 1 435.012 3.402 20 0 IGADMO COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1ncnc3c1ncn3C1CC1)CC2 ZINC001164711317 720144835 /nfs/dbraw/zinc/14/48/35/720144835.db2.gz HEAAOKVRRZKTDZ-HXUWFJFHSA-N 1 1 433.560 3.064 20 0 IGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1ncccc1C(=O)N1CCC(C)CC1)C2 ZINC001164820265 720167714 /nfs/dbraw/zinc/16/77/14/720167714.db2.gz ZWBPIVUNYPJRPD-BWKNWUBXSA-N 1 1 426.605 3.138 20 0 IGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN([C@@](F)(COc1cncc(Cl)n1)C(F)F)C2 ZINC001164816344 720179000 /nfs/dbraw/zinc/17/90/00/720179000.db2.gz KZSCQAZOUMLCGS-BEVDRBHNSA-N 1 1 448.917 3.120 20 0 IGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1ccc(-c3cc(OC)ccc3OC)nn1)C2 ZINC001164814403 720181922 /nfs/dbraw/zinc/18/19/22/720181922.db2.gz GCJNQBFANUMWRC-KBMIEXCESA-N 1 1 438.572 3.346 20 0 IGADMO Cc1cc2c(nc(Cl)nc2N2CCCn3c(=O)cc(C[N@H+](C)C(C)C)nc3C2)s1 ZINC001164814113 720217419 /nfs/dbraw/zinc/21/74/19/720217419.db2.gz UNZJPFALPQIKAI-UHFFFAOYSA-N 1 1 432.981 3.460 20 0 IGADMO Cc1sc2nc(C)nc(N3CCCn4c(=O)cc(C[N@H+](C)C(C)C)nc4C3)c2c1C ZINC001164814781 720222843 /nfs/dbraw/zinc/22/28/43/720222843.db2.gz YZMFQIFKOQKZRF-UHFFFAOYSA-N 1 1 426.590 3.424 20 0 IGADMO Cc1ccc2c(c1)nc(Cl)nc2N1CCCn2c(=O)cc(C[N@H+](C)C(C)C)nc2C1 ZINC001164814681 720224475 /nfs/dbraw/zinc/22/44/75/720224475.db2.gz UWDNSHGLPWMUOH-UHFFFAOYSA-N 1 1 426.952 3.399 20 0 IGADMO CC(C)(C)C(=O)OCn1ccc2c1ncnc2N1CC[C@H]2[C@H]1CC[N@H+]2Cc1cccnc1 ZINC001164727793 720384961 /nfs/dbraw/zinc/38/49/61/720384961.db2.gz RLFPSRBDTOFCOH-VQTJNVASSA-N 1 1 434.544 3.226 20 0 IGADMO Cc1noc([C@@H]2CC[C@@H]3[C@@H](CCN3c3ncnc4c3CC[N@H+](Cc3ccccc3)C4)O2)n1 ZINC001164826691 720403884 /nfs/dbraw/zinc/40/38/84/720403884.db2.gz CREOTLRZVXVMSW-VSKRKVRLSA-N 1 1 432.528 3.225 20 0 IGADMO Cc1noc([C@@H]2CC[C@@H]3[C@@H](CCN3c3ncnc4c3CC[N@@H+](Cc3ccccc3)C4)O2)n1 ZINC001164826691 720403893 /nfs/dbraw/zinc/40/38/93/720403893.db2.gz CREOTLRZVXVMSW-VSKRKVRLSA-N 1 1 432.528 3.225 20 0 IGADMO CCOC(=O)c1cc(Cl)nc(N2CC[C@@H]3[C@H](C[C@@H](Cn4cccn4)[N@H+]3C(C)C)C2)c1 ZINC001164840038 720505779 /nfs/dbraw/zinc/50/57/79/720505779.db2.gz WBRYESHDBNANHX-CEXWTWQISA-N 1 1 431.968 3.486 20 0 IGADMO CCOC(=O)c1cc(Cl)nc(N2CC[C@@H]3[C@@H](C[C@@H](Cn4cccn4)[N@H+]3C(C)C)C2)c1 ZINC001164840039 720506049 /nfs/dbraw/zinc/50/60/49/720506049.db2.gz WBRYESHDBNANHX-GBESFXJTSA-N 1 1 431.968 3.486 20 0 IGADMO CC(C)[N@@H+]1[C@@H]2CCN(c3ncccc3C(=O)N3CCCCC3)C[C@H]2C[C@H]1Cn1cccn1 ZINC001164832943 720512477 /nfs/dbraw/zinc/51/24/77/720512477.db2.gz CBQNSXXGFDIGDE-FUPPJEDESA-N 1 1 436.604 3.282 20 0 IGADMO CCOC(=O)c1cc(N2CC[C@@H]3[C@@H](C[C@@H](Cn4cccn4)[N@H+]3C(C)C)C2)ncc1Cl ZINC001164839048 720513568 /nfs/dbraw/zinc/51/35/68/720513568.db2.gz SEXIBUDJBJFKRG-ABSDTBQOSA-N 1 1 431.968 3.486 20 0 IGADMO COc1cc2ncnc(N3CC[C@@H]4[C@@H](C[C@H](Cn5cccn5)[N@H+]4C(C)C)C3)c2cc1OC ZINC001164834882 720519280 /nfs/dbraw/zinc/51/92/80/720519280.db2.gz HUFMULYFRVXVLH-WAOWUJCRSA-N 1 1 436.560 3.221 20 0 IGADMO COc1cc2ncnc(N3CC[C@@H]4[C@@H](C[C@@H](Cn5cccn5)[N@H+]4C(C)C)C3)c2c(OC)c1 ZINC001164842924 720554103 /nfs/dbraw/zinc/55/41/03/720554103.db2.gz YZUFYLYXXABRMR-BBTUJRGHSA-N 1 1 436.560 3.221 20 0 IGADMO COc1cc2ncnc(N3CC[C@@H]4[C@H](C[C@@H](Cn5cccn5)[N@H+]4C(C)C)C3)c2c(OC)c1 ZINC001164842928 720555030 /nfs/dbraw/zinc/55/50/30/720555030.db2.gz YZUFYLYXXABRMR-LVCYWYKZSA-N 1 1 436.560 3.221 20 0 IGADMO CCOC(=O)c1c(C)cc(N2CC[C@@H]3[C@@H](C[C@@H](Cn4cccn4)[N@H+]3C(C)C)C2)nc1C ZINC001164841403 720558851 /nfs/dbraw/zinc/55/88/51/720558851.db2.gz UYFGIQPXUSSKHK-PCCBWWKXSA-N 1 1 425.577 3.449 20 0 IGADMO CSc1nc2ncnc(N3CC[C@@H]4[C@@H](C[C@@H](Cn5cccn5)[N@H+]4C(C)C)C3)c2s1 ZINC001164835468 720572534 /nfs/dbraw/zinc/57/25/34/720572534.db2.gz HJNUQCGFQLUVCX-HRCADAONSA-N 1 1 429.619 3.383 20 0 IGADMO CCOC(=O)c1nc(N2CC[C@@H]3[C@H](C[C@@H](Cn4cccn4)[N@H+]3C(C)C)C2)ccc1Cl ZINC001164837750 720583249 /nfs/dbraw/zinc/58/32/49/720583249.db2.gz JCQSMUAWKFWPAO-ZIFCJYIRSA-N 1 1 431.968 3.486 20 0 IGADMO CCOC(=O)c1cnc2cc(N3CC[C@@H]4[C@@H](C[C@@H](Cn5cccn5)[N@@H+]4C(C)C)C3)[nH]cc1-2 ZINC001164840833 720593382 /nfs/dbraw/zinc/59/33/82/720593382.db2.gz QYECULDINBRLIV-NPPFBWRTSA-N 1 1 436.560 3.314 20 0 IGADMO CCOC(=O)c1cnc2cc(N3CC[C@@H]4[C@@H](C[C@@H](Cn5cccn5)[N@H+]4C(C)C)C3)[nH]cc1-2 ZINC001164840833 720593391 /nfs/dbraw/zinc/59/33/91/720593391.db2.gz QYECULDINBRLIV-NPPFBWRTSA-N 1 1 436.560 3.314 20 0 IGADMO COC(=O)c1c[n-]c2nc[nH+]c(N3CCC4(C[C@@H]([N@@H+](C)Cc5ccccc5)CO4)CC3)c12 ZINC001164844932 720698412 /nfs/dbraw/zinc/69/84/12/720698412.db2.gz WPPKVXKXKWRKFK-GOSISDBHSA-N 1 1 435.528 3.004 20 0 IGADMO COC(=O)c1c[nH]c2ncnc(N3CCC4(C[C@@H]([N@H+](C)Cc5ccccc5)CO4)CC3)c12 ZINC001164844932 720698426 /nfs/dbraw/zinc/69/84/26/720698426.db2.gz WPPKVXKXKWRKFK-GOSISDBHSA-N 1 1 435.528 3.004 20 0 IGADMO COC(=O)c1c[nH]c2ncnc(N3CCC4(C[C@@H]([N@@H+](C)Cc5ccccc5)CO4)CC3)c12 ZINC001164844932 720698436 /nfs/dbraw/zinc/69/84/36/720698436.db2.gz WPPKVXKXKWRKFK-GOSISDBHSA-N 1 1 435.528 3.004 20 0 IGADMO CN1CCOc2c(Cl)nnc(N3CCC4(C[C@H]([N@@H+](C)Cc5ccccc5)CO4)CC3)c21 ZINC001164842281 720708438 /nfs/dbraw/zinc/70/84/38/720708438.db2.gz XMMCEBLDYZTQFI-SFHVURJKSA-N 1 1 443.979 3.219 20 0 IGADMO CSc1cnc(Cl)c(C(F)(F)N2CC[N@@H+]3C[C@H](Oc4cncnc4)C[C@H]3C2)c1 ZINC001164744121 720749378 /nfs/dbraw/zinc/74/93/78/720749378.db2.gz REYHFDFWWFLQOL-QWHCGFSZSA-N 1 1 427.908 3.134 20 0 IGADMO CSc1cnc(Cl)c(C(F)(F)N2CC[N@H+]3C[C@H](Oc4cncnc4)C[C@H]3C2)c1 ZINC001164744121 720749385 /nfs/dbraw/zinc/74/93/85/720749385.db2.gz REYHFDFWWFLQOL-QWHCGFSZSA-N 1 1 427.908 3.134 20 0 IGADMO Clc1c[nH]c2nc(Cl)nc(N3CC[C@@H]4[C@@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)c12 ZINC001164747701 720810377 /nfs/dbraw/zinc/81/03/77/720810377.db2.gz PCPKBCLHNCVMMF-SQWLQELKSA-N 1 1 447.374 3.236 20 0 IGADMO Clc1ncnc2scc(N3CC[C@@H]4[C@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)c21 ZINC001164741740 720822765 /nfs/dbraw/zinc/82/27/65/720822765.db2.gz OCJIHNAEMHBMMB-BZUAXINKSA-N 1 1 429.981 3.316 20 0 IGADMO Fc1cccc2c1nc(Cl)nc2N1CC[C@@H]2[C@@H](C[C@@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164737973 720824867 /nfs/dbraw/zinc/82/48/67/720824867.db2.gz CTJYLAGEEANGOM-TXPKVOOTSA-N 1 1 441.942 3.393 20 0 IGADMO c1ncn(C[C@@H]2C[C@@H]3CN(c4cc(OCc5ccccc5)cnn4)CC[C@H]3[N@@H+]2CC2CC2)n1 ZINC001164750998 720834646 /nfs/dbraw/zinc/83/46/46/720834646.db2.gz XOOUABRHCFDCFD-AOHZBQACSA-N 1 1 445.571 3.027 20 0 IGADMO CCc1cc2c(nc(Cl)nc2N2CC[C@@H]3[C@H](C[C@H](Cn4cncn4)[N@H+]3CC3CC3)C2)[nH]1 ZINC001164747540 720842805 /nfs/dbraw/zinc/84/28/05/720842805.db2.gz REFRBANKHGUSLX-SZVBFZGTSA-N 1 1 440.983 3.145 20 0 IGADMO COc1ccccc1-c1ccc(N2CC[C@@H]3[C@H](C[C@@H](Cn4cncn4)[N@H+]3CC3CC3)C2)nn1 ZINC001164745205 720847890 /nfs/dbraw/zinc/84/78/90/720847890.db2.gz MRCPYIBNQVUGKT-ZRCGQRJVSA-N 1 1 445.571 3.123 20 0 IGADMO Fc1cc2ncc(Cl)nc2cc1N1CC[C@@H]2[C@H](C[C@@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164744635 720851035 /nfs/dbraw/zinc/85/10/35/720851035.db2.gz LABSMUIOUUJJRN-GQIGUUNPSA-N 1 1 441.942 3.393 20 0 IGADMO Cc1cc(N2CC[C@@H]3[C@@H](C[C@@H](Cn4cncn4)[N@H+]3CC3CC3)C2)nc(-c2ccsc2)n1 ZINC001164743926 720851431 /nfs/dbraw/zinc/85/14/31/720851431.db2.gz BAGAISFFCFJHJV-PCCBWWKXSA-N 1 1 435.601 3.484 20 0 IGADMO COCC[N@H+]1CCO[C@H]2CN(c3nc(-c4ccccc4)nc(-c4ccccc4)n3)CC[C@H]2C1 ZINC001164850154 720852098 /nfs/dbraw/zinc/85/20/98/720852098.db2.gz DPIVGAHUOFTCEX-GOTSBHOMSA-N 1 1 445.567 3.379 20 0 IGADMO Fc1cnc(N2CC[C@@H]3[C@@H](C[C@@H](Cn4cncn4)[N@H+]3CC3CC3)C2)nc1-c1ccsc1 ZINC001164753598 720858539 /nfs/dbraw/zinc/85/85/39/720858539.db2.gz YOZAGVRUJKVXFE-CMKODMSKSA-N 1 1 439.564 3.315 20 0 IGADMO CC[C@H](C)c1nc2[nH]ccc2c(N2CC[C@@H]3[C@H](C[C@@H](Cn4cncn4)[N@H+]3CC3CC3)C2)n1 ZINC001164754077 720861628 /nfs/dbraw/zinc/86/16/28/720861628.db2.gz ZYCUOJGJLWIPCI-GZMOKQHVSA-N 1 1 434.592 3.442 20 0 IGADMO COCC[N@H+]1CCO[C@@H]2CN(C(F)(F)c3nc4ccccc4nc3Cl)CC[C@H]2C1 ZINC001164853111 720863806 /nfs/dbraw/zinc/86/38/06/720863806.db2.gz GMPCIVLKUQMPGW-WMLDXEAASA-N 1 1 426.895 3.002 20 0 IGADMO Cc1nc(N(C)C)cc(N2CC[C@]3(C2)C[N@H+](CC2CC2)C[C@H]3COCc2cccnc2)n1 ZINC001164755904 720874567 /nfs/dbraw/zinc/87/45/67/720874567.db2.gz ZSPCCOGSXQLGMT-WIOPSUGQSA-N 1 1 436.604 3.001 20 0 IGADMO Cc1nc(N(C)C)cc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COCc2cccnc2)n1 ZINC001164755904 720874573 /nfs/dbraw/zinc/87/45/73/720874573.db2.gz ZSPCCOGSXQLGMT-WIOPSUGQSA-N 1 1 436.604 3.001 20 0 IGADMO COCC[N@H+]1CCO[C@@H]2CN(c3cnc(Cl)nc3Oc3ccc(C)cc3)CC[C@H]2C1 ZINC001164853759 720888940 /nfs/dbraw/zinc/88/89/40/720888940.db2.gz CRINLIZFSYJSJJ-FXAWDEMLSA-N 1 1 432.952 3.404 20 0 IGADMO Cc1nc2ccc(N3CC[C@]4(C3)C[N@@H+](CC3CC3)C[C@@H]4COCc3cccnc3)nc2n1C ZINC001164755080 720890388 /nfs/dbraw/zinc/89/03/88/720890388.db2.gz KPYBZPKMMCFCRH-ATIYNZHBSA-N 1 1 446.599 3.427 20 0 IGADMO CSc1cnc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COCc2cccnc2)nc1 ZINC001164754546 720895314 /nfs/dbraw/zinc/89/53/14/720895314.db2.gz JHIIJWLLJASIOK-REWPJTCUSA-N 1 1 425.602 3.349 20 0 IGADMO CSc1cncc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COCc2cccnc2)n1 ZINC001164755261 720923738 /nfs/dbraw/zinc/92/37/38/720923738.db2.gz ZZRIVSOUMQTPHB-REWPJTCUSA-N 1 1 425.602 3.349 20 0 IGADMO Nc1nc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COCc2cccnc2)ccc1Cl ZINC001164754673 720936599 /nfs/dbraw/zinc/93/65/99/720936599.db2.gz XFNJGHIXNXFNCL-AUSIDOKSSA-N 1 1 427.980 3.467 20 0 IGADMO COC(=O)c1cc2c(nc(Cl)nc2N2CCn3c(C[N@@H+](C)C(C)C)cnc3[C@@H]2C)[nH]1 ZINC001164864150 720973771 /nfs/dbraw/zinc/97/37/71/720973771.db2.gz YDOYAIASGFAYOP-LBPRGKRZSA-N 1 1 431.928 3.016 20 0 IGADMO CCOC(=O)c1cc2ncnc(N3CCn4c(C[N@@H+](C)C(C)C)cnc4[C@@H]3C)c2s1 ZINC001164863473 720979416 /nfs/dbraw/zinc/97/94/16/720979416.db2.gz VRLMGXTUTKVPRI-AWEZNQCLSA-N 1 1 428.562 3.486 20 0 IGADMO CN1C[C@H](COCC2CC2)[C@@H]2CCN(c3ccc(C[N@@H+](C)C4CC4)cn3)CC[C@@H]2C1=O ZINC001164860345 721029525 /nfs/dbraw/zinc/02/95/25/721029525.db2.gz LKZSCWVRRMZCFR-PUHATCMVSA-N 1 1 426.605 3.023 20 0 IGADMO FC(F)(c1ccc2nc(Cl)cnc2c1)N1CCc2[nH+]cc(Cn3cccn3)n2CC1 ZINC001164864102 721032725 /nfs/dbraw/zinc/03/27/25/721032725.db2.gz XVXKNLIPXNVZSX-UHFFFAOYSA-N 1 1 429.862 3.332 20 0 IGADMO FC(F)(c1cnc(Cl)nc1Cl)N1CC[N@H+]2C[C@H](OCc3cccnc3)C[C@H]2C1 ZINC001164868448 721048135 /nfs/dbraw/zinc/04/81/35/721048135.db2.gz OMARNPIHUYWKGG-UONOGXRCSA-N 1 1 430.286 3.203 20 0 IGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2C[C@H](NC(=O)c3cccn3C)[C@@H]3OCCC[C@@H]32)nc1 ZINC001164761035 721067354 /nfs/dbraw/zinc/06/73/54/721067354.db2.gz AKSJABBMDVVUAJ-XARGGIHNSA-N 1 1 437.588 3.133 20 0 IGADMO COc1ccc2nc(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@@H]4C3)c(Cl)nc2c1 ZINC001164866409 721076368 /nfs/dbraw/zinc/07/63/68/721076368.db2.gz TZTUXJGCKKYALN-SJLPKXTDSA-N 1 1 425.920 3.167 20 0 IGADMO CCOC(=O)c1cc(Cl)nc(N2CC[N@H+]3C[C@@H](OCc4cccnc4)C[C@H]3C2)c1C ZINC001164867719 721086768 /nfs/dbraw/zinc/08/67/68/721086768.db2.gz ZSQNPRNJSJNGCQ-ROUUACIJSA-N 1 1 430.936 3.095 20 0 IGADMO COc1cc2c(cc1Cl)ncnc2N1CC[N@H+]2C[C@H](OCc3cccnc3)C[C@H]2C1 ZINC001164865914 721091521 /nfs/dbraw/zinc/09/15/21/721091521.db2.gz PRSZMDVZSPOPSN-DLBZAZTESA-N 1 1 425.920 3.167 20 0 IGADMO COC(=O)C[C@H](c1ccnc(N2CC[N@H+]3C[C@H](OCc4cccnc4)C[C@H]3C2)c1)C1CC1 ZINC001164881018 721135041 /nfs/dbraw/zinc/13/50/41/721135041.db2.gz YVIMDUHZMUBJRW-ZRBLBEILSA-N 1 1 436.556 3.013 20 0 IGADMO c1ccc2nc(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@H]4C3)c(N3CCCCC3)nc2c1 ZINC001164874431 721136536 /nfs/dbraw/zinc/13/65/36/721136536.db2.gz JXOOMVYDEKKPLS-VXKWHMMOSA-N 1 1 444.583 3.495 20 0 IGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4nc(Cl)ncc4OCc4ccccc4)C[C@@H]3C2)cn1 ZINC001164765603 721139438 /nfs/dbraw/zinc/13/94/38/721139438.db2.gz JNNUIPNDBFSLOU-UXHICEINSA-N 1 1 438.963 3.401 20 0 IGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4ncnc5c4ccn5Cc4cccc(F)c4)C[C@H]3C2)cn1 ZINC001164762678 721144712 /nfs/dbraw/zinc/14/47/12/721144712.db2.gz DECTXKAMWMSLSX-LEWJYISDSA-N 1 1 445.546 3.311 20 0 IGADMO COc1ccc(OC)c(-c2ccc(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@@H]4C3)nn2)c1 ZINC001164880373 721164589 /nfs/dbraw/zinc/16/45/89/721164589.db2.gz WAKRWJQOCWOBTE-TZIWHRDSSA-N 1 1 447.539 3.036 20 0 IGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4ncc(C(=O)N5CCCCC5)cc4Cl)C[C@@H]3C2)cn1 ZINC001164761971 721208090 /nfs/dbraw/zinc/20/80/90/721208090.db2.gz BGYNKDUXRFZCDW-ICSRJNTNSA-N 1 1 442.995 3.053 20 0 IGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(C(Cl)(Cl)Oc4ccc(Cl)nc4)C[C@@H]3C2)cn1 ZINC001164766879 721244839 /nfs/dbraw/zinc/24/48/39/721244839.db2.gz VSXGATDYVDOTEE-CABCVRRESA-N 1 1 430.767 3.390 20 0 IGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@@]2(CCCN(C(F)(F)c3cnnc(Cl)c3)C2)C1 ZINC001164780092 721350881 /nfs/dbraw/zinc/35/08/81/721350881.db2.gz ZNRNPLYEALUXNH-IBGZPJMESA-N 1 1 441.910 3.399 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@@]2(CCCN(C(F)(F)c3cnnc(Cl)c3)C2)C1 ZINC001164780092 721350884 /nfs/dbraw/zinc/35/08/84/721350884.db2.gz ZNRNPLYEALUXNH-IBGZPJMESA-N 1 1 441.910 3.399 20 0 IGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@]2(CCCN(c3nccc(OC(C)(C)C)n3)C2)C1 ZINC001164780107 721351484 /nfs/dbraw/zinc/35/14/84/721351484.db2.gz ZSWAXJZSWGCSJV-HSZRJFAPSA-N 1 1 429.565 3.378 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@]2(CCCN(c3nccc(OC(C)(C)C)n3)C2)C1 ZINC001164780107 721351487 /nfs/dbraw/zinc/35/14/87/721351487.db2.gz ZSWAXJZSWGCSJV-HSZRJFAPSA-N 1 1 429.565 3.378 20 0 IGADMO COc1nc(N2CCC[C@]3(C2)COCC[N@H+](Cc2c(C)noc2C)C3)nc2ccccc21 ZINC001164778825 721354420 /nfs/dbraw/zinc/35/44/20/721354420.db2.gz OYYGOIMCUVBVJJ-DEOSSOPVSA-N 1 1 437.544 3.362 20 0 IGADMO COc1nc(N2CCC[C@]3(C2)COCC[N@@H+](Cc2c(C)noc2C)C3)nc2ccccc21 ZINC001164778825 721354424 /nfs/dbraw/zinc/35/44/24/721354424.db2.gz OYYGOIMCUVBVJJ-DEOSSOPVSA-N 1 1 437.544 3.362 20 0 IGADMO O=C1C[C@@H]2[C@@H](CCN2c2ncnc3c2CC[N@H+](Cc2ccccc2)C3)N1c1ccsc1 ZINC001164883205 721355688 /nfs/dbraw/zinc/35/56/88/721355688.db2.gz ODFGCKFAKNYPQX-FGZHOGPDSA-N 1 1 431.565 3.481 20 0 IGADMO O=C1C[C@@H]2[C@@H](CCN2c2ncnc3c2CC[N@@H+](Cc2ccccc2)C3)N1c1ccsc1 ZINC001164883205 721355690 /nfs/dbraw/zinc/35/56/90/721355690.db2.gz ODFGCKFAKNYPQX-FGZHOGPDSA-N 1 1 431.565 3.481 20 0 IGADMO Cc1noc(C)c1CN1CCOC[C@]2(CCCN(c3ccc(C[NH+]4CCCC4)cn3)C2)C1 ZINC001164784918 721365428 /nfs/dbraw/zinc/36/54/28/721365428.db2.gz RNUJGCGWLDJVFN-RUZDIDTESA-N 1 1 439.604 3.401 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@@]2(CCCN(c3cc4c(nn3)CC[C@H](C)C4)C2)C1 ZINC001164785269 721371843 /nfs/dbraw/zinc/37/18/43/721371843.db2.gz SWFHLZFWWGEXAM-XDHUDOTRSA-N 1 1 425.577 3.325 20 0 IGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@@]2(CCCN(c3cc4c(nn3)CC[C@H](C)C4)C2)C1 ZINC001164785269 721371845 /nfs/dbraw/zinc/37/18/45/721371845.db2.gz SWFHLZFWWGEXAM-XDHUDOTRSA-N 1 1 425.577 3.325 20 0 IGADMO Cc1noc(C)c1CN1CCOC[C@@]2(CCCN(c3ncccc3C[NH+]3CCCC3)C2)C1 ZINC001164784601 721374884 /nfs/dbraw/zinc/37/48/84/721374884.db2.gz QRWVDBGLQJSIAN-VWLOTQADSA-N 1 1 439.604 3.401 20 0 IGADMO CSc1nc2ccsc2c(N2CC[C@@]3(C2)CCC[C@H](CN2CC[NH+](C)CC2)O3)n1 ZINC001164891954 721406788 /nfs/dbraw/zinc/40/67/88/721406788.db2.gz WYHKHUKNHXAFKV-IIBYNOLFSA-N 1 1 433.647 3.179 20 0 IGADMO Cc1sc2nc(C)nc(N3CC[C@]4(C3)CCC[C@@H](CN3CC[NH+](C)CC3)O4)c2c1C ZINC001164891925 721409293 /nfs/dbraw/zinc/40/92/93/721409293.db2.gz WQWHNHSLVBINLO-CVDCTZTESA-N 1 1 429.634 3.382 20 0 IGADMO O=C(NC1CCCC1)c1cnc(N2C[C@H]3C[NH+](Cc4nccs4)C[C@@H]3C2)c(Cl)c1 ZINC001164782759 721428821 /nfs/dbraw/zinc/42/88/21/721428821.db2.gz HTYHWOYOASUFFH-HZPDHXFCSA-N 1 1 431.993 3.432 20 0 IGADMO c1csc(C[NH+]2C[C@@H]3CN(c4ccc(-c5ccc6c(c5)OCCCO6)nn4)C[C@H]3C2)n1 ZINC001164787295 721430511 /nfs/dbraw/zinc/43/05/11/721430511.db2.gz PUDWKNRXZXSOCC-QZTJIDSGSA-N 1 1 435.553 3.330 20 0 IGADMO O=C(Nc1cccnc1Cl)OCC(F)(F)N1C[C@H]2C[NH+](Cc3nccs3)C[C@@H]2C1 ZINC001164786804 721435411 /nfs/dbraw/zinc/43/54/11/721435411.db2.gz PRYDNZQCSAFAPF-CHWSQXEVSA-N 1 1 443.907 3.397 20 0 IGADMO C[NH+]1CCN(C[C@@H]2CCC[C@@]3(CCN(c4ccc(-c5ccc(F)cc5)nn4)C3)O2)CC1 ZINC001164896072 721438926 /nfs/dbraw/zinc/43/89/26/721438926.db2.gz QKCLAVVXOXNOAG-URXFXBBRSA-N 1 1 425.552 3.048 20 0 IGADMO C[NH+]1CCN(C[C@@H]2CCC[C@]3(CCN(c4ccc(-c5ccc(F)cc5)nn4)C3)O2)CC1 ZINC001164896075 721439011 /nfs/dbraw/zinc/43/90/11/721439011.db2.gz QKCLAVVXOXNOAG-XUZZJYLKSA-N 1 1 425.552 3.048 20 0 IGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1ncc(C)c(NC(C)C)n1)CC2 ZINC001164790381 721447695 /nfs/dbraw/zinc/44/76/95/721447695.db2.gz YRDZMCJLAMBZBU-NRFANRHFSA-N 1 1 431.625 3.339 20 0 IGADMO Cc1c(Cl)nc(C2CCC2)nc1N1CC[C@@]2(C1)CCC[C@@H](CN1CC[NH+](C)CC1)O2 ZINC001164891374 721448257 /nfs/dbraw/zinc/44/82/57/721448257.db2.gz UNBWTIWUXGYHKB-WMZHIEFXSA-N 1 1 434.028 3.471 20 0 IGADMO O=C(NC1CCC1)[C@@H]1COC2(C1)CCN(c1nc(Cl)ccc1C[NH+]1CCCC1)CC2 ZINC001164902453 721489650 /nfs/dbraw/zinc/48/96/50/721489650.db2.gz ZUQNJIUODHPOJH-SFHVURJKSA-N 1 1 432.996 3.375 20 0 IGADMO COC(=O)c1nc2cnccc2c(N2CCC3(CC([N@@H+](C)Cc4ccncc4)C3)CC2)n1 ZINC001164792328 721497361 /nfs/dbraw/zinc/49/73/61/721497361.db2.gz OQTWDMMVYKNDCC-UHFFFAOYSA-N 1 1 432.528 3.087 20 0 IGADMO COC(=O)CSc1cncc(N2CCC3(CC([N@@H+](C)Cc4ccncc4)C3)CC2)n1 ZINC001164796374 721501349 /nfs/dbraw/zinc/50/13/49/721501349.db2.gz SDGPTDUNVPNYHU-UHFFFAOYSA-N 1 1 427.574 3.018 20 0 IGADMO CCOC(=O)c1nc2ccccc2c(N2CC[N@H+]3C[C@@H](Oc4cccc(F)c4)C[C@H]3C2)n1 ZINC001164900063 721514551 /nfs/dbraw/zinc/51/45/51/721514551.db2.gz NRPHPFZUFYMFTO-HKUYNNGSSA-N 1 1 436.487 3.288 20 0 IGADMO COC(=O)c1cc2c(N3CC[N@H+]4C[C@@H](Oc5cccc(F)c5)C[C@H]4C3)[nH]c(Cl)cc-2n1 ZINC001164908809 721545656 /nfs/dbraw/zinc/54/56/56/721545656.db2.gz QQRIZYUWZNKVAV-HOCLYGCPSA-N 1 1 444.894 3.484 20 0 IGADMO CC(C)(C)C(=O)Nc1ccc(CO)nc1N1CC[N@H+]2C[C@H](Oc3cccc(F)c3)C[C@@H]2C1 ZINC001164906372 721546605 /nfs/dbraw/zinc/54/66/05/721546605.db2.gz KFMIFALPYXHFNJ-UYAOXDASSA-N 1 1 442.535 3.040 20 0 IGADMO Fc1cccc(O[C@H]2C[C@@H]3CN(c4ncnc5c4ncn5-c4ccccc4)CC[N@H+]3C2)c1 ZINC001164905890 721562763 /nfs/dbraw/zinc/56/27/63/721562763.db2.gz HUGQULFEPAYMFU-CTNGQTDRSA-N 1 1 430.487 3.297 20 0 IGADMO COc1nnc(Cl)cc1C(F)(F)N1CC[N@H+]2C[C@H](Oc3cccc(F)c3)C[C@@H]2C1 ZINC001164907207 721566523 /nfs/dbraw/zinc/56/65/23/721566523.db2.gz MRVSKHBCEHVOHI-UKRRQHHQSA-N 1 1 428.842 3.165 20 0 IGADMO CCOC(=O)c1cc2ccc(N3C[C@H]([N@@H+](C)Cc4cccnc4)[C@@H]4OCCC[C@@H]43)[nH]c-2n1 ZINC001164798126 721567036 /nfs/dbraw/zinc/56/70/36/721567036.db2.gz AIMXKWAUHHFEFM-JAXLGGSGSA-N 1 1 435.528 3.003 20 0 IGADMO CCOC(=O)c1cc2ccc(N3C[C@H]([N@H+](C)Cc4cccnc4)[C@@H]4OCCC[C@@H]43)nc2[nH]1 ZINC001164798126 721567045 /nfs/dbraw/zinc/56/70/45/721567045.db2.gz AIMXKWAUHHFEFM-JAXLGGSGSA-N 1 1 435.528 3.003 20 0 IGADMO CCOC(=O)c1cc2ccc(N3C[C@H]([N@@H+](C)Cc4cccnc4)[C@@H]4OCCC[C@@H]43)nc2[nH]1 ZINC001164798126 721567052 /nfs/dbraw/zinc/56/70/52/721567052.db2.gz AIMXKWAUHHFEFM-JAXLGGSGSA-N 1 1 435.528 3.003 20 0 IGADMO CN(C)c1ccc(-c2ccnc(N3C[C@H]([N@H+](C)Cc4cccnc4)[C@H]4OCCC[C@@H]43)n2)cc1 ZINC001164806652 721570258 /nfs/dbraw/zinc/57/02/58/721570258.db2.gz QKGMWQHVERIKON-SDHOMARFSA-N 1 1 444.583 3.473 20 0 IGADMO CN(C)c1ccc(-c2ccnc(N3C[C@H]([N@@H+](C)Cc4cccnc4)[C@H]4OCCC[C@@H]43)n2)cc1 ZINC001164806652 721570263 /nfs/dbraw/zinc/57/02/63/721570263.db2.gz QKGMWQHVERIKON-SDHOMARFSA-N 1 1 444.583 3.473 20 0 IGADMO COC(=O)c1ccc2cc(N3C[C@H]([N@@H+](C)Cc4cccnc4)[C@H]4OCCC[C@@H]43)ncc2c1 ZINC001164804701 721573454 /nfs/dbraw/zinc/57/34/54/721573454.db2.gz MHJDAKUIJICOQX-FIXSFTCYSA-N 1 1 432.524 3.285 20 0 IGADMO C[C@@H]1CCCN(C(=O)c2ccc(N3C[C@H]([N@@H+](C)Cc4cccnc4)[C@H]4OCCC[C@H]43)nc2)C1 ZINC001164798192 721576900 /nfs/dbraw/zinc/57/69/00/721576900.db2.gz APMKEBXPCYOECS-BRXVMWLGSA-N 1 1 449.599 3.217 20 0 IGADMO Cc1cc(Cl)nc(N2CCC(F)(F)[C@@]3(CC[N@@H+](Cc4ccccn4)C3)C2)c1C(N)=O ZINC001164904174 721585466 /nfs/dbraw/zinc/58/54/66/721585466.db2.gz DMLYMVQYEJULOQ-HXUWFJFHSA-N 1 1 435.906 3.275 20 0 IGADMO COC(=O)c1cnc(N2CCC(F)(F)[C@]3(CC[N@@H+](Cc4ccccn4)C3)C2)cc1OC ZINC001164906253 721586696 /nfs/dbraw/zinc/58/66/96/721586696.db2.gz MQENFSDPLYWQNR-NRFANRHFSA-N 1 1 432.471 3.010 20 0 IGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2nc(Cl)cc(-c3ccncc3)n2)[C@@H]2CCCO[C@H]12 ZINC001164802587 721589209 /nfs/dbraw/zinc/58/92/09/721589209.db2.gz GXMYOWHKODPVCN-SJBKTWHCSA-N 1 1 436.947 3.455 20 0 IGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2nc(Cl)cc(-c3ccncc3)n2)[C@@H]2CCCO[C@H]12 ZINC001164802587 721589212 /nfs/dbraw/zinc/58/92/12/721589212.db2.gz GXMYOWHKODPVCN-SJBKTWHCSA-N 1 1 436.947 3.455 20 0 IGADMO Cc1cccc(CN2CCO[C@H]3C[N@@H+](C(C)(C)c4ccnc(Cl)c4)CC[C@H]3C2=O)n1 ZINC001164798879 721603418 /nfs/dbraw/zinc/60/34/18/721603418.db2.gz JKRSLDXIIFLCKI-UXHICEINSA-N 1 1 428.964 3.423 20 0 IGADMO Cc1cccc(CN2CCO[C@H]3C[N@H+](C(C)(C)c4ccnc(Cl)c4)CC[C@H]3C2=O)n1 ZINC001164798879 721603419 /nfs/dbraw/zinc/60/34/19/721603419.db2.gz JKRSLDXIIFLCKI-UXHICEINSA-N 1 1 428.964 3.423 20 0 IGADMO C[C@@H]1CN(c2ccc(C[N@@H+](C)C3CC3)cn2)CC[C@@]12CC[C@H](C(=O)Nc1cccnc1)O2 ZINC001165010737 721692018 /nfs/dbraw/zinc/69/20/18/721692018.db2.gz WUMZIWRITIXZCK-KPCPBYSCSA-N 1 1 435.572 3.474 20 0 IGADMO CN(C)C(=O)C[NH+]1CCC2(CCCN2C(F)(F)c2ccc3nc(Cl)cnc3c2)CC1 ZINC001165010125 721736570 /nfs/dbraw/zinc/73/65/70/721736570.db2.gz BDNIEPRRVLZNHC-UHFFFAOYSA-N 1 1 437.922 3.351 20 0 IGADMO CN(C)C(=O)C[NH+]1CCC2(CCCN2C(F)(F)c2ccc3cnc(Cl)nc3c2)CC1 ZINC001165011385 721740793 /nfs/dbraw/zinc/74/07/93/721740793.db2.gz WALGIONNDFFOKP-UHFFFAOYSA-N 1 1 437.922 3.351 20 0 IGADMO O=C1[C@H]2CN(c3ccc4c(n3)CC[N@H+](Cc3ccccc3)C4)C[C@H]2CN1c1cccnc1 ZINC001165024873 721790088 /nfs/dbraw/zinc/79/00/88/721790088.db2.gz UDHSTBBRASRLDA-GMAHTHKFSA-N 1 1 425.536 3.134 20 0 IGADMO CCOC(=O)c1c[n-]c2nc[nH+]c(N3C[C@@H]4CCC[C@@H]([N@@H+](C)Cc5ccccn5)[C@H]4C3)c12 ZINC001165024604 721805713 /nfs/dbraw/zinc/80/57/13/721805713.db2.gz MJOUEQHRNBVCJP-FFZOFVMBSA-N 1 1 434.544 3.267 20 0 IGADMO CCOC(=O)c1c[nH]c2ncnc(N3C[C@@H]4CCC[C@@H]([N@H+](C)Cc5ccccn5)[C@H]4C3)c12 ZINC001165024604 721805718 /nfs/dbraw/zinc/80/57/18/721805718.db2.gz MJOUEQHRNBVCJP-FFZOFVMBSA-N 1 1 434.544 3.267 20 0 IGADMO CCOC(=O)c1c[nH]c2ncnc(N3C[C@@H]4CCC[C@@H]([N@@H+](C)Cc5ccccn5)[C@H]4C3)c12 ZINC001165024604 721805719 /nfs/dbraw/zinc/80/57/19/721805719.db2.gz MJOUEQHRNBVCJP-FFZOFVMBSA-N 1 1 434.544 3.267 20 0 IGADMO COc1ccc2c[nH+]c(N3CCO[C@@]4(C3)COCCN(Cc3csc(C)n3)C4)cc2c1 ZINC001164920456 721830454 /nfs/dbraw/zinc/83/04/54/721830454.db2.gz DTZHVZDFDDIFQO-QHCPKHFHSA-N 1 1 440.569 3.116 20 0 IGADMO Clc1ccc(C[NH+]2CCCC2)c(N2C[C@@H]3COC[C@@]3(COCc3ccccn3)C2)n1 ZINC001164921777 721839173 /nfs/dbraw/zinc/83/91/73/721839173.db2.gz FWBSGUVUGNMNSC-AUSIDOKSSA-N 1 1 428.964 3.395 20 0 IGADMO c1ccc(CN2CCc3c(ncnc3N3CC[NH+](CCOc4ccccc4)CC3)C2)cc1 ZINC001165044685 721956000 /nfs/dbraw/zinc/95/60/00/721956000.db2.gz OINCNIQAIKCQGF-UHFFFAOYSA-N 1 1 429.568 3.236 20 0 IGADMO NC(=O)c1cc(Cl)ncc1C(F)(F)N1CCC2(CC[N@@H+](Cc3cccnc3)C2)CC1 ZINC001164955613 722021232 /nfs/dbraw/zinc/02/12/32/722021232.db2.gz KGJKMBCWGASHIZ-UHFFFAOYSA-N 1 1 435.906 3.266 20 0 IGADMO CCOC(=O)c1cnc(N2CCC3(CC2)COCC[N@@H+](Cc2ccncc2)C3)c(Cl)c1 ZINC001164964314 722056699 /nfs/dbraw/zinc/05/66/99/722056699.db2.gz UQBRDRKXLUEREG-UHFFFAOYSA-N 1 1 444.963 3.426 20 0 IGADMO Cc1cc(C(F)(F)N2CCC3(CC2)COCC[N@@H+](Cc2ccncc2)C3)c(Cl)nn1 ZINC001164960656 722060000 /nfs/dbraw/zinc/06/00/00/722060000.db2.gz GDDMGYRWHGANQH-UHFFFAOYSA-N 1 1 437.922 3.497 20 0 IGADMO CN(C)C(=O)N[C@H]1c2ccccc2[C@H]2CN(c3cc(OC4CC[NH+](C)CC4)ccn3)C[C@H]12 ZINC001164985737 722098247 /nfs/dbraw/zinc/09/82/47/722098247.db2.gz WJPWRAKKTDXXMB-GPXNEJASSA-N 1 1 435.572 3.101 20 0 IGADMO COc1ccc2nc(Cl)nc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)c2c1 ZINC001164984342 722099266 /nfs/dbraw/zinc/09/92/66/722099266.db2.gz SQLWPLRRXLOIRR-UTKZUKDTSA-N 1 1 439.947 3.414 20 0 IGADMO COc1ccc2nc(Cl)nc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)c2c1 ZINC001164984340 722099552 /nfs/dbraw/zinc/09/95/52/722099552.db2.gz SQLWPLRRXLOIRR-LAUBAEHRSA-N 1 1 439.947 3.414 20 0 IGADMO CCOC(=O)c1cc(N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)ncc1Cl ZINC001164980808 722103096 /nfs/dbraw/zinc/10/30/96/722103096.db2.gz KLDPAGDFZYIKGF-FXAWDEMLSA-N 1 1 430.936 3.034 20 0 IGADMO Clc1cc(-c2ccncc2)c(N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)nn1 ZINC001164986044 722104317 /nfs/dbraw/zinc/10/43/17/722104317.db2.gz XVBHFCVJPBNTNM-CTNGQTDRSA-N 1 1 436.947 3.314 20 0 IGADMO COc1ccc2nc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)c(Cl)nc2c1 ZINC001164975709 722111233 /nfs/dbraw/zinc/11/12/33/722111233.db2.gz KKJBLZMXLCKAOP-UWJYYQICSA-N 1 1 439.947 3.414 20 0 IGADMO c1ccc(COc2cnc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)cn2)cc1 ZINC001164984919 722133381 /nfs/dbraw/zinc/13/33/81/722133381.db2.gz YLFWGWCCMKDCJO-DHIUTWEWSA-N 1 1 431.540 3.178 20 0 IGADMO FC(F)(c1nc2ccc(Cl)nc2[nH]1)N1CC[C@H]2C[N@@H+](Cc3cccnc3)CCO[C@@H]2C1 ZINC001164980895 722145630 /nfs/dbraw/zinc/14/56/30/722145630.db2.gz NKHITMSFERZDRT-DOTOQJQBSA-N 1 1 448.905 3.279 20 0 IGADMO Cc1nc(-c2ccccn2)nc(N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)c1C ZINC001164978049 722148405 /nfs/dbraw/zinc/14/84/05/722148405.db2.gz JKDPXASXFDJEQS-GGAORHGYSA-N 1 1 430.556 3.278 20 0 IGADMO Cc1ccc(NC[C@H]2CO[C@]3(C2)COCC[N@@H+](C(C)(C)c2ccnc(Cl)c2)C3)nn1 ZINC001164636769 719267236 /nfs/dbraw/zinc/26/72/36/719267236.db2.gz JZFAHVZIANLTBX-JTSKRJEESA-N 1 1 431.968 3.288 20 0 IGADMO Cc1ccc(NC[C@H]2CO[C@]3(C2)COCC[N@H+](C(C)(C)c2ccnc(Cl)c2)C3)nn1 ZINC001164636769 719267242 /nfs/dbraw/zinc/26/72/42/719267242.db2.gz JZFAHVZIANLTBX-JTSKRJEESA-N 1 1 431.968 3.288 20 0 IGADMO CC(C)n1nc(C[NH+](C)C)c2c1CN(c1ncccc1C(=O)NCc1ccccc1)CC2 ZINC001164647832 719308054 /nfs/dbraw/zinc/30/80/54/719308054.db2.gz NRUSHGHOGLLVFQ-UHFFFAOYSA-N 1 1 432.572 3.413 20 0 IGADMO CNC(=O)C[N@H+]1CCCC12CCN(C(F)(F)c1nc3ccsc3c(Cl)n1)CC2 ZINC001164682250 719706568 /nfs/dbraw/zinc/70/65/68/719706568.db2.gz CSLRIEVZLGYVRQ-UHFFFAOYSA-N 1 1 429.924 3.070 20 0 IGADMO CC(C)(c1ccnc(Cl)c1)[N@@H+]1CC[C@@H]2C[C@@H](C(=O)NCCc3ccccn3)O[C@H]2C1 ZINC001164701406 719820696 /nfs/dbraw/zinc/82/06/96/719820696.db2.gz OVWRQDRZCNSGII-UXPWSPDFSA-N 1 1 428.964 3.203 20 0 IGADMO CC(C)(c1ccnc(Cl)c1)[N@H+]1CC[C@@H]2C[C@@H](C(=O)NCCc3ccccn3)O[C@H]2C1 ZINC001164701406 719820698 /nfs/dbraw/zinc/82/06/98/719820698.db2.gz OVWRQDRZCNSGII-UXPWSPDFSA-N 1 1 428.964 3.203 20 0 IGADMO COC[C@@H]1CN(c2nc(C[NH+]3CCCC3)nc3sc(C)c(C)c32)Cc2cn(C)nc21 ZINC001164695822 719832293 /nfs/dbraw/zinc/83/22/93/719832293.db2.gz PGPRCLMRQGVOMK-KRWDZBQOSA-N 1 1 426.590 3.388 20 0 IGADMO CC[N@H+]1CCCC[C@H]1c1ccc(N2Cc3nnn(C)c3[C@H](COCc3cccnc3)C2)nc1 ZINC001164695445 719835487 /nfs/dbraw/zinc/83/54/87/719835487.db2.gz MYOOGJXICCHQDC-GMAHTHKFSA-N 1 1 447.587 3.473 20 0 IGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2Cc3nnn(C)c3[C@H](COCc3cccnc3)C2)nc1 ZINC001164695447 719835787 /nfs/dbraw/zinc/83/57/87/719835787.db2.gz MYOOGJXICCHQDC-JTHBVZDNSA-N 1 1 447.587 3.473 20 0 IGADMO CCC[N@H+]1CCCC[C@@H]1c1ccc(N2CC[C@@H](N3CCOCC3)C[C@]2(C)C(=O)OC)nc1 ZINC001164703850 719877108 /nfs/dbraw/zinc/87/71/08/719877108.db2.gz KYRIBCAIHAIRBQ-TZBSWOFLSA-N 1 1 444.620 3.251 20 0 IGADMO O=c1ccccn1Cc1ccc(N2CCC3(CC2)C[N@@H+](Cc2cccs2)CCO3)nc1 ZINC001164707750 719898511 /nfs/dbraw/zinc/89/85/11/719898511.db2.gz XIFIRELXOXEIOG-UHFFFAOYSA-N 1 1 436.581 3.225 20 0 IGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1ncccc1C(=O)NC1CCCCC1)C2 ZINC001164805888 720077790 /nfs/dbraw/zinc/07/77/90/720077790.db2.gz AIZFDISIJIQZAZ-NLFFAJNJSA-N 1 1 426.605 3.329 20 0 IGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1nc3cc(C(=O)OC)ccc3nc1Cl)C2 ZINC001164810413 720078211 /nfs/dbraw/zinc/07/82/11/720078211.db2.gz LSSCXCQMXSQZIR-GAJHUEQPSA-N 1 1 444.963 3.255 20 0 IGADMO CCOC(=O)c1cc(C)cc(N2CCC3(C[C@H](COC)[N@@H+](Cc4ccccn4)C3)CC2)n1 ZINC001164709675 720102597 /nfs/dbraw/zinc/10/25/97/720102597.db2.gz CDTVUGRJLNGHQB-OAQYLSRUSA-N 1 1 438.572 3.469 20 0 IGADMO COc1cc2ccc(N3CCCn4c(=O)cc(C[N@@H+](C)C(C)C)nc4C3)nc2cc1OC ZINC001164811968 720227918 /nfs/dbraw/zinc/22/79/18/720227918.db2.gz BNOFAGGIPBEHNJ-UHFFFAOYSA-N 1 1 437.544 3.059 20 0 IGADMO CC(C)[N@@H+](C)Cc1cc(=O)n2c(n1)CN(c1nccc(Oc3ccc(F)cc3)n1)CCC2 ZINC001164813852 720239730 /nfs/dbraw/zinc/23/97/30/720239730.db2.gz QBUPOEMRMPBUOI-UHFFFAOYSA-N 1 1 438.507 3.215 20 0 IGADMO COc1cc2nc(N3CCCn4c(=O)cc(C[N@@H+](C)C(C)C)nc4C3)ccc2c(OC)c1 ZINC001164817480 720244148 /nfs/dbraw/zinc/24/41/48/720244148.db2.gz RMDQZHIBNYBOHY-UHFFFAOYSA-N 1 1 437.544 3.059 20 0 IGADMO Clc1nc2c(ncn2[C@H]2CCCCO2)c(N2CC[C@@H]3[C@@H]2CC[N@H+]3Cc2cccnc2)n1 ZINC001164721655 720380049 /nfs/dbraw/zinc/38/00/49/720380049.db2.gz AIGLEGLJFDEPIA-FGTMMUONSA-N 1 1 439.951 3.427 20 0 IGADMO CCOC(=O)c1cnc(N2CC[C@@H]3[C@H](C[C@H](Cn4cccn4)[N@H+]3C(C)C)C2)cc1OCC ZINC001164838435 720540156 /nfs/dbraw/zinc/54/01/56/720540156.db2.gz NUWXPCZFWBNCPO-SFHLNBCPSA-N 1 1 441.576 3.231 20 0 IGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@@H]2CN(c3nc(-c4ccccc4)nc(N(C)C)n3)CC[C@@H]21 ZINC001164842107 720560773 /nfs/dbraw/zinc/56/07/73/720560773.db2.gz WNIPCLNFBRVENL-FSSWDIPSSA-N 1 1 446.603 3.179 20 0 IGADMO COc1cc(OC)c2ncnc(N3CC[C@@H]4[C@H](C[C@H](Cn5cccn5)[N@H+]4C(C)C)C3)c2c1 ZINC001164842500 720645260 /nfs/dbraw/zinc/64/52/60/720645260.db2.gz RUDJCIMYSIEWSJ-DBXWQHBBSA-N 1 1 436.560 3.221 20 0 IGADMO Cc1cc(Cl)nc(N2CCC3(C[C@H]([N@@H+](C)Cc4ccccc4)CO3)CC2)c1C(N)=O ZINC001164837512 720664340 /nfs/dbraw/zinc/66/43/40/720664340.db2.gz BXCNGKWHMAOKEH-SFHVURJKSA-N 1 1 428.964 3.402 20 0 IGADMO COC(=O)c1cnc(N2CCC3(C[C@H]([N@@H+](C)Cc4ccccc4)CO3)CC2)cc1OC ZINC001164843760 720669111 /nfs/dbraw/zinc/66/91/11/720669111.db2.gz XRCALEUBBRUJJD-IBGZPJMESA-N 1 1 425.529 3.137 20 0 IGADMO COCCOC(=O)c1ccnc(N2CCC3(C[C@@H]([N@@H+](C)Cc4ccccc4)CO3)CC2)c1 ZINC001164842282 720724939 /nfs/dbraw/zinc/72/49/39/720724939.db2.gz XOMWBFHKVFRTOA-JOCHJYFZSA-N 1 1 439.556 3.145 20 0 IGADMO c1ccc(Cc2nnc(N3CC[N@H+]4C[C@@H](Oc5cncnc5)C[C@@H]4C3)c3ccccc23)cc1 ZINC001164742868 720755037 /nfs/dbraw/zinc/75/50/37/720755037.db2.gz OQSAQDWPZOIRPV-RTWAWAEBSA-N 1 1 438.535 3.353 20 0 IGADMO Fc1ccc(Oc2nc(Cl)ncc2N2CC[N@H+]3C[C@H](Oc4cncnc4)C[C@@H]3C2)cc1 ZINC001164739927 720766602 /nfs/dbraw/zinc/76/66/02/720766602.db2.gz JUYRRRQUQSVPDB-NVXWUHKLSA-N 1 1 442.882 3.193 20 0 IGADMO FC(F)c1nc2ccc(Cl)cc2c(N2CC[N@H+]3C[C@@H](Oc4cncnc4)C[C@@H]3C2)n1 ZINC001164747680 720800343 /nfs/dbraw/zinc/80/03/43/720800343.db2.gz PAXMLSNWABZTBJ-KGLIPLIRSA-N 1 1 432.862 3.353 20 0 IGADMO Fc1ccc(C(F)(F)N2CC[C@@H]3[C@H](C[C@@H](Cn4cncn4)[N@H+]3CC3CC3)C2)nc1Cl ZINC001164742696 720814851 /nfs/dbraw/zinc/81/48/51/720814851.db2.gz DAUWGZMMKYXFON-HLLBOEOZSA-N 1 1 440.901 3.390 20 0 IGADMO CC(C)(C)OC(=O)c1ccnc(N2CC[C@@H]3[C@H](C[C@H](Cn4cncn4)[N@H+]3CC3CC3)C2)c1 ZINC001164742054 720815611 /nfs/dbraw/zinc/81/56/11/720815611.db2.gz PGIIPIJCLJLPTE-NJDAHSKKSA-N 1 1 438.576 3.008 20 0 IGADMO c1ncn(C[C@@H]2C[C@@H]3CN(c4cncc(OCc5ccccc5)n4)CC[C@H]3[N@@H+]2CC2CC2)n1 ZINC001164737688 720817222 /nfs/dbraw/zinc/81/72/22/720817222.db2.gz BYPVYJHAGLBHBE-XPWALMASSA-N 1 1 445.571 3.027 20 0 IGADMO FC(F)(Oc1cccc(Cl)n1)N1CC[C@@H]2[C@@H](C[C@@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164738789 720820658 /nfs/dbraw/zinc/82/06/58/720820658.db2.gz GNCWLIOVBBZFIV-YESZJQIVSA-N 1 1 438.910 3.131 20 0 IGADMO Fc1cccc2nc(Cl)nc(N3CC[C@@H]4[C@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)c12 ZINC001164746263 720822095 /nfs/dbraw/zinc/82/20/95/720822095.db2.gz YSULPUPZRMLIMO-GPMSIDNRSA-N 1 1 441.942 3.393 20 0 IGADMO CSc1nc2ccsc2c(N2CC[C@@H]3[C@@H](C[C@H](Cn4cncn4)[N@H+]3CC3CC3)C2)n1 ZINC001164737727 720825622 /nfs/dbraw/zinc/82/56/22/720825622.db2.gz CGZKWWYJLBKMCQ-LZLYRXPVSA-N 1 1 441.630 3.384 20 0 IGADMO Clc1nc2c(c(N3CC[C@@H]4[C@@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)n1)CCCCC2 ZINC001164740775 720826080 /nfs/dbraw/zinc/82/60/80/720826080.db2.gz LGELSFSYUGWWOD-BBTUJRGHSA-N 1 1 442.011 3.370 20 0 IGADMO CSc1nc2ccccc2c(N2CC[C@@H]3[C@@H](C[C@@H](Cn4cncn4)[N@H+]3CC3CC3)C2)n1 ZINC001164750221 720832884 /nfs/dbraw/zinc/83/28/84/720832884.db2.gz WSDUWUOFCFJQOY-BBTUJRGHSA-N 1 1 435.601 3.323 20 0 IGADMO COc1cccc(-c2ccnc(N3CC[C@@H]4[C@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)n2)c1 ZINC001164748323 720838812 /nfs/dbraw/zinc/83/88/12/720838812.db2.gz UEUQAUIYFAEHCN-PQNGQFLHSA-N 1 1 445.571 3.123 20 0 IGADMO CCCN(CCC)c1cncc(N2CC[C@@H]3[C@H](C[C@@H](Cn4cncn4)[N@H+]3CC3CC3)C2)n1 ZINC001164751027 720839527 /nfs/dbraw/zinc/83/95/27/720839527.db2.gz XWMSDNJNFGFAMP-BHIFYINESA-N 1 1 438.624 3.074 20 0 IGADMO c1ncn(C[C@@H]2C[C@@H]3CN(c4ncc5c(n4)-c4ccccc4CC5)CC[C@H]3[N@H+]2CC2CC2)n1 ZINC001164747421 720841898 /nfs/dbraw/zinc/84/18/98/720841898.db2.gz QMJZMEOCQYFPNN-AOHZBQACSA-N 1 1 441.583 3.213 20 0 IGADMO CC(C)(C)c1nc2[nH]ccc2c(N2CC[C@@H]3[C@@H](C[C@@H](Cn4cncn4)[N@H+]3CC3CC3)C2)n1 ZINC001164741705 720842595 /nfs/dbraw/zinc/84/25/95/720842595.db2.gz FODSEMPPCVREES-CMKODMSKSA-N 1 1 434.592 3.226 20 0 IGADMO Cc1ccc(-c2ccc(N3CC[C@@H]4[C@@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)nn2)cc1 ZINC001164742485 720845188 /nfs/dbraw/zinc/84/51/88/720845188.db2.gz GSDYXLHRKXZCMS-WPFOTENUSA-N 1 1 429.572 3.423 20 0 IGADMO Cc1nc2sc3c(c2c(N2CC[C@@H]4[C@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C2)n1)CCC3 ZINC001164745772 720846638 /nfs/dbraw/zinc/84/66/38/720846638.db2.gz NHLXHSHYPCPQSO-QWFCFKBJSA-N 1 1 449.628 3.459 20 0 IGADMO Cc1nc(C2CC2)nc(Cl)c1N1CC[C@@H]2[C@@H](C[C@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164747901 720850502 /nfs/dbraw/zinc/85/05/02/720850502.db2.gz RYDMKRMXJQYVAM-IPMKNSEASA-N 1 1 427.984 3.287 20 0 IGADMO c1ncn(C[C@H]2C[C@@H]3CN(c4ccnc(Cc5ccccc5)n4)CC[C@H]3[N@H+]2CC2CC2)n1 ZINC001164753104 720851523 /nfs/dbraw/zinc/85/15/23/720851523.db2.gz WUCOBMGAVCESSG-DNVJHFABSA-N 1 1 429.572 3.038 20 0 IGADMO Fc1ccc(-c2cncc(N3CC[C@@H]4[C@@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)n2)cc1 ZINC001164750282 720857339 /nfs/dbraw/zinc/85/73/39/720857339.db2.gz PHFLSYJLDODYAB-IEIRFRATSA-N 1 1 433.535 3.254 20 0 IGADMO CCc1nc(Cl)nc(Cl)c1N1CC[C@@H]2[C@H](C[C@@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164745476 720858638 /nfs/dbraw/zinc/85/86/38/720858638.db2.gz DSUBWGSGUUOZPV-HLLBOEOZSA-N 1 1 436.391 3.317 20 0 IGADMO CC[C@H](C)c1nc2[nH]ccc2c(N2CC[C@@H]3[C@H](C[C@H](Cn4cncn4)[N@H+]3CC3CC3)C2)n1 ZINC001164754079 720861819 /nfs/dbraw/zinc/86/18/19/720861819.db2.gz ZYCUOJGJLWIPCI-HKJQZYRSSA-N 1 1 434.592 3.442 20 0 IGADMO CC[C@H](C)c1nc2[nH]ccc2c(N2CC[C@@H]3[C@@H](C[C@@H](Cn4cncn4)[N@H+]3CC3CC3)C2)n1 ZINC001164754081 720861903 /nfs/dbraw/zinc/86/19/03/720861903.db2.gz ZYCUOJGJLWIPCI-MCNSAMFCSA-N 1 1 434.592 3.442 20 0 IGADMO c1cc2c(nc(C3CCC3)nc2N2CC[C@H]3[C@@H](C[C@@H](Cn4cncn4)[N@@H+]3CC3CC3)C2)[nH]1 ZINC001164745296 720862057 /nfs/dbraw/zinc/86/20/57/720862057.db2.gz CSYQTVURMQHIJN-ZJOUEHCJSA-N 1 1 432.576 3.196 20 0 IGADMO COCC[N@H+]1CCO[C@@H]2CN(c3cc(Oc4ccc(SC)cc4)ncn3)CC[C@@H]2C1 ZINC001164862132 720869311 /nfs/dbraw/zinc/86/93/11/720869311.db2.gz ZCVUTNMAZBQOOS-YLJYHZDGSA-N 1 1 430.574 3.164 20 0 IGADMO COC(=O)c1ccnc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COCc2cccnc2)c1 ZINC001164749671 720871184 /nfs/dbraw/zinc/87/11/84/720871184.db2.gz HQAYJUPRLHEFNU-RDGATRHJSA-N 1 1 436.556 3.018 20 0 IGADMO c1cncc(COC[C@H]2C[N@@H+](CC3CC3)C[C@@]23CCN(c2ncnc4cccnc42)C3)c1 ZINC001164749033 720876282 /nfs/dbraw/zinc/87/62/82/720876282.db2.gz GHRQNWYHMDCNMQ-PXDATVDWSA-N 1 1 430.556 3.175 20 0 IGADMO COCC[N@H+]1CCO[C@@H]2CN(c3nc(C(F)F)nc4ccc(Cl)cc43)CC[C@@H]2C1 ZINC001164860815 720885876 /nfs/dbraw/zinc/88/58/76/720885876.db2.gz PEOORESARNYKGB-CXAGYDPISA-N 1 1 426.895 3.394 20 0 IGADMO COCC[N@H+]1CCO[C@H]2CN(c3cnc(Cl)nc3Oc3ccccc3C)CC[C@@H]2C1 ZINC001164858559 720888773 /nfs/dbraw/zinc/88/87/73/720888773.db2.gz LDKDBZLIAZRBQC-XLIONFOSSA-N 1 1 432.952 3.404 20 0 IGADMO Nc1cnc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COCc2cccnc2)c(Cl)c1 ZINC001164758494 720890925 /nfs/dbraw/zinc/89/09/25/720890925.db2.gz YOXBTPZHJRUZLC-XXBNENTESA-N 1 1 427.980 3.467 20 0 IGADMO CC(C)Oc1cncc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COCc2cccnc2)n1 ZINC001164752808 720913770 /nfs/dbraw/zinc/91/37/70/720913770.db2.gz OZKYYUCDCWJDRZ-DHLKQENFSA-N 1 1 437.588 3.414 20 0 IGADMO CSc1cncc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COCc2cccnc2)n1 ZINC001164755260 720923035 /nfs/dbraw/zinc/92/30/35/720923035.db2.gz ZZRIVSOUMQTPHB-OFNKIYASSA-N 1 1 425.602 3.349 20 0 IGADMO CC(C)[N@@H+](C)Cc1cnc2n1CCN(C(F)(F)c1nc(Cl)cc(N(C)C)n1)[C@H]2C ZINC001164859231 720935162 /nfs/dbraw/zinc/93/51/62/720935162.db2.gz LOJKTRGEADYQBV-ZDUSSCGKSA-N 1 1 427.931 3.359 20 0 IGADMO FC(F)(c1nc2ccsc2c(Cl)n1)N1CCc2[nH+]cc(Cn3cccn3)n2CC1 ZINC001164861093 721031765 /nfs/dbraw/zinc/03/17/65/721031765.db2.gz BCCUXCUBTPEDJL-UHFFFAOYSA-N 1 1 435.891 3.394 20 0 IGADMO FC(F)(c1nc(Cl)c2ccccc2n1)N1CCc2[nH+]cc(Cn3cccn3)n2CC1 ZINC001164862766 721031776 /nfs/dbraw/zinc/03/17/76/721031776.db2.gz PWZGCHHNZXFOJE-UHFFFAOYSA-N 1 1 429.862 3.332 20 0 IGADMO FC(F)(c1nc2ccccc2nc1Cl)N1CCc2[nH+]cc(Cn3cccn3)n2CC1 ZINC001164861998 721032396 /nfs/dbraw/zinc/03/23/96/721032396.db2.gz JLIMBOPZTJDCPU-UHFFFAOYSA-N 1 1 429.862 3.332 20 0 IGADMO FC(F)(Oc1cc(Cl)nc(Cl)c1)N1CCc2[nH+]cc(Cn3cccn3)n2CC1 ZINC001164861562 721034041 /nfs/dbraw/zinc/03/40/41/721034041.db2.gz IRAPJVMWDUXEPW-UHFFFAOYSA-N 1 1 429.258 3.317 20 0 IGADMO Clc1ccc(OC(Cl)(Cl)N2CCc3[nH+]cc(Cn4cccn4)n3CC2)cn1 ZINC001164861092 721034616 /nfs/dbraw/zinc/03/46/16/721034616.db2.gz AZQFKYLUGMFDFN-UHFFFAOYSA-N 1 1 427.723 3.202 20 0 IGADMO CSc1nc(Cl)cc(C(F)(F)N2CC[N@H+]3C[C@H](OCc4cccnc4)C[C@H]3C2)n1 ZINC001164866593 721051233 /nfs/dbraw/zinc/05/12/33/721051233.db2.gz FSYAPHDINUKXQX-LSDHHAIUSA-N 1 1 441.935 3.272 20 0 IGADMO CSc1nc(Cl)cc(C(F)(F)N2CC[N@H+]3C[C@@H](OCc4cccnc4)C[C@H]3C2)n1 ZINC001164866591 721052220 /nfs/dbraw/zinc/05/22/20/721052220.db2.gz FSYAPHDINUKXQX-GJZGRUSLSA-N 1 1 441.935 3.272 20 0 IGADMO COCc1cc(N2CC[N@H+]3C[C@H](OCc4cccnc4)C[C@H]3C2)nc(-c2ccccc2)n1 ZINC001164865858 721052264 /nfs/dbraw/zinc/05/22/64/721052264.db2.gz APVCQYMHTWBYLB-XZOQPEGZSA-N 1 1 431.540 3.165 20 0 IGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2C[C@H](NC(=O)c3cccn3C)[C@@H]3OCCC[C@H]32)nc1 ZINC001164761028 721067028 /nfs/dbraw/zinc/06/70/28/721067028.db2.gz AKSJABBMDVVUAJ-BLRYILKCSA-N 1 1 437.588 3.133 20 0 IGADMO c1cncc(CO[C@@H]2C[C@@H]3CN(c4nccnc4C4SCCCS4)CC[N@H+]3C2)c1 ZINC001164868216 721071236 /nfs/dbraw/zinc/07/12/36/721071236.db2.gz NQSXLJHQJUYLRQ-QZTJIDSGSA-N 1 1 429.615 3.220 20 0 IGADMO CCOC(=O)c1cc(Cl)nc(N2CC[N@H+]3C[C@H](OCc4cccnc4)C[C@@H]3C2)c1C ZINC001164867713 721086805 /nfs/dbraw/zinc/08/68/05/721086805.db2.gz ZSQNPRNJSJNGCQ-QZTJIDSGSA-N 1 1 430.936 3.095 20 0 IGADMO CCOc1cc2ncnc(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@H]4C3)c2cc1OCC ZINC001164866934 721090212 /nfs/dbraw/zinc/09/02/12/721090212.db2.gz VGVTYOGEGONCKS-PMACEKPBSA-N 1 1 449.555 3.302 20 0 IGADMO O=C(Nc1ccccc1)c1ccnc(N2CC[N@H+]3C[C@@H](OCc4cccnc4)C[C@H]3C2)c1 ZINC001164865029 721093691 /nfs/dbraw/zinc/09/36/91/721093691.db2.gz IBYCSXMKJWDQMV-GOTSBHOMSA-N 1 1 429.524 3.209 20 0 IGADMO c1cn(Cc2ccccc2)c2ncnc(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@@H]4C3)c12 ZINC001164866332 721098723 /nfs/dbraw/zinc/09/87/23/721098723.db2.gz SFLQFUXTWBGADR-PKTZIBPZSA-N 1 1 440.551 3.354 20 0 IGADMO CC(C)(C)OC(=O)Nc1ccc(N2CC[N@H+]3C[C@@H](OCc4cccnc4)C[C@H]3C2)nc1 ZINC001164873604 721135404 /nfs/dbraw/zinc/13/54/04/721135404.db2.gz IYVINUVDWGGSQR-PMACEKPBSA-N 1 1 425.533 3.303 20 0 IGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4ncnc5c4ccn5Cc4cccc(F)c4)C[C@@H]3C2)cn1 ZINC001164762688 721144914 /nfs/dbraw/zinc/14/49/14/721144914.db2.gz DECTXKAMWMSLSX-SFTDATJTSA-N 1 1 445.546 3.311 20 0 IGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4ncnc5c4ccn5Cc4ccc(F)cc4)C[C@@H]3C2)cn1 ZINC001164763412 721146051 /nfs/dbraw/zinc/14/60/51/721146051.db2.gz FORHUWCEGOCSSD-RTWAWAEBSA-N 1 1 445.546 3.311 20 0 IGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4ncnc5c4ccn5Cc4ccc(F)cc4)C[C@H]3C2)cn1 ZINC001164763410 721146563 /nfs/dbraw/zinc/14/65/63/721146563.db2.gz FORHUWCEGOCSSD-NHCUHLMSSA-N 1 1 445.546 3.311 20 0 IGADMO COc1ccc(-c2ccc(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@H]4C3)nn2)c(OC)c1 ZINC001164879106 721163392 /nfs/dbraw/zinc/16/33/92/721163392.db2.gz RTSRKVBWWNGCIH-FPOVZHCZSA-N 1 1 447.539 3.036 20 0 IGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(C(F)(F)Oc4ccc5c(Cl)ncnc5c4)C[C@H]3C2)cn1 ZINC001164774430 721174162 /nfs/dbraw/zinc/17/41/62/721174162.db2.gz ZCJIVRWNSSCUKQ-JKSUJKDBSA-N 1 1 448.905 3.400 20 0 IGADMO Cc1cc(N2CC[N@H+]3C[C@H](OCc4cccnc4)C[C@@H]3C2)nc(-c2ccc(Cl)nc2)n1 ZINC001164877048 721174553 /nfs/dbraw/zinc/17/45/53/721174553.db2.gz OFWUGEKPKRWVMH-WOJBJXKFSA-N 1 1 436.947 3.375 20 0 IGADMO Cc1cc(N2CC[N@H+]3C[C@@H](OCc4cccnc4)C[C@H]3C2)nc(-c2ccc(Cl)nc2)n1 ZINC001164877045 721174769 /nfs/dbraw/zinc/17/47/69/721174769.db2.gz OFWUGEKPKRWVMH-PMACEKPBSA-N 1 1 436.947 3.375 20 0 IGADMO COc1ccc(Oc2cc(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@@H]4C3)nc(C)n2)cc1 ZINC001164873572 721175230 /nfs/dbraw/zinc/17/52/30/721175230.db2.gz IQXCCFYJYOWXGA-NFBKMPQASA-N 1 1 447.539 3.461 20 0 IGADMO Cc1ccc(-c2nc3c(ncnc3N3C[C@@H]4C[N@@H+](Cc5cnn(C)c5)CC[C@@H]4C3)o2)cc1 ZINC001164771843 721205310 /nfs/dbraw/zinc/20/53/10/721205310.db2.gz REJLZNOWLDLNMZ-UXHICEINSA-N 1 1 429.528 3.285 20 0 IGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4ccc(C(=O)OCc5ccccc5)cn4)C[C@@H]3C2)cn1 ZINC001164762534 721212008 /nfs/dbraw/zinc/21/20/08/721212008.db2.gz CRYWEGVCCFVROO-GOTSBHOMSA-N 1 1 431.540 3.130 20 0 IGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4nc(-c5ccncc5)nc5sccc54)C[C@H]3C2)cn1 ZINC001164759474 721229006 /nfs/dbraw/zinc/22/90/06/721229006.db2.gz AMYJORRNUAPNIJ-RBUKOAKNSA-N 1 1 431.569 3.445 20 0 IGADMO CN(C)C(=O)C[N@H+]1CCOCC2(CCN(c3ccc4c(Cl)ccc(F)c4n3)CC2)C1 ZINC001164877699 721291010 /nfs/dbraw/zinc/29/10/10/721291010.db2.gz OCIFPYWCZKRWGZ-UHFFFAOYSA-N 1 1 434.943 3.034 20 0 IGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@]2(CCCN(c3ncc(C)c(N4CCCC4)n3)C2)C1 ZINC001164776997 721330862 /nfs/dbraw/zinc/33/08/62/721330862.db2.gz JQPILVMYJJKHKS-XMMPIXPASA-N 1 1 440.592 3.109 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@]2(CCCN(c3ncc(C)c(N4CCCC4)n3)C2)C1 ZINC001164776997 721330864 /nfs/dbraw/zinc/33/08/64/721330864.db2.gz JQPILVMYJJKHKS-XMMPIXPASA-N 1 1 440.592 3.109 20 0 IGADMO COC(=O)c1cc(Cl)nc(N2CCC[C@]3(C2)COCC[N@H+](Cc2c(C)noc2C)C3)c1 ZINC001164777036 721335316 /nfs/dbraw/zinc/33/53/16/721335316.db2.gz KOIKJTJPXKRESN-QFIPXVFZSA-N 1 1 448.951 3.245 20 0 IGADMO COC(=O)c1cc(Cl)nc(N2CCC[C@]3(C2)COCC[N@@H+](Cc2c(C)noc2C)C3)c1 ZINC001164777036 721335321 /nfs/dbraw/zinc/33/53/21/721335321.db2.gz KOIKJTJPXKRESN-QFIPXVFZSA-N 1 1 448.951 3.245 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@]2(CCCN(c3ncc4ncn(C(C)C)c4n3)C2)C1 ZINC001164780723 721366913 /nfs/dbraw/zinc/36/69/13/721366913.db2.gz GVJMGAXJBYCQFU-HSZRJFAPSA-N 1 1 439.564 3.131 20 0 IGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@]2(CCCN(c3ncc4ncn(C(C)C)c4n3)C2)C1 ZINC001164780723 721366915 /nfs/dbraw/zinc/36/69/15/721366915.db2.gz GVJMGAXJBYCQFU-HSZRJFAPSA-N 1 1 439.564 3.131 20 0 IGADMO C[NH+]1CCN(C[C@H]2CCC[C@]3(CCN(c4nc(Cl)nc5[nH]cc(Cl)c54)C3)O2)CC1 ZINC001164884991 721381932 /nfs/dbraw/zinc/38/19/32/721381932.db2.gz BLDFVBCHNDQGJV-JLTOFOAXSA-N 1 1 439.391 3.030 20 0 IGADMO Cc1cc2c(nc(Cl)nc2N2CC[C@]3(C2)CCC[C@@H](CN2CC[NH+](C)CC2)O3)s1 ZINC001164886110 721400357 /nfs/dbraw/zinc/40/03/57/721400357.db2.gz HUPLYWYCJBNIDY-KKSFZXQISA-N 1 1 436.025 3.419 20 0 IGADMO C[NH+]1CCN(C[C@@H]2CCC[C@@]3(CCN(C(F)(F)c4nc(Cl)ccc4F)C3)O2)CC1 ZINC001164885145 721409381 /nfs/dbraw/zinc/40/93/81/721409381.db2.gz FWUPUDRSKKNCDY-KXBFYZLASA-N 1 1 432.918 3.184 20 0 IGADMO Cc1sc2nc(C)nc(N3CC[C@]4(C3)CCC[C@H](CN3CC[NH+](C)CC3)O4)c2c1C ZINC001164891927 721409789 /nfs/dbraw/zinc/40/97/89/721409789.db2.gz WQWHNHSLVBINLO-XXBNENTESA-N 1 1 429.634 3.382 20 0 IGADMO CCOC(=O)c1c(Cl)nc(SC)nc1N1C[C@@H]2C[N@@H+](Cc3nccs3)C[C@@H]2C1 ZINC001164784672 721409938 /nfs/dbraw/zinc/40/99/38/721409938.db2.gz KYBQFHGZMVIDDL-TXEJJXNPSA-N 1 1 439.994 3.053 20 0 IGADMO CCOC(=O)c1c(Cl)nc(SC)nc1N1C[C@@H]2C[N@H+](Cc3nccs3)C[C@@H]2C1 ZINC001164784672 721409940 /nfs/dbraw/zinc/40/99/40/721409940.db2.gz KYBQFHGZMVIDDL-TXEJJXNPSA-N 1 1 439.994 3.053 20 0 IGADMO Cc1ccc2c(c1)nc(Cl)nc2N1CC[C@]2(C1)CCC[C@H](CN1CC[NH+](C)CC1)O2 ZINC001164885211 721412518 /nfs/dbraw/zinc/41/25/18/721412518.db2.gz GGJDVIQXUDTYFW-JPYJTQIMSA-N 1 1 429.996 3.357 20 0 IGADMO COc1cccc2nc(Cl)nc(N3CC[C@@]4(C3)CCC[C@H](CN3CC[NH+](C)CC3)O4)c21 ZINC001164891939 721417539 /nfs/dbraw/zinc/41/75/39/721417539.db2.gz WTHUHPRRRFSOQN-UZUQRXQVSA-N 1 1 445.995 3.057 20 0 IGADMO CC(C)(C)OC(=O)Nc1cnc(N2C[C@H]3C[NH+](Cc4nccs4)C[C@@H]3C2)c2[nH]cnc21 ZINC001164784818 721423564 /nfs/dbraw/zinc/42/35/64/721423564.db2.gz MNFOJEHOQVGIFE-ZIAGYGMSSA-N 1 1 441.561 3.330 20 0 IGADMO C[NH+]1CCN(C[C@H]2CCC[C@]3(CCN(c4ncc5c(n4)-c4ccccc4CC5)C3)O2)CC1 ZINC001164895376 721427805 /nfs/dbraw/zinc/42/78/05/721427805.db2.gz OCSXWBGXRZTSCG-ATIYNZHBSA-N 1 1 433.600 3.008 20 0 IGADMO c1csc(C[N@H+]2C[C@H]3CN(c4ccc(-c5ccc6c(c5)OCCCO6)nn4)C[C@H]3C2)n1 ZINC001164787293 721430748 /nfs/dbraw/zinc/43/07/48/721430748.db2.gz PUDWKNRXZXSOCC-HDICACEKSA-N 1 1 435.553 3.330 20 0 IGADMO c1csc(C[N@@H+]2C[C@H]3CN(c4ccc(-c5ccc6c(c5)OCCCO6)nn4)C[C@H]3C2)n1 ZINC001164787293 721430750 /nfs/dbraw/zinc/43/07/50/721430750.db2.gz PUDWKNRXZXSOCC-HDICACEKSA-N 1 1 435.553 3.330 20 0 IGADMO O=C(Nc1ccc(Cl)nc1)OCC(F)(F)N1C[C@@H]2C[NH+](Cc3nccs3)C[C@H]2C1 ZINC001164790306 721437967 /nfs/dbraw/zinc/43/79/67/721437967.db2.gz XMSZZKUKRWAPIH-STQMWFEESA-N 1 1 443.907 3.397 20 0 IGADMO Cc1cc(N2CC[C@@]3(C2)CCC[C@@H](CN2CC[NH+](C)CC2)O3)nc(-c2cccs2)n1 ZINC001164899512 721440463 /nfs/dbraw/zinc/44/04/63/721440463.db2.gz YSNJLXWGWJSVJX-WMZHIEFXSA-N 1 1 427.618 3.279 20 0 IGADMO C[NH+]1CCN(C[C@@H]2CCC[C@]3(CCN(c4ccc(-c5ccccc5F)nn4)C3)O2)CC1 ZINC001164899179 721441083 /nfs/dbraw/zinc/44/10/83/721441083.db2.gz YBNFJRGPEXNXAW-YADARESESA-N 1 1 425.552 3.048 20 0 IGADMO CC(C)c1noc(-c2ccnc(N3CC[C@]4(C3)CCC[C@H](CN3CC[NH+](C)CC3)O4)c2)n1 ZINC001164898394 721442572 /nfs/dbraw/zinc/44/25/72/721442572.db2.gz VXCPYZFENWBXSC-YKSBVNFPSA-N 1 1 440.592 3.020 20 0 IGADMO CC(C)c1noc(-c2ccnc(N3CC[C@@]4(C3)CCC[C@@H](CN3CC[NH+](C)CC3)O4)c2)n1 ZINC001164898385 721443036 /nfs/dbraw/zinc/44/30/36/721443036.db2.gz VXCPYZFENWBXSC-GBXCKJPGSA-N 1 1 440.592 3.020 20 0 IGADMO Cc1cc(-c2ccccc2F)nnc1N1CC[C@@]2(C1)CCC[C@H](CN1CC[NH+](C)CC1)O2 ZINC001164891318 721447657 /nfs/dbraw/zinc/44/76/57/721447657.db2.gz UILCLGJUKAKKHB-CJFMBICVSA-N 1 1 439.579 3.357 20 0 IGADMO CC[C@H](C)c1nc2[nH]ccc2c(N2CC[C@]3(C2)CCC[C@H](CN2CC[NH+](C)CC2)O3)n1 ZINC001164889705 721453090 /nfs/dbraw/zinc/45/30/90/721453090.db2.gz PLVGBYRCHBEEGS-GLDPYIMESA-N 1 1 426.609 3.237 20 0 IGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1ncnc3cccc(OC)c31)CC2 ZINC001164786452 721468103 /nfs/dbraw/zinc/46/81/03/721468103.db2.gz BHYORIPOZMEPJA-HXUWFJFHSA-N 1 1 440.588 3.372 20 0 IGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1ncnc3cccc(OC)c31)CC2 ZINC001164786445 721468171 /nfs/dbraw/zinc/46/81/71/721468171.db2.gz BHYORIPOZMEPJA-FQEVSTJZSA-N 1 1 440.588 3.372 20 0 IGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1cc3c(nn1)CC[C@H](C)C3)CC2 ZINC001164789567 721470531 /nfs/dbraw/zinc/47/05/31/721470531.db2.gz OEAXWEYXGFJMGJ-UGKGYDQZSA-N 1 1 428.621 3.335 20 0 IGADMO CN1CCc2nc(Cl)nc(N3CCC4(CC([N@@H+](C)Cc5ccncc5)C4)CC3)c2C1 ZINC001164794923 721503193 /nfs/dbraw/zinc/50/31/93/721503193.db2.gz FZHIKVWAVSAIEI-UHFFFAOYSA-N 1 1 426.996 3.394 20 0 IGADMO O=C(NCc1ccccc1)c1cccnc1N1CC[N@H+]2C[C@H](Oc3cccc(F)c3)C[C@@H]2C1 ZINC001164899974 721515355 /nfs/dbraw/zinc/51/53/55/721515355.db2.gz MWROAUDICTVMCC-FYYLOGMGSA-N 1 1 446.526 3.493 20 0 IGADMO CCOC(=O)c1c(Cl)cc(C)nc1N1C[C@H]([N@H+](C)Cc2cccnc2)[C@H]2OCCC[C@H]21 ZINC001164806077 721529484 /nfs/dbraw/zinc/52/94/84/721529484.db2.gz NROGUKUPWFDMBW-DYXWJJEUSA-N 1 1 444.963 3.483 20 0 IGADMO CCOC(=O)c1c(Cl)cc(C)nc1N1C[C@H]([N@@H+](C)Cc2cccnc2)[C@H]2OCCC[C@H]21 ZINC001164806077 721529490 /nfs/dbraw/zinc/52/94/90/721529490.db2.gz NROGUKUPWFDMBW-DYXWJJEUSA-N 1 1 444.963 3.483 20 0 IGADMO CCOC(=O)c1c(C)nc(Cl)cc1N1C[C@H]([N@@H+](C)Cc2cccnc2)[C@@H]2OCCC[C@H]21 ZINC001164809441 721543669 /nfs/dbraw/zinc/54/36/69/721543669.db2.gz UPMNUBOSRDLLCG-ZWCUEREDSA-N 1 1 444.963 3.483 20 0 IGADMO CCOC(=O)c1c(C)nc(Cl)cc1N1C[C@H]([N@@H+](C)Cc2cccnc2)[C@H]2OCCC[C@H]21 ZINC001164809438 721544029 /nfs/dbraw/zinc/54/40/29/721544029.db2.gz UPMNUBOSRDLLCG-LZNRXBQRSA-N 1 1 444.963 3.483 20 0 IGADMO CCOC(=O)c1cc(Cl)nc(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@H]3OCCC[C@@H]32)c1C ZINC001164804564 721552374 /nfs/dbraw/zinc/55/23/74/721552374.db2.gz KHFAYSKFIAGRPE-ZJOUEHCJSA-N 1 1 444.963 3.483 20 0 IGADMO CCOC(=O)c1cc2cccnc2nc1N1C[C@H]([N@H+](C)Cc2cccnc2)[C@H]2OCCC[C@H]21 ZINC001164805648 721553187 /nfs/dbraw/zinc/55/31/87/721553187.db2.gz MNIARKONSVEOHN-FSSWDIPSSA-N 1 1 447.539 3.070 20 0 IGADMO CCOC(=O)c1cc2cccnc2nc1N1C[C@H]([N@@H+](C)Cc2cccnc2)[C@H]2OCCC[C@H]21 ZINC001164805648 721553191 /nfs/dbraw/zinc/55/31/91/721553191.db2.gz MNIARKONSVEOHN-FSSWDIPSSA-N 1 1 447.539 3.070 20 0 IGADMO Fc1cccc(O[C@@H]2C[C@H]3CN(c4ccc(-c5ccc6c(c5)OCCO6)nn4)CC[N@H+]3C2)c1 ZINC001164910901 721554096 /nfs/dbraw/zinc/55/40/96/721554096.db2.gz XNFHWVRXTPIAKM-PZJWPPBQSA-N 1 1 448.498 3.396 20 0 IGADMO CCOC(=O)c1cnc(N2C[C@H]([N@H+](C)Cc3cccnc3)[C@H]3OCCC[C@@H]32)c(Cl)c1 ZINC001164800721 721557512 /nfs/dbraw/zinc/55/75/12/721557512.db2.gz FNNRGDBYMWCVKR-UFYCRDLUSA-N 1 1 430.936 3.175 20 0 IGADMO CCOC(=O)c1cnc(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@H]3OCCC[C@@H]32)c(Cl)c1 ZINC001164800721 721557516 /nfs/dbraw/zinc/55/75/16/721557516.db2.gz FNNRGDBYMWCVKR-UFYCRDLUSA-N 1 1 430.936 3.175 20 0 IGADMO Fc1cccc(O[C@@H]2C[C@H]3CN(c4ncnc5c4ncn5-c4ccccc4)CC[N@H+]3C2)c1 ZINC001164905892 721562555 /nfs/dbraw/zinc/56/25/55/721562555.db2.gz HUGQULFEPAYMFU-PZJWPPBQSA-N 1 1 430.487 3.297 20 0 IGADMO COC(=O)/C=C/c1cc2cc[nH]c2c(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@@H]32)n1 ZINC001164806691 721570615 /nfs/dbraw/zinc/57/06/15/721570615.db2.gz QUGQYZXJYKDGJY-IOBPRNIASA-N 1 1 447.539 3.012 20 0 IGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(C(F)(F)c2c3c(nnc2Cl)CCC3)[C@@H]2CCCO[C@H]12 ZINC001164807645 721580201 /nfs/dbraw/zinc/58/02/01/721580201.db2.gz PBSUMZRQPUKOEA-GGPKGHCWSA-N 1 1 449.933 3.427 20 0 IGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(C(F)(F)c2c3c(nnc2Cl)CCC3)[C@@H]2CCCO[C@H]12 ZINC001164807645 721580204 /nfs/dbraw/zinc/58/02/04/721580204.db2.gz PBSUMZRQPUKOEA-GGPKGHCWSA-N 1 1 449.933 3.427 20 0 IGADMO Cc1nc(C)c(-c2ccc(N3C[C@H]([N@H+](C)Cc4cccnc4)[C@@H]4OCCC[C@H]43)nn2)s1 ZINC001164806239 721586792 /nfs/dbraw/zinc/58/67/92/721586792.db2.gz MOQSKMLTHRNYLR-RZUBCFFCSA-N 1 1 436.585 3.480 20 0 IGADMO Cc1nc(C)c(-c2ccc(N3C[C@H]([N@@H+](C)Cc4cccnc4)[C@@H]4OCCC[C@H]43)nn2)s1 ZINC001164806239 721586794 /nfs/dbraw/zinc/58/67/94/721586794.db2.gz MOQSKMLTHRNYLR-RZUBCFFCSA-N 1 1 436.585 3.480 20 0 IGADMO CCOC(=O)Cc1cccnc1N1CCC(F)(F)[C@@]2(CC[N@@H+](Cc3ccccn3)C2)C1 ZINC001164904959 721587516 /nfs/dbraw/zinc/58/75/16/721587516.db2.gz IJQIANFJXPPRMU-JOCHJYFZSA-N 1 1 430.499 3.320 20 0 IGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2nc(Cl)cc(-c3ccncc3)n2)[C@H]2CCCO[C@@H]12 ZINC001164802588 721589296 /nfs/dbraw/zinc/58/92/96/721589296.db2.gz GXMYOWHKODPVCN-TUNNFDKTSA-N 1 1 436.947 3.455 20 0 IGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2nc(Cl)cc(-c3ccncc3)n2)[C@H]2CCCO[C@@H]12 ZINC001164802588 721589299 /nfs/dbraw/zinc/58/92/99/721589299.db2.gz GXMYOWHKODPVCN-TUNNFDKTSA-N 1 1 436.947 3.455 20 0 IGADMO Cc1cccc(CN2CCO[C@@H]3C[N@@H+](C(C)(C)c4ccnc(Cl)c4)CC[C@@H]3C2=O)n1 ZINC001164798884 721603395 /nfs/dbraw/zinc/60/33/95/721603395.db2.gz JKRSLDXIIFLCKI-VQTJNVASSA-N 1 1 428.964 3.423 20 0 IGADMO Cc1cccc(CN2CCO[C@@H]3C[N@H+](C(C)(C)c4ccnc(Cl)c4)CC[C@@H]3C2=O)n1 ZINC001164798884 721603398 /nfs/dbraw/zinc/60/33/98/721603398.db2.gz JKRSLDXIIFLCKI-VQTJNVASSA-N 1 1 428.964 3.423 20 0 IGADMO Cc1nc(N(C)C)nc2c1COC[C@@]21CCN(c2nc(Cl)ccc2C[NH+]2CCCC2)C1 ZINC001164806909 721606257 /nfs/dbraw/zinc/60/62/57/721606257.db2.gz UDWNGFMNIZUFMV-QHCPKHFHSA-N 1 1 442.995 3.174 20 0 IGADMO CSc1nc(Cl)nc(N2CCC(F)(F)[C@]3(CC[N@@H+](Cc4ccccn4)C3)C2)n1 ZINC001164905606 721695252 /nfs/dbraw/zinc/69/52/52/721695252.db2.gz KBKQYZHSCHUORS-KRWDZBQOSA-N 1 1 426.924 3.380 20 0 IGADMO COCCn1ccc2c1ncnc2N1CCC(F)(F)[C@@]2(CC[N@@H+](Cc3ccccn3)C2)C1 ZINC001164906008 721708890 /nfs/dbraw/zinc/70/88/90/721708890.db2.gz JFRUKHUOZCCXTL-JOCHJYFZSA-N 1 1 442.514 3.210 20 0 IGADMO CCCNC(=O)c1ccc(N2CCC(F)(F)[C@]3(CC[N@@H+](Cc4ccccn4)C3)C2)nc1 ZINC001164909717 721725484 /nfs/dbraw/zinc/72/54/84/721725484.db2.gz DEBYUQMHHXACHR-QFIPXVFZSA-N 1 1 429.515 3.354 20 0 IGADMO COc1nc(N2CCC(F)(F)[C@]3(CC[N@@H+](Cc4ccccn4)C3)C2)nc2c1ccn2C ZINC001164913140 721735723 /nfs/dbraw/zinc/73/57/23/721735723.db2.gz UJCSYOJRJSARDK-NRFANRHFSA-N 1 1 428.487 3.110 20 0 IGADMO CN(C)C(=O)C[NH+]1CCC2(CCCN2C(F)(F)c2cc(Cl)nc3c2CCC3)CC1 ZINC001165012191 721750682 /nfs/dbraw/zinc/75/06/82/721750682.db2.gz BXMLZAZJHDZKFD-UHFFFAOYSA-N 1 1 426.939 3.292 20 0 IGADMO CC(C)c1ccc2ncnc(N3CCO[C@]4(C3)COCC[N@H+](Cc3cccnc3)C4)c2c1 ZINC001164914276 721794451 /nfs/dbraw/zinc/79/44/51/721794451.db2.gz LECUOOPKTQLHCM-RUZDIDTESA-N 1 1 433.556 3.256 20 0 IGADMO CC(C)c1ccc2ncnc(N3CCO[C@]4(C3)COCC[N@@H+](Cc3cccnc3)C4)c2c1 ZINC001164914276 721794454 /nfs/dbraw/zinc/79/44/54/721794454.db2.gz LECUOOPKTQLHCM-RUZDIDTESA-N 1 1 433.556 3.256 20 0 IGADMO CC(C)c1ccc2ncnc(N3CCO[C@@]4(C3)COCC[N@H+](Cc3cccnc3)C4)c2c1 ZINC001164914278 721794663 /nfs/dbraw/zinc/79/46/63/721794663.db2.gz LECUOOPKTQLHCM-VWLOTQADSA-N 1 1 433.556 3.256 20 0 IGADMO CC(C)c1ccc2ncnc(N3CCO[C@@]4(C3)COCC[N@@H+](Cc3cccnc3)C4)c2c1 ZINC001164914278 721794664 /nfs/dbraw/zinc/79/46/64/721794664.db2.gz LECUOOPKTQLHCM-VWLOTQADSA-N 1 1 433.556 3.256 20 0 IGADMO C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@@H]2CN(c3nc(Cl)c(F)c4c3C(=O)NC4)C[C@@H]21 ZINC001165025359 721815204 /nfs/dbraw/zinc/81/52/04/721815204.db2.gz MUHCCHOLYFMPBJ-XOKHGSTOSA-N 1 1 429.927 3.249 20 0 IGADMO C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@H]2CN(c3c(Cl)nc(Cl)nc3C(N)=O)C[C@H]21 ZINC001165025235 721815538 /nfs/dbraw/zinc/81/55/38/721815538.db2.gz MAYKWRQJVYOVBP-NWANDNLSSA-N 1 1 435.359 3.014 20 0 IGADMO COC(=O)CSc1cccc(N2C[C@@H]3CCC[C@H]([N@@H+](C)Cc4ccccn4)[C@H]3C2)n1 ZINC001165022585 721820730 /nfs/dbraw/zinc/82/07/30/721820730.db2.gz FZESWOOTQVUSKG-IHPCNDPISA-N 1 1 426.586 3.479 20 0 IGADMO C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@H]2CN(c3ccc(Cn4ccccc4=O)cn3)C[C@@H]21 ZINC001165019880 721825499 /nfs/dbraw/zinc/82/54/99/721825499.db2.gz CJAFJIPQLSLKJF-OEMFJLHTSA-N 1 1 429.568 3.424 20 0 IGADMO CN(c1ncccn1)[C@H]1CO[C@@]2(C1)CCCN(c1nc(Cl)ccc1C[NH+]1CCCC1)C2 ZINC001164925278 721835996 /nfs/dbraw/zinc/83/59/96/721835996.db2.gz ODZNCFRIFBIUAV-AUSIDOKSSA-N 1 1 442.995 3.385 20 0 IGADMO CN(C)CC[N@H+]1CC[C@H]2[C@@H]1CCN2c1nc(-c2cnccn2)nc2sc3c(c21)CCCC3 ZINC001164931513 721884800 /nfs/dbraw/zinc/88/48/00/721884800.db2.gz GGTKRRFLYOSJFW-OALUTQOASA-N 1 1 449.628 3.242 20 0 IGADMO C[NH+](C)CCN1CC[C@H]2[C@@H]1CCN2c1nc(-c2cnccn2)nc2sc3c(c21)CCCC3 ZINC001164931513 721884801 /nfs/dbraw/zinc/88/48/01/721884801.db2.gz GGTKRRFLYOSJFW-OALUTQOASA-N 1 1 449.628 3.242 20 0 IGADMO Cc1ccc(C[N@H+]2CCOC3(CCN(c4ccc(CN5CCOCC5)cn4)CC3)C2)cc1 ZINC001164938222 721921270 /nfs/dbraw/zinc/92/12/70/721921270.db2.gz JOVHGKUSSGUEKQ-UHFFFAOYSA-N 1 1 436.600 3.094 20 0 IGADMO CN(CC1CC[NH+](C)CC1)c1cc(NS(=O)(=O)c2ccc(Cl)nc2)ccc1F ZINC001165043428 721938158 /nfs/dbraw/zinc/93/81/58/721938158.db2.gz XHCAHEYFPYMBLO-UHFFFAOYSA-N 1 1 426.945 3.453 20 0 IGADMO O=C1NCC[N@H+](Cc2ccccc2)C12CCN(c1ncnc3sc4c(c31)CCC4)CC2 ZINC001164945128 721978360 /nfs/dbraw/zinc/97/83/60/721978360.db2.gz DCVDIDBTANJMOQ-UHFFFAOYSA-N 1 1 433.581 3.151 20 0 IGADMO O=C1NCC[N@@H+](Cc2ccccc2)C12CCN(c1ncnc3sc4c(c31)CCC4)CC2 ZINC001164945128 721978361 /nfs/dbraw/zinc/97/83/61/721978361.db2.gz DCVDIDBTANJMOQ-UHFFFAOYSA-N 1 1 433.581 3.151 20 0 IGADMO COC[C@]12COC[C@@H]1CN(c1nc(C[NH+]3CCCCC3)nc3sc4c(c31)CCC4)C2 ZINC001164951531 721994394 /nfs/dbraw/zinc/99/43/94/721994394.db2.gz MLVIOTCVFMGERF-QMHKHESXSA-N 1 1 428.602 3.265 20 0 IGADMO COC[C@@]12COC[C@H]1CN(c1nc(C[NH+]3CCCCC3)nc3sc4c(c31)CCC4)C2 ZINC001164951530 721994679 /nfs/dbraw/zinc/99/46/79/721994679.db2.gz MLVIOTCVFMGERF-MWTRTKDXSA-N 1 1 428.602 3.265 20 0 IGADMO O=C(c1cccnc1N1CCC2(CC1)COCC[N@@H+](Cc1ccncc1)C2)N1CCCCC1 ZINC001164960533 722053150 /nfs/dbraw/zinc/05/31/50/722053150.db2.gz ROSFCUKZXQTARE-UHFFFAOYSA-N 1 1 449.599 3.222 20 0 IGADMO COC(=O)/C=C/c1cc(C)cnc1N1CCC2(CC1)COCC[N@@H+](Cc1ccncc1)C2 ZINC001164963305 722058338 /nfs/dbraw/zinc/05/83/38/722058338.db2.gz WGHOUHYLOGZEIJ-ONEGZZNKSA-N 1 1 436.556 3.090 20 0 IGADMO COCc1cc(N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)nc(-c2ccccc2)n1 ZINC001164976349 722102547 /nfs/dbraw/zinc/10/25/47/722102547.db2.gz CQJQERGSVJWJPC-LADGPHEKSA-N 1 1 445.567 3.412 20 0 IGADMO COc1cccc2c1nc(Cl)nc2N1CC[C@@H]2C[N@@H+](Cc3cccnc3)CCO[C@@H]2C1 ZINC001164972537 722116398 /nfs/dbraw/zinc/11/63/98/722116398.db2.gz FYCXZNWDCOWFQO-YLJYHZDGSA-N 1 1 439.947 3.414 20 0 IGADMO c1ccc(COc2ccnc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)n2)cc1 ZINC001164971365 722116617 /nfs/dbraw/zinc/11/66/17/722116617.db2.gz BITJKGSTIWNGHI-XZOQPEGZSA-N 1 1 431.540 3.178 20 0 IGADMO COc1ccc2nc(Cl)cc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)c2n1 ZINC001164983763 722122570 /nfs/dbraw/zinc/12/25/70/722122570.db2.gz ZZGUVYIYLKXMRF-FXAWDEMLSA-N 1 1 439.947 3.414 20 0 IGADMO Clc1ccc(CN2CCCC2)c(N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)n1 ZINC001164983730 722125378 /nfs/dbraw/zinc/12/53/78/722125378.db2.gz ZIJYEQICOVAYQT-UNMCSNQZSA-N 1 1 442.007 3.453 20 0 IGADMO COc1cccc(-c2ccnc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)n2)c1 ZINC001164985553 722130928 /nfs/dbraw/zinc/13/09/28/722130928.db2.gz ZUIOMHWRXZCVIZ-XUZZJYLKSA-N 1 1 431.540 3.275 20 0 IGADMO COc1cccc(-c2ccnc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)n2)c1 ZINC001164985550 722131025 /nfs/dbraw/zinc/13/10/25/722131025.db2.gz ZUIOMHWRXZCVIZ-QPPBQGQZSA-N 1 1 431.540 3.275 20 0 IGADMO COc1cc2cnc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)cc2cc1OC ZINC001164983283 722145889 /nfs/dbraw/zinc/14/58/89/722145889.db2.gz SXSGLYYWXCSRGD-YADARESESA-N 1 1 434.540 3.374 20 0 IGADMO Fc1ccc2c(c1)[nH]c1ncnc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)c21 ZINC001164971058 722157784 /nfs/dbraw/zinc/15/77/84/722157784.db2.gz ACBHSUXZBADJME-LAUBAEHRSA-N 1 1 432.503 3.373 20 0 IGADMO C[NH+]1CCN(c2ncnc3c2CCN(c2nc(Cl)cc4c(Cl)ccnc42)CC3)CC1 ZINC001164996226 722233319 /nfs/dbraw/zinc/23/33/19/722233319.db2.gz AEBMHVKPMHVPMV-UHFFFAOYSA-N 1 1 444.370 3.084 20 0 IGADMO O=C1NCCc2[nH]c(-c3ccnc(N4CCC[C@@H]5C[N@@H+](Cc6ccccc6)C[C@@H]54)c3)cc21 ZINC001164619929 719075673 /nfs/dbraw/zinc/07/56/73/719075673.db2.gz DCVZYTYUPBXMLZ-YKSBVNFPSA-N 1 1 427.552 3.463 20 0 IGADMO O=S(=O)(c1cccnc1N1CCC[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21)N1CCCCC1 ZINC001164628118 719103884 /nfs/dbraw/zinc/10/38/84/719103884.db2.gz MCFWMJVSEIZAET-VXKWHMMOSA-N 1 1 440.613 3.357 20 0 IGADMO CN1CCN(c2cccc(N(c3cccc(F)c3)[C@@H]3CO[C@@]4(C3)CCC[NH2+]C4)n2)CC1 ZINC001164646337 719297267 /nfs/dbraw/zinc/29/72/67/719297267.db2.gz AJTMALHGVZLCFJ-XUZZJYLKSA-N 1 1 425.552 3.022 20 0 IGADMO O=C1CCCN1[C@@H]1CN(c2ccc3c(n2)CC[N@H+](Cc2ccccc2)C3)C[C@@H]2CCCO[C@H]12 ZINC001164656903 719303232 /nfs/dbraw/zinc/30/32/32/719303232.db2.gz ZFCISXRNSWURBE-LLGBQNBKSA-N 1 1 446.595 3.246 20 0 IGADMO COC(=O)c1cnc(Cl)c(C(F)(F)N2CCc3c(C[NH+](C)C)nn(C(C)C)c3C2)c1 ZINC001164653833 719314216 /nfs/dbraw/zinc/31/42/16/719314216.db2.gz ZUZYLEYFRFOVIL-UHFFFAOYSA-N 1 1 441.910 3.468 20 0 IGADMO O=C([C@@H]1C[C@H]2OCC[C@H]2N(c2ccc3c(n2)CC[N@H+](Cc2ccccc2)C3)C1)N1CCCC1 ZINC001164679228 719537543 /nfs/dbraw/zinc/53/75/43/719537543.db2.gz VZRPZQMEOQLXMD-QLBJFCOMSA-N 1 1 446.595 3.246 20 0 IGADMO Cc1nc(C[N@H+]2CCCC23CCN(c2nc(Cl)ncc2N2CCOCC2)CC3)cs1 ZINC001164692476 719809207 /nfs/dbraw/zinc/80/92/07/719809207.db2.gz HZFMXJFPSWMKDV-UHFFFAOYSA-N 1 1 449.024 3.367 20 0 IGADMO CCC[N@H+]1CCCC[C@@H]1c1ccc(N2CC[C@H](N3CCOCC3)C[C@@]2(C)C(=O)OC)nc1 ZINC001164703843 719876631 /nfs/dbraw/zinc/87/66/31/719876631.db2.gz KYRIBCAIHAIRBQ-FBLLAGFSSA-N 1 1 444.620 3.251 20 0 IGADMO CCC[N@H+]1CCCC[C@@H]1c1ccc(N2C[C@@H]3COC[C@@H](C(=O)N4CCCCO4)[C@@H]3C2)nc1 ZINC001164704185 719924176 /nfs/dbraw/zinc/92/41/76/719924176.db2.gz OPJVANAPMRASRS-SSGKUCQKSA-N 1 1 442.604 3.271 20 0 IGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1ncccc1C(=O)NCc1ccccc1)C2 ZINC001164808456 720079975 /nfs/dbraw/zinc/07/99/75/720079975.db2.gz HKSJWVIZDICBAU-NVQXNPDNSA-N 1 1 434.584 3.196 20 0 IGADMO COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1c[nH]c3ncnc(Cl)c13)CC2 ZINC001164710651 720100640 /nfs/dbraw/zinc/10/06/40/720100640.db2.gz KLQICLUPSIGICZ-QGZVFWFLSA-N 1 1 426.952 3.465 20 0 IGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(C(F)(F)c1ccc(C(=O)OC)nc1Cl)C2 ZINC001164807484 720110228 /nfs/dbraw/zinc/11/02/28/720110228.db2.gz CNIKMTQZTCDODC-FOIQADDNSA-N 1 1 443.922 3.251 20 0 IGADMO COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1nc(C)cc(C)c1C(=O)OC)CC2 ZINC001164718578 720116014 /nfs/dbraw/zinc/11/60/14/720116014.db2.gz SPULZXJSOJIQML-NRFANRHFSA-N 1 1 438.572 3.388 20 0 IGADMO COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1nc(Cl)cc(N(C)C)n1)CC2 ZINC001164719095 720121644 /nfs/dbraw/zinc/12/16/44/720121644.db2.gz VXIQCUCRYXCSOG-SFHVURJKSA-N 1 1 430.984 3.099 20 0 IGADMO CCN(CC)C(=O)c1cc(Cl)nc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COC)c1 ZINC001164815919 720127367 /nfs/dbraw/zinc/12/73/67/720127367.db2.gz XKYXMPKCULBRIH-WMZHIEFXSA-N 1 1 435.012 3.402 20 0 IGADMO COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1ncccc1-c1nc(C)no1)CC2 ZINC001164714024 720143751 /nfs/dbraw/zinc/14/37/51/720143751.db2.gz VLIIOVPANSINKP-FQEVSTJZSA-N 1 1 434.544 3.343 20 0 IGADMO COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1cc(-c3ccncc3)ncn1)CC2 ZINC001164714110 720144332 /nfs/dbraw/zinc/14/43/32/720144332.db2.gz WGQNTCXDLNIRDZ-JOCHJYFZSA-N 1 1 430.556 3.441 20 0 IGADMO COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1ccc(-c3ccncc3)nn1)CC2 ZINC001164713894 720148325 /nfs/dbraw/zinc/14/83/25/720148325.db2.gz UDGAYIQDKIDWLX-JOCHJYFZSA-N 1 1 430.556 3.441 20 0 IGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(C(F)(F)c1cnc3c(Cl)ncnc3c1)C2 ZINC001164818008 720154016 /nfs/dbraw/zinc/15/40/16/720154016.db2.gz REPNNYZTXQZADO-JXFKEZNVSA-N 1 1 437.922 3.408 20 0 IGADMO CCOC(=O)c1c(C)nc(Cl)cc1N1CCCn2c(=O)cc(C[N@@H+](C)C(C)C)nc2C1 ZINC001164812684 720217957 /nfs/dbraw/zinc/21/79/57/720217957.db2.gz IEYTXOMXHHOFIN-UHFFFAOYSA-N 1 1 447.967 3.027 20 0 IGADMO COc1cc2c(cc1Cl)ncnc2N1CCCn2c(=O)cc(C[N@@H+](C)C(C)C)nc2C1 ZINC001164813566 720224223 /nfs/dbraw/zinc/22/42/23/720224223.db2.gz PKIYBWJHOMUHLJ-UHFFFAOYSA-N 1 1 442.951 3.099 20 0 IGADMO CC(C)[N@@H+](C)Cc1cc(=O)n2c(n1)CN(c1cncc(Oc3cccc(F)c3)n1)CCC2 ZINC001164814547 720230596 /nfs/dbraw/zinc/23/05/96/720230596.db2.gz XULSISCTRKLLCK-UHFFFAOYSA-N 1 1 438.507 3.215 20 0 IGADMO CCOC(=O)c1cnc(C(F)(F)N2CC[C@@H]3[C@H]2CC[N@@H+]3Cc2cccnc2)nc1Cl ZINC001164724936 720335458 /nfs/dbraw/zinc/33/54/58/720335458.db2.gz LVFHTXSDGUFFIE-HZPDHXFCSA-N 1 1 437.878 3.100 20 0 IGADMO CCOC(=O)c1cnc(C(F)(F)N2CC[C@@H]3[C@H]2CC[N@H+]3Cc2cccnc2)nc1Cl ZINC001164724936 720335465 /nfs/dbraw/zinc/33/54/65/720335465.db2.gz LVFHTXSDGUFFIE-HZPDHXFCSA-N 1 1 437.878 3.100 20 0 IGADMO Cc1cc2nc(N3CC[C@@H]4[C@H]3CC[N@H+]4Cc3cccnc3)nc(N3CCOCC3)c2s1 ZINC001164731006 720402601 /nfs/dbraw/zinc/40/26/01/720402601.db2.gz XWNIZTIDFGFTLJ-WOJBJXKFSA-N 1 1 436.585 3.085 20 0 IGADMO CC(C)NC(=O)C[C@@H]1COC[C@@H]2CN(c3ccc4c(n3)CC[N@H+](Cc3ccccc3)C4)C[C@@H]21 ZINC001164827071 720417664 /nfs/dbraw/zinc/41/76/64/720417664.db2.gz QSQFJHKNAFEMSX-TZRRMPRUSA-N 1 1 448.611 3.253 20 0 IGADMO CCOC(=O)c1cnc(Cl)cc1N1CC[C@@H]2[C@@H](C[C@@H](Cn3cccn3)[N@H+]2C(C)C)C1 ZINC001164832395 720507310 /nfs/dbraw/zinc/50/73/10/720507310.db2.gz ANVCVBOONWODQO-JENIJYKNSA-N 1 1 431.968 3.486 20 0 IGADMO CC(C)[N@@H+]1[C@@H]2CCN(c3nc(Cl)nc4c3CSCC4)C[C@@H]2C[C@H]1Cn1cccn1 ZINC001164841757 720516833 /nfs/dbraw/zinc/51/68/33/720516833.db2.gz ZZFCNGXFBHHNAD-TXPKVOOTSA-N 1 1 433.025 3.494 20 0 IGADMO COc1cc2ncnc(N3CC[C@@H]4[C@H](C[C@@H](Cn5cccn5)[N@H+]4C(C)C)C3)c2cc1OC ZINC001164834881 720519459 /nfs/dbraw/zinc/51/94/59/720519459.db2.gz HUFMULYFRVXVLH-LVCYWYKZSA-N 1 1 436.560 3.221 20 0 IGADMO CCOC(=O)c1cc2ccnc(N3CC[C@@H]4[C@H](C[C@@H](Cn5cccn5)[N@H+]4C(C)C)C3)c2[nH]1 ZINC001164836794 720532432 /nfs/dbraw/zinc/53/24/32/720532432.db2.gz KXDUGLAXWZFBCM-SVFBPWRDSA-N 1 1 436.560 3.314 20 0 IGADMO Fc1ccc(Oc2ccc(Cl)nn2)c(N2CC[N@H+]3C[C@@H](Oc4cncnc4)C[C@@H]3C2)c1 ZINC001164743398 720760020 /nfs/dbraw/zinc/76/00/20/720760020.db2.gz PVAYLBWCAHZENS-CVEARBPZSA-N 1 1 442.882 3.193 20 0 IGADMO c1cc(-c2nc3ccccc3c(N3CC[N@@H+]4C[C@H](Oc5cncnc5)C[C@H]4C3)n2)cs1 ZINC001164745390 720766406 /nfs/dbraw/zinc/76/64/06/720766406.db2.gz VNUDMFMOJPSLMW-ZWKOTPCHSA-N 1 1 430.537 3.490 20 0 IGADMO Cc1ccc(Oc2nc(Cl)ncc2N2CC[N@H+]3C[C@@H](Oc4cncnc4)C[C@@H]3C2)cc1 ZINC001164742289 720802035 /nfs/dbraw/zinc/80/20/35/720802035.db2.gz CTKNNFCPVXSFTI-AEFFLSMTSA-N 1 1 438.919 3.363 20 0 IGADMO O=C1[C@@H]2CN(c3ccc4c(n3)CC[N@H+](Cc3ccccc3)C4)C[C@H]2CN1Cc1ccncc1 ZINC001164851979 720810494 /nfs/dbraw/zinc/81/04/94/720810494.db2.gz MEYKJBQCEPRYAJ-BJKOFHAPSA-N 1 1 439.563 3.130 20 0 IGADMO CC(C)(C)OC(=O)c1ccnc(N2CC[C@@H]3[C@@H](C[C@@H](Cn4cncn4)[N@H+]3CC3CC3)C2)c1 ZINC001164742055 720815811 /nfs/dbraw/zinc/81/58/11/720815811.db2.gz PGIIPIJCLJLPTE-PCCBWWKXSA-N 1 1 438.576 3.008 20 0 IGADMO CCC[N@H+]1CCCC[C@@H]1c1ccc(N2CC[C@@H]3O[C@H](C(=O)N4CCCO4)CC[C@H]32)nc1 ZINC001164848843 720822868 /nfs/dbraw/zinc/82/28/68/720822868.db2.gz NKVWGKLJAMYJJF-CZYKHXBRSA-N 1 1 428.577 3.309 20 0 IGADMO CSc1nc2ccsc2c(N2CC[C@@H]3[C@H](C[C@H](Cn4cncn4)[N@H+]3CC3CC3)C2)n1 ZINC001164737726 720825522 /nfs/dbraw/zinc/82/55/22/720825522.db2.gz CGZKWWYJLBKMCQ-JFIYKMOQSA-N 1 1 441.630 3.384 20 0 IGADMO Fc1cnc(Cl)cc1C(F)(F)N1CC[C@@H]2[C@H](C[C@@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164741207 720827851 /nfs/dbraw/zinc/82/78/51/720827851.db2.gz MHNHFJVQLXMZNU-RVKKMQEKSA-N 1 1 440.901 3.390 20 0 IGADMO Cc1nc2sc3c(c2c(N2CC[C@@H]4[C@@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C2)n1)CCC3 ZINC001164745771 720846723 /nfs/dbraw/zinc/84/67/23/720846723.db2.gz NHLXHSHYPCPQSO-NLWGTHIKSA-N 1 1 449.628 3.459 20 0 IGADMO COc1ccccc1-c1ccnc(N2CC[C@@H]3[C@@H](C[C@H](Cn4cncn4)[N@H+]3CC3CC3)C2)n1 ZINC001164749705 720849439 /nfs/dbraw/zinc/84/94/39/720849439.db2.gz WPWLLXBHILOBLQ-MIZPHKNDSA-N 1 1 445.571 3.123 20 0 IGADMO Fc1ccc(-c2cc(N3CC[C@@H]4[C@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)ncn2)cc1 ZINC001164745919 720850213 /nfs/dbraw/zinc/85/02/13/720850213.db2.gz OEGRYXYCTUGYGG-KJXAQDMKSA-N 1 1 433.535 3.254 20 0 IGADMO Fc1ccccc1-c1ccc(N2CC[C@@H]3[C@@H](C[C@H](Cn4cncn4)[N@H+]3CC3CC3)C2)nn1 ZINC001164752676 720852341 /nfs/dbraw/zinc/85/23/41/720852341.db2.gz UEGMMYHALFWWDG-YCRNBWNJSA-N 1 1 433.535 3.254 20 0 IGADMO CSc1ccnc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COCc2cccnc2)n1 ZINC001164750535 720876478 /nfs/dbraw/zinc/87/64/78/720876478.db2.gz JGWHZOLSGBVHAB-OFNKIYASSA-N 1 1 425.602 3.349 20 0 IGADMO COCC[N@H+]1CCO[C@H]2CN(C(F)(F)c3cccc4c(Cl)ncnc43)CC[C@H]2C1 ZINC001164864283 720879446 /nfs/dbraw/zinc/87/94/46/720879446.db2.gz VHNXSEUZWCCCIK-YOEHRIQHSA-N 1 1 426.895 3.002 20 0 IGADMO COCC[N@H+]1CCO[C@@H]2CN(c3cc(-c4nc(-c5cccs5)no4)ccn3)CC[C@H]2C1 ZINC001164859113 720883445 /nfs/dbraw/zinc/88/34/45/720883445.db2.gz LPZHQPVJBFPTND-ZWKOTPCHSA-N 1 1 441.557 3.034 20 0 IGADMO COCC[N@H+]1CCO[C@@H]2CN(c3cnc(Cl)nc3Oc3cccc(F)c3)CC[C@@H]2C1 ZINC001164858524 720888776 /nfs/dbraw/zinc/88/87/76/720888776.db2.gz KZYHCYGPVIYJFF-DNVCBOLYSA-N 1 1 436.915 3.235 20 0 IGADMO COCC[N@H+]1CCO[C@@H]2CN(c3cnc(Cl)nc3Oc3ccccc3OC)CC[C@@H]2C1 ZINC001164865030 720890259 /nfs/dbraw/zinc/89/02/59/720890259.db2.gz XZXUGOGBDFVXOK-OXQOHEQNSA-N 1 1 448.951 3.104 20 0 IGADMO Fc1cc(Cl)nnc1N1CC[C@]2(C1)C[N@@H+](CC1CC1)C[C@H]2COCc1cccnc1 ZINC001164749987 720890543 /nfs/dbraw/zinc/89/05/43/720890543.db2.gz BGPFFUGNMVIFBQ-PGRDOPGGSA-N 1 1 431.943 3.419 20 0 IGADMO Cc1noc2ncnc(N3CC[C@@]4(C3)C[N@@H+](CC3CC3)C[C@@H]4COCc3cccnc3)c12 ZINC001164749109 720926280 /nfs/dbraw/zinc/92/62/80/720926280.db2.gz HSZVOYVNZOBXBQ-YKSBVNFPSA-N 1 1 434.544 3.076 20 0 IGADMO COc1nc(C)nc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COCc2cccnc2)c1C ZINC001164750151 720931777 /nfs/dbraw/zinc/93/17/77/720931777.db2.gz JJTSCNMWIJHWQB-RCZVLFRGSA-N 1 1 437.588 3.252 20 0 IGADMO CCOC(=O)c1cnc(N2CCn3c(C[N@@H+](C)C(C)C)cnc3[C@@H]2C)cc1C(=O)OCC ZINC001164859615 721022462 /nfs/dbraw/zinc/02/24/62/721022462.db2.gz KCSUXKAZYPQNAI-INIZCTEOSA-N 1 1 443.548 3.053 20 0 IGADMO COc1ccc2nc(Cl)nc(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@H]4C3)c2c1 ZINC001164870643 721042306 /nfs/dbraw/zinc/04/23/06/721042306.db2.gz WNMZATPDQAMCCH-FUHWJXTLSA-N 1 1 425.920 3.167 20 0 IGADMO CCOc1cc2ncnc(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@@H]4C3)c2cc1OCC ZINC001164866935 721090720 /nfs/dbraw/zinc/09/07/20/721090720.db2.gz VGVTYOGEGONCKS-UXHICEINSA-N 1 1 449.555 3.302 20 0 IGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4cc(C(=O)N5CCCCC5)cc(Cl)n4)C[C@H]3C2)cn1 ZINC001164774177 721093725 /nfs/dbraw/zinc/09/37/25/721093725.db2.gz YZHZJOSSHHHONI-AZUAARDMSA-N 1 1 442.995 3.053 20 0 IGADMO CCOC(=O)c1cnc(Cl)c(N2C[C@H]3CC[N@@H+](Cc4cnn(C)c4)C[C@@H]3C2)c1Cl ZINC001164768291 721097726 /nfs/dbraw/zinc/09/77/26/721097726.db2.gz MTIQFUPMFRMEKS-HUUCEWRRSA-N 1 1 438.359 3.257 20 0 IGADMO CCOC(=O)c1cc2c(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@@H]4C3)[nH]c(C)c(C)c-2n1 ZINC001164866351 721107124 /nfs/dbraw/zinc/10/71/24/721107124.db2.gz SOGMCKSRYSZVFC-UXHICEINSA-N 1 1 449.555 3.231 20 0 IGADMO CC(C)(C)c1noc(-c2ccnc(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@@H]4C3)c2)n1 ZINC001164872055 721128763 /nfs/dbraw/zinc/12/87/63/721128763.db2.gz GEVUNCGEFFUETA-UXHICEINSA-N 1 1 434.544 3.304 20 0 IGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4ncnc5c4ccn5Cc4ccccc4)C[C@H]3C2)cn1 ZINC001164764987 721145729 /nfs/dbraw/zinc/14/57/29/721145729.db2.gz IRDOFSJKPGTMOC-FCHUYYIVSA-N 1 1 427.556 3.171 20 0 IGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4ncnc5c4ccn5Cc4ccc(F)cc4)C[C@H]3C2)cn1 ZINC001164763408 721145841 /nfs/dbraw/zinc/14/58/41/721145841.db2.gz FORHUWCEGOCSSD-LEWJYISDSA-N 1 1 445.546 3.311 20 0 IGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2CCn3cc(CNC(=O)c4cccn4C)nc3C2)nc1 ZINC001164867193 721200247 /nfs/dbraw/zinc/20/02/47/721200247.db2.gz FHGXQHHVKQMAIJ-OAQYLSRUSA-N 1 1 447.587 3.114 20 0 IGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4nc(-c5ccncc5)nc5sccc54)C[C@@H]3C2)cn1 ZINC001164759471 721229483 /nfs/dbraw/zinc/22/94/83/721229483.db2.gz AMYJORRNUAPNIJ-MOPGFXCFSA-N 1 1 431.569 3.445 20 0 IGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4ncc(C(=O)OC(C)(C)C)cc4Cl)C[C@H]3C2)cn1 ZINC001164769734 721233774 /nfs/dbraw/zinc/23/37/74/721233774.db2.gz ZLJYLFKDZIJWNC-FUHWJXTLSA-N 1 1 431.968 3.382 20 0 IGADMO CN(C)C(=O)C[N@H+]1CCOCC2(CCN(c3nc(Cl)cc4ccc(F)cc43)CC2)C1 ZINC001164869897 721268407 /nfs/dbraw/zinc/26/84/07/721268407.db2.gz SSROEKQVLJIOMX-UHFFFAOYSA-N 1 1 434.943 3.034 20 0 IGADMO CCOC(=O)c1ccc(C)c(N2CCC[C@]3(C2)COCC[N@@H+](Cc2c(C)noc2C)C3)n1 ZINC001164776982 721331219 /nfs/dbraw/zinc/33/12/19/721331219.db2.gz JGEGYKRZQYISJC-DEOSSOPVSA-N 1 1 442.560 3.291 20 0 IGADMO COC(=O)c1cc(Cl)nc(N2CCC[C@@]3(C2)COCC[N@H+](Cc2c(C)noc2C)C3)c1 ZINC001164777035 721335643 /nfs/dbraw/zinc/33/56/43/721335643.db2.gz KOIKJTJPXKRESN-JOCHJYFZSA-N 1 1 448.951 3.245 20 0 IGADMO COC(=O)c1cc(Cl)nc(N2CCC[C@@]3(C2)COCC[N@@H+](Cc2c(C)noc2C)C3)c1 ZINC001164777035 721335645 /nfs/dbraw/zinc/33/56/45/721335645.db2.gz KOIKJTJPXKRESN-JOCHJYFZSA-N 1 1 448.951 3.245 20 0 IGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@@]2(CCCN(C(F)(F)c3ccc(Cl)nn3)C2)C1 ZINC001164779354 721339625 /nfs/dbraw/zinc/33/96/25/721339625.db2.gz SJPDABIYMZCRGJ-IBGZPJMESA-N 1 1 441.910 3.399 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@@]2(CCCN(C(F)(F)c3ccc(Cl)nn3)C2)C1 ZINC001164779354 721339630 /nfs/dbraw/zinc/33/96/30/721339630.db2.gz SJPDABIYMZCRGJ-IBGZPJMESA-N 1 1 441.910 3.399 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@]2(CCCN(c3nc(Cl)nc4ncsc43)C2)C1 ZINC001164778294 721351599 /nfs/dbraw/zinc/35/15/99/721351599.db2.gz LZBHNZDNFLLVML-HXUWFJFHSA-N 1 1 448.980 3.464 20 0 IGADMO CCOCc1cnc(Cl)nc1N1CCC[C@@]2(C1)COCC[N@H+](Cc1c(C)noc1C)C2 ZINC001164782303 721362812 /nfs/dbraw/zinc/36/28/12/721362812.db2.gz MSQYVHNXWRUYTM-JOCHJYFZSA-N 1 1 449.983 3.390 20 0 IGADMO CCOCc1cnc(Cl)nc1N1CCC[C@@]2(C1)COCC[N@@H+](Cc1c(C)noc1C)C2 ZINC001164782303 721362813 /nfs/dbraw/zinc/36/28/13/721362813.db2.gz MSQYVHNXWRUYTM-JOCHJYFZSA-N 1 1 449.983 3.390 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@]2(CCCN(c3nccnc3OCC(C)C)C2)C1 ZINC001164781317 721370456 /nfs/dbraw/zinc/37/04/56/721370456.db2.gz ISJMZHWHCICSCN-HSZRJFAPSA-N 1 1 429.565 3.235 20 0 IGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@]2(CCCN(c3nccnc3OCC(C)C)C2)C1 ZINC001164781317 721370460 /nfs/dbraw/zinc/37/04/60/721370460.db2.gz ISJMZHWHCICSCN-HSZRJFAPSA-N 1 1 429.565 3.235 20 0 IGADMO C[NH+]1CCN(C[C@@H]2CCC[C@@]3(CCN(c4nc(Cl)nc5[nH]cc(Cl)c54)C3)O2)CC1 ZINC001164884994 721381807 /nfs/dbraw/zinc/38/18/07/721381807.db2.gz BLDFVBCHNDQGJV-XOBRGWDASA-N 1 1 439.391 3.030 20 0 IGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2C[C@@H](NC(=O)c3cccnc3)[C@@H]3OCCC[C@H]3C2)nc1 ZINC001164788542 721381963 /nfs/dbraw/zinc/38/19/63/721381963.db2.gz ZPFJMPHDJSXXSX-XJTUCQONSA-N 1 1 449.599 3.437 20 0 IGADMO C[NH+]1CCN(C[C@@H]2CCC[C@@]3(CCN(C(F)(F)c4ccnc(Cl)c4F)C3)O2)CC1 ZINC001164887313 721385114 /nfs/dbraw/zinc/38/51/14/721385114.db2.gz HOJPHGIPCSLOEE-KXBFYZLASA-N 1 1 432.918 3.184 20 0 IGADMO C[NH+]1CCN(C[C@H]2CCC[C@]3(CCN(c4nc(Cl)nc5c(F)cccc54)C3)O2)CC1 ZINC001164883630 721406133 /nfs/dbraw/zinc/40/61/33/721406133.db2.gz BJNPHYNGQNLNSP-OPAMFIHVSA-N 1 1 433.959 3.188 20 0 IGADMO COc1ccc(C(F)(F)N2CC[C@]3(C2)CCC[C@H](CN2CC[NH+](C)CC2)O3)c(Cl)n1 ZINC001164885777 721408474 /nfs/dbraw/zinc/40/84/74/721408474.db2.gz HHWZJEGVLBSIPI-UZLBHIALSA-N 1 1 444.954 3.054 20 0 IGADMO CCOc1cc2ncnc(N3C[C@H]4C[NH+](Cc5nccs5)C[C@@H]4C3)c2cc1OCC ZINC001164781148 721410732 /nfs/dbraw/zinc/41/07/32/721410732.db2.gz CBOLCFDGAVXYHS-HZPDHXFCSA-N 1 1 425.558 3.452 20 0 IGADMO Cc1ccc(C(F)(F)N2CC[C@]3(C2)CCC[C@H](CN2CC[NH+](C)CC2)O3)nc1Cl ZINC001164892863 721415299 /nfs/dbraw/zinc/41/52/99/721415299.db2.gz YZAQPNCUFHDTFE-XLIONFOSSA-N 1 1 428.955 3.354 20 0 IGADMO C[NH+]1CCN(C[C@H]2CCC[C@]3(CCN(c4ccc(-c5ccccc5F)nn4)C3)O2)CC1 ZINC001164899176 721441535 /nfs/dbraw/zinc/44/15/35/721441535.db2.gz YBNFJRGPEXNXAW-NTKDMRAZSA-N 1 1 425.552 3.048 20 0 IGADMO CCOC(=O)c1cc(F)cnc1N1CCC2(C[C@@H](COCC3CC3)[N@@H+](CCOC)C2)CC1 ZINC001164788692 721453098 /nfs/dbraw/zinc/45/30/98/721453098.db2.gz SQEFOIBRRHIACY-FQEVSTJZSA-N 1 1 449.567 3.131 20 0 IGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1ncnc3nc(Cl)ccc31)CC2 ZINC001164783619 721453266 /nfs/dbraw/zinc/45/32/66/721453266.db2.gz CLMCZHKDWSSFTC-GOSISDBHSA-N 1 1 445.995 3.412 20 0 IGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1nc(C)cc(C)c1C(=O)OC)CC2 ZINC001164782369 721458868 /nfs/dbraw/zinc/45/88/68/721458868.db2.gz AKSQITWPMNVFJX-NRFANRHFSA-N 1 1 445.604 3.219 20 0 IGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1nc(C)cc(C)c1C(=O)OC)CC2 ZINC001164782371 721459142 /nfs/dbraw/zinc/45/91/42/721459142.db2.gz AKSQITWPMNVFJX-OAQYLSRUSA-N 1 1 445.604 3.219 20 0 IGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(C(F)(F)c1cnnc(Cl)c1)CC2 ZINC001164784106 721459992 /nfs/dbraw/zinc/45/99/92/721459992.db2.gz GWSJNHCOIXQBNK-GOSISDBHSA-N 1 1 444.954 3.409 20 0 IGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1ncnc3cc(Cl)cnc31)CC2 ZINC001164783718 721461834 /nfs/dbraw/zinc/46/18/34/721461834.db2.gz GBRKYZOEFLSNSQ-LJQANCHMSA-N 1 1 445.995 3.412 20 0 IGADMO CCOC(=O)c1c(C)ccnc1N1CCC2(C[C@H](COCC3CC3)[N@@H+](CCOC)C2)CC1 ZINC001164787491 721463589 /nfs/dbraw/zinc/46/35/89/721463589.db2.gz RBHKJITZDZDRON-OAQYLSRUSA-N 1 1 445.604 3.301 20 0 IGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1ccc(-c3ccncc3)nn1)CC2 ZINC001164788120 721469586 /nfs/dbraw/zinc/46/95/86/721469586.db2.gz IFNCHLJCVQUQRB-JOCHJYFZSA-N 1 1 437.588 3.273 20 0 IGADMO CN(C)c1cc(Cl)nc(C(F)(F)N2CC[N@H+]3C[C@@H](Oc4cccc(F)c4)C[C@@H]3C2)n1 ZINC001164901455 721519013 /nfs/dbraw/zinc/51/90/13/721519013.db2.gz XPALCKOYFMMGOB-ZBFHGGJFSA-N 1 1 441.885 3.222 20 0 IGADMO CC(C)(C)OC(=O)Nc1cc(N2CC[N@H+]3C[C@H](Oc4cccc(F)c4)C[C@@H]3C2)ncn1 ZINC001164902062 721519338 /nfs/dbraw/zinc/51/93/38/721519338.db2.gz YWNQXCXXDKIEMB-SJLPKXTDSA-N 1 1 429.496 3.305 20 0 IGADMO CC(C)(C)OC(=O)Nc1cc(N2CC[N@H+]3C[C@@H](Oc4cccc(F)c4)C[C@H]3C2)ncn1 ZINC001164902063 721519801 /nfs/dbraw/zinc/51/98/01/721519801.db2.gz YWNQXCXXDKIEMB-WMZOPIPTSA-N 1 1 429.496 3.305 20 0 IGADMO CCOC(=O)c1cnc(N2CC[N@H+]3C[C@H](Oc4cccc(F)c4)C[C@H]3C2)cc1OCC ZINC001164911284 721531840 /nfs/dbraw/zinc/53/18/40/721531840.db2.gz VYHRSJYHRKNWLA-PKOBYXMFSA-N 1 1 429.492 3.138 20 0 IGADMO CCOC(=O)c1ccc2ncnc(N3CC[N@H+]4C[C@@H](Oc5cccc(F)c5)C[C@H]4C3)c2c1 ZINC001164912058 721533715 /nfs/dbraw/zinc/53/37/15/721533715.db2.gz YMJHTHDGYPJDGZ-ICSRJNTNSA-N 1 1 436.487 3.288 20 0 IGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2cc(NC(=O)OC(C)(C)C)ncn2)[C@@H]2CCCO[C@H]12 ZINC001164808948 721536904 /nfs/dbraw/zinc/53/69/04/721536904.db2.gz SNKKBCNVORCYRC-OPYAIIAOSA-N 1 1 440.548 3.087 20 0 IGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2cc(NC(=O)OC(C)(C)C)ncn2)[C@@H]2CCCO[C@H]12 ZINC001164808948 721536907 /nfs/dbraw/zinc/53/69/07/721536907.db2.gz SNKKBCNVORCYRC-OPYAIIAOSA-N 1 1 440.548 3.087 20 0 IGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2cncc(OCc3ccccc3)n2)[C@H]2CCCO[C@H]12 ZINC001164807829 721537545 /nfs/dbraw/zinc/53/75/45/721537545.db2.gz RMAASUDDHKJVIM-FBLLAGFSSA-N 1 1 431.540 3.319 20 0 IGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2cncc(OCc3ccccc3)n2)[C@H]2CCCO[C@H]12 ZINC001164807829 721537548 /nfs/dbraw/zinc/53/75/48/721537548.db2.gz RMAASUDDHKJVIM-FBLLAGFSSA-N 1 1 431.540 3.319 20 0 IGADMO CSc1nc2c(c(N3C[C@H]([N@@H+](C)Cc4cccnc4)[C@@H]4OCCC[C@@H]43)n1)CCCC2 ZINC001164803011 721550608 /nfs/dbraw/zinc/55/06/08/721550608.db2.gz HDZRXNUOCJGCPV-PCCBWWKXSA-N 1 1 425.602 3.341 20 0 IGADMO Cc1cc(NC(=O)c2cccnc2N2CC[N@H+]3C[C@@H](Oc4cccc(F)c4)C[C@@H]3C2)no1 ZINC001164903538 721551491 /nfs/dbraw/zinc/55/14/91/721551491.db2.gz CCMCEVFYFKYXPB-MJGOQNOKSA-N 1 1 437.475 3.111 20 0 IGADMO CCOC(=O)c1cnc(Cl)c(C)c1N1C[C@H]([N@@H+](C)Cc2cccnc2)[C@H]2OCCC[C@H]21 ZINC001164798118 721560251 /nfs/dbraw/zinc/56/02/51/721560251.db2.gz AHNRVQULRPIVRB-DYXWJJEUSA-N 1 1 444.963 3.483 20 0 IGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2cc(OCc3ccccc3)cnn2)[C@H]2CCCO[C@H]12 ZINC001164804024 721561497 /nfs/dbraw/zinc/56/14/97/721561497.db2.gz KSRVPUYIORUVGM-ARNLJNQMSA-N 1 1 431.540 3.319 20 0 IGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2cc(OCc3ccccc3)cnn2)[C@H]2CCCO[C@H]12 ZINC001164804024 721561499 /nfs/dbraw/zinc/56/14/99/721561499.db2.gz KSRVPUYIORUVGM-ARNLJNQMSA-N 1 1 431.540 3.319 20 0 IGADMO NC(=S)c1cnc(N2CC[N@H+]3C[C@@H](Oc4cccc(F)c4)C[C@@H]3C2)c2sccc21 ZINC001164907585 721567649 /nfs/dbraw/zinc/56/76/49/721567649.db2.gz OSBUIESZPXKNND-ZBFHGGJFSA-N 1 1 428.558 3.412 20 0 IGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2cnc(OCc3ccccc3)cn2)[C@H]2CCCO[C@@H]12 ZINC001164805637 721569794 /nfs/dbraw/zinc/56/97/94/721569794.db2.gz OGEPOMVLUUYTOD-SGIRGMQISA-N 1 1 431.540 3.319 20 0 IGADMO COC(=O)c1ccc2cc(N3C[C@H]([N@@H+](C)Cc4cccnc4)[C@H]4OCCC[C@H]43)ncc2c1 ZINC001164804702 721573568 /nfs/dbraw/zinc/57/35/68/721573568.db2.gz MHJDAKUIJICOQX-GPXNEJASSA-N 1 1 432.524 3.285 20 0 IGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2ncc(C(N)=S)c3ccsc32)[C@H]2CCCO[C@@H]12 ZINC001164805095 721591410 /nfs/dbraw/zinc/59/14/10/721591410.db2.gz KQJMYIKZBJFQSI-IPMKNSEASA-N 1 1 439.610 3.194 20 0 IGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2ncc(C(N)=S)c3ccsc32)[C@H]2CCCO[C@@H]12 ZINC001164805095 721591412 /nfs/dbraw/zinc/59/14/12/721591412.db2.gz KQJMYIKZBJFQSI-IPMKNSEASA-N 1 1 439.610 3.194 20 0 IGADMO CC[N@H+]1CCCC[C@H]1c1ccc(N2CC[C@@]3(C2)COCc2c(C)nc(N(C)C)nc23)nc1 ZINC001164799763 721606659 /nfs/dbraw/zinc/60/66/59/721606659.db2.gz BPEANRDCCBIODG-SQJMNOBHSA-N 1 1 436.604 3.471 20 0 IGADMO COC(=O)c1nc(Cl)cc(N2CCC(F)(F)[C@@]3(CC[N@@H+](Cc4ccccn4)C3)C2)n1 ZINC001164912121 721730699 /nfs/dbraw/zinc/73/06/99/721730699.db2.gz LVLSGFBLXYTBDQ-LJQANCHMSA-N 1 1 437.878 3.049 20 0 IGADMO F[C@H](Oc1ccc(Cl)nn1)N1CCC(F)(F)[C@@]2(CC[N@@H+](Cc3ccccn3)C2)C1 ZINC001164910512 721738065 /nfs/dbraw/zinc/73/80/65/721738065.db2.gz FPPFHZZBKICEPP-ZWKOTPCHSA-N 1 1 427.858 3.390 20 0 IGADMO COC(=O)c1nc(Cl)cc(N2CCc3c(C[N@H+](C)Cc4ccco4)cncc3C2)n1 ZINC001164909573 721763939 /nfs/dbraw/zinc/76/39/39/721763939.db2.gz CFYBGDPFAOFFJG-UHFFFAOYSA-N 1 1 427.892 3.099 20 0 IGADMO COC(=O)c1nc(Cl)cc(N2CCc3c(C[N@@H+](C)Cc4ccco4)cncc3C2)n1 ZINC001164909573 721763941 /nfs/dbraw/zinc/76/39/41/721763941.db2.gz CFYBGDPFAOFFJG-UHFFFAOYSA-N 1 1 427.892 3.099 20 0 IGADMO C[NH+]1CCC(Oc2ccnc(N3CCC(F)(F)[C@@]4(CCN(c5cnccn5)C4)C3)c2)CC1 ZINC001164915340 721802933 /nfs/dbraw/zinc/80/29/33/721802933.db2.gz ITPXBUGQXCPYQG-QFIPXVFZSA-N 1 1 444.530 3.087 20 0 IGADMO C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@@H]2CN(c3nc(Cl)c(F)c4c3C(=O)NC4)C[C@H]21 ZINC001165025355 721815424 /nfs/dbraw/zinc/81/54/24/721815424.db2.gz MUHCCHOLYFMPBJ-KBRIMQKVSA-N 1 1 429.927 3.249 20 0 IGADMO CCOC(=O)c1nc2ccn(C)c2c(N2C[C@@H]3CCC[C@@H]([N@@H+](C)Cc4ccccn4)[C@H]3C2)n1 ZINC001165025484 721820842 /nfs/dbraw/zinc/82/08/42/721820842.db2.gz MXIQZGJZRXZBQU-HFSMHLIXSA-N 1 1 448.571 3.277 20 0 IGADMO C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@@H]2CN(c3nc(Cl)cc(O[C@@H]4CCOC4)n3)C[C@@H]21 ZINC001165025211 721831291 /nfs/dbraw/zinc/83/12/91/721831291.db2.gz MFPKKAZHAASVBV-RSPOEFSDSA-N 1 1 443.979 3.430 20 0 IGADMO CN(C)CC[N@@H+]1CC[C@@H]2[C@H]1CCN2c1cc(C(=O)Nc2ccc(Cl)nc2)ccc1F ZINC001164923098 721863509 /nfs/dbraw/zinc/86/35/09/721863509.db2.gz IBMQJKFCXNSYFF-RTBURBONSA-N 1 1 431.943 3.341 20 0 IGADMO CN(C)CC[N@H+]1CC[C@@H]2[C@H]1CCN2c1cc(C(=O)Nc2ccc(Cl)nc2)ccc1F ZINC001164923098 721863511 /nfs/dbraw/zinc/86/35/11/721863511.db2.gz IBMQJKFCXNSYFF-RTBURBONSA-N 1 1 431.943 3.341 20 0 IGADMO CCOC(=O)c1cc(Cl)nnc1N1CCC2(CC1)C[N@@H+](Cc1ccc(C)cc1)CCO2 ZINC001164939294 721923836 /nfs/dbraw/zinc/92/38/36/721923836.db2.gz GTVWCPOQXVIJIJ-UHFFFAOYSA-N 1 1 444.963 3.487 20 0 IGADMO Cc1ccc(C[N@H+]2CCOC3(CCN(c4cc(C(=O)N5CCCC5)ccn4)CC3)C2)cc1 ZINC001164940747 721928840 /nfs/dbraw/zinc/92/88/40/721928840.db2.gz ZUGAJMKYBDWDEB-UHFFFAOYSA-N 1 1 434.584 3.497 20 0 IGADMO CCOC(=O)[C@@H]1CCc2nnc(N3CCC4(CC[N@@H+](Cc5cccnc5)C4)CC3)cc2C1 ZINC001164963339 722025197 /nfs/dbraw/zinc/02/51/97/722025197.db2.gz SJLDNCYNLZWGIC-HXUWFJFHSA-N 1 1 435.572 3.032 20 0 IGADMO COC(=O)c1cc(Cl)cnc1N1CCC2(CC1)COCC[N@@H+](Cc1ccncc1)C2 ZINC001164958064 722053093 /nfs/dbraw/zinc/05/30/93/722053093.db2.gz BHQZAYLCXCSCSS-UHFFFAOYSA-N 1 1 430.936 3.036 20 0 IGADMO COc1cc2ncc(N3CCC4(CC3)COCC[N@@H+](Cc3ccncc3)C4)nc2cc1OC ZINC001164964288 722055197 /nfs/dbraw/zinc/05/51/97/722055197.db2.gz ULBRTIJQIQYLCZ-UHFFFAOYSA-N 1 1 449.555 3.161 20 0 IGADMO CCN(CC)Cc1nc2sc(C)c(C)c2c(N2C[C@@H]3C[N@H+](CC4CC4)C[C@H](C2)O3)n1 ZINC001164966929 722075729 /nfs/dbraw/zinc/07/57/29/722075729.db2.gz HHXQYMKATQIBOA-KDURUIRLSA-N 1 1 429.634 3.449 20 0 IGADMO CCOC(=O)c1cnc(Cl)cc1N1CC[C@@H]2C[N@@H+](Cc3cccnc3)CCO[C@H]2C1 ZINC001164974656 722099769 /nfs/dbraw/zinc/09/97/69/722099769.db2.gz BFJGDAKKSSMEGS-XLIONFOSSA-N 1 1 430.936 3.034 20 0 IGADMO FC(F)(c1nc(Cl)cc(Cl)n1)N1CC[C@H]2C[N@@H+](Cc3cccnc3)CCO[C@H]2C1 ZINC001164983976 722103620 /nfs/dbraw/zinc/10/36/20/722103620.db2.gz RJWUYDHBAYNCHI-GJZGRUSLSA-N 1 1 444.313 3.451 20 0 IGADMO Clc1nc(-c2ccccc2)nc(N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)n1 ZINC001164971400 722110233 /nfs/dbraw/zinc/11/02/33/722110233.db2.gz BXXCITBALYPLQX-VQTJNVASSA-N 1 1 436.947 3.314 20 0 IGADMO FC(F)(COc1ccnc(Cl)c1)N1CC[C@H]2C[N@@H+](Cc3cccnc3)CCO[C@@H]2C1 ZINC001164972564 722114766 /nfs/dbraw/zinc/11/47/66/722114766.db2.gz GBBRFJDECNXUFN-PKOBYXMFSA-N 1 1 438.906 3.325 20 0 IGADMO COc1ccc(C(F)(F)N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)c(Cl)n1 ZINC001164973890 722115942 /nfs/dbraw/zinc/11/59/42/722115942.db2.gz HVEKDBQXWGFKSO-SJLPKXTDSA-N 1 1 438.906 3.411 20 0 IGADMO c1ccc(COc2ccnc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)n2)cc1 ZINC001164971363 722116181 /nfs/dbraw/zinc/11/61/81/722116181.db2.gz BITJKGSTIWNGHI-GOTSBHOMSA-N 1 1 431.540 3.178 20 0 IGADMO COc1ccc(C(F)(F)N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)nc1Cl ZINC001164975586 722125369 /nfs/dbraw/zinc/12/53/69/722125369.db2.gz JXCZLSNJWSIGIU-FUHWJXTLSA-N 1 1 438.906 3.411 20 0 IGADMO COc1cccc(-c2ccnc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)n2)c1 ZINC001164985551 722130694 /nfs/dbraw/zinc/13/06/94/722130694.db2.gz ZUIOMHWRXZCVIZ-URXFXBBRSA-N 1 1 431.540 3.275 20 0 IGADMO FC(F)(c1cc(Cl)nc(=S)[nH]1)N1CC[C@H]2C[N@@H+](Cc3cccnc3)CCO[C@@H]2C1 ZINC001164982021 722134629 /nfs/dbraw/zinc/13/46/29/722134629.db2.gz QROAWYYNYMTUFP-LSDHHAIUSA-N 1 1 441.935 3.086 20 0 IGADMO FC(F)(c1cc(Cl)nc(=S)[nH]1)N1CC[C@@H]2C[N@@H+](Cc3cccnc3)CCO[C@@H]2C1 ZINC001164982019 722134706 /nfs/dbraw/zinc/13/47/06/722134706.db2.gz QROAWYYNYMTUFP-HUUCEWRRSA-N 1 1 441.935 3.086 20 0 IGADMO Clc1nc2c(Cl)nccc2c(N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)n1 ZINC001164979684 722137927 /nfs/dbraw/zinc/13/79/27/722137927.db2.gz LSYCPITZRFFEAF-RDJZCZTQSA-N 1 1 445.354 3.454 20 0 IGADMO c1ccc2nc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)c(N3CCCC3)nc2c1 ZINC001164980879 722138465 /nfs/dbraw/zinc/13/84/65/722138465.db2.gz NHJLCAGAAIOKED-QPPBQGQZSA-N 1 1 444.583 3.352 20 0 IGADMO COc1cccc(-c2ccc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)nn2)c1 ZINC001164983312 722141355 /nfs/dbraw/zinc/14/13/55/722141355.db2.gz TYLBEAXEHZUASK-URXFXBBRSA-N 1 1 431.540 3.275 20 0 IGADMO COc1ccccc1-c1ccc(N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)nn1 ZINC001164985085 722141584 /nfs/dbraw/zinc/14/15/84/722141584.db2.gz ZELPULJERNHFIM-HYBUGGRVSA-N 1 1 431.540 3.275 20 0 IGADMO FC(F)(c1nc2ccc(Cl)nc2[nH]1)N1CC[C@@H]2C[N@@H+](Cc3cccnc3)CCO[C@@H]2C1 ZINC001164980896 722145392 /nfs/dbraw/zinc/14/53/92/722145392.db2.gz NKHITMSFERZDRT-NVXWUHKLSA-N 1 1 448.905 3.279 20 0 IGADMO COC(=O)c1cccc2nc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)ccc21 ZINC001164977097 722149779 /nfs/dbraw/zinc/14/97/79/722149779.db2.gz ISHDQROOVMDSNJ-WMZHIEFXSA-N 1 1 432.524 3.144 20 0 IGADMO Fc1cnc(N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)nc1-c1ccsc1 ZINC001164977211 722154332 /nfs/dbraw/zinc/15/43/32/722154332.db2.gz YGACMOUUOZXGBT-YLJYHZDGSA-N 1 1 425.533 3.467 20 0 IGADMO Cc1nc(CN2CCO[C@H]3CCN(c4cc(N5CCCC5)nc(C)[nH+]4)CC[C@@H]32)cs1 ZINC001164987081 722176025 /nfs/dbraw/zinc/17/60/25/722176025.db2.gz MJJNLRKOLJBHOS-PMACEKPBSA-N 1 1 428.606 3.020 20 0 IGADMO CCOC(=O)c1nnc(SC)nc1N1CCC[C@@]2(CC[N@H+]2Cc2cccc(F)c2)C1 ZINC001164995527 722196791 /nfs/dbraw/zinc/19/67/91/722196791.db2.gz VFOOHLLJDJEBKM-OAQYLSRUSA-N 1 1 431.537 3.154 20 0 IGADMO CC(C)NC(=O)[C@@H]1C[C@@H]2OCCN(c3ccc4c(n3)CC[N@H+](Cc3ccccc3)C4)[C@H]2C1 ZINC001164994318 722214640 /nfs/dbraw/zinc/21/46/40/722214640.db2.gz ALRJLLFZQVSDIU-XWGVYQGASA-N 1 1 434.584 3.148 20 0 IGADMO CC[C@@H](C)c1nc(Cl)c(C)c(N2CCc3ncnc(N4CC[NH+](C)CC4)c3CC2)n1 ZINC001165001085 722239764 /nfs/dbraw/zinc/23/97/64/722239764.db2.gz BRJMBLIWMREPPK-OAHLLOKOSA-N 1 1 430.000 3.099 20 0 IGADMO CCC[N@H+]1CCCC[C@@H]1c1ccc(N2CCc3ncnc(N4CCN(C)CC4)c3CC2)nc1 ZINC001165002261 722239838 /nfs/dbraw/zinc/23/98/38/722239838.db2.gz SFQCVGGEILWVTQ-XMMPIXPASA-N 1 1 449.647 3.166 20 0 IGADMO Cc1cccc(CN2C(=O)COC3(CCN(c4ccc(C[N@@H+](C)C5CC5)cn4)CC3)[C@@H]2C)n1 ZINC001164428918 718951987 /nfs/dbraw/zinc/95/19/87/718951987.db2.gz MAFOKNXNXUUYJZ-FQEVSTJZSA-N 1 1 449.599 3.166 20 0 IGADMO CCOC(=O)[C@@H]1CCCN(c2ccc(N3CCC[C@@H]4C[N@@H+](Cc5ccccc5)C[C@H]43)nn2)C1 ZINC001164626723 719098038 /nfs/dbraw/zinc/09/80/38/719098038.db2.gz IPGRLGIFEHEMHD-DNVJHFABSA-N 1 1 449.599 3.357 20 0 IGADMO CCOC(=O)[C@@H]1CCCN(c2ccc(N3CCC[C@@H]4C[N@@H+](Cc5ccccc5)C[C@@H]43)nn2)C1 ZINC001164626727 719098374 /nfs/dbraw/zinc/09/83/74/719098374.db2.gz IPGRLGIFEHEMHD-ZLNRFVROSA-N 1 1 449.599 3.357 20 0 IGADMO Cc1ccc(S(=O)(=O)n2ccc3c2nc(Cl)nc3N2C[C@H](C)[N@H+](C)C[C@H]2C)cc1 ZINC001164632955 719171414 /nfs/dbraw/zinc/17/14/14/719171414.db2.gz GAIBVQVZWCFKFB-LSDHHAIUSA-N 1 1 433.965 3.159 20 0 IGADMO C[N@H+]1CCO[C@H]2CN(c3nc(CN4CCCCC4)nc4sc5c(c43)CCCC5)C[C@H]21 ZINC001164675181 719440905 /nfs/dbraw/zinc/44/09/05/719440905.db2.gz ZMXNDFCLNPVMDT-MSOLQXFVSA-N 1 1 427.618 3.075 20 0 IGADMO CNC(=O)C[N@H+]1CCCC12CCN(c1cnc(Cl)nc1Oc1ccc(OC)cc1)CC2 ZINC001164689320 719756509 /nfs/dbraw/zinc/75/65/09/719756509.db2.gz ATOXZJKWXDJLSZ-UHFFFAOYSA-N 1 1 445.951 3.112 20 0 IGADMO CC(C)(c1ccnc(Cl)c1)[N@@H+]1CC[C@@H]2C[C@H](C(=O)NCCc3ccccn3)O[C@@H]2C1 ZINC001164701402 719820666 /nfs/dbraw/zinc/82/06/66/719820666.db2.gz OVWRQDRZCNSGII-NSISKUIASA-N 1 1 428.964 3.203 20 0 IGADMO CC(C)(c1ccnc(Cl)c1)[N@H+]1CC[C@@H]2C[C@H](C(=O)NCCc3ccccn3)O[C@@H]2C1 ZINC001164701402 719820669 /nfs/dbraw/zinc/82/06/69/719820669.db2.gz OVWRQDRZCNSGII-NSISKUIASA-N 1 1 428.964 3.203 20 0 IGADMO CC[N@H+]1CCCC[C@H]1c1ccc(N2Cc3nnn(C)c3[C@@H](COCc3cccnc3)C2)nc1 ZINC001164695443 719835666 /nfs/dbraw/zinc/83/56/66/719835666.db2.gz MYOOGJXICCHQDC-GGAORHGYSA-N 1 1 447.587 3.473 20 0 IGADMO COC(=O)[C@]1(C)C[C@@H]([NH+]2CCOCC2)CCN1c1nc(Cl)nc2ccc(Cl)cc21 ZINC001164697338 719838716 /nfs/dbraw/zinc/83/87/16/719838716.db2.gz CRFJQMHNZXNNBM-XOBRGWDASA-N 1 1 439.343 3.169 20 0 IGADMO COC(=O)[C@]1(C)C[C@@H]([NH+]2CCOCC2)CCN1c1cc(Cl)nc2cc(OC)ccc21 ZINC001164702002 719853718 /nfs/dbraw/zinc/85/37/18/719853718.db2.gz MJJXWSCDKGDLOY-NYHFZMIOSA-N 1 1 433.936 3.130 20 0 IGADMO COC(=O)[C@@]1(C)C[C@@H]([NH+]2CCOCC2)CCN1c1cc(Cl)nnc1-c1ccccc1 ZINC001164701928 719854869 /nfs/dbraw/zinc/85/48/69/719854869.db2.gz MCBVIQGKWPQHGE-HTAPYJJXSA-N 1 1 430.936 3.030 20 0 IGADMO COC(=O)[C@]1(C)C[C@@H]([NH+]2CCOCC2)CCN1c1ncc(Cl)nc1-c1ccccc1 ZINC001164701676 719871889 /nfs/dbraw/zinc/87/18/89/719871889.db2.gz GQFSAZCXFCUPOL-JTSKRJEESA-N 1 1 430.936 3.030 20 0 IGADMO COC(=O)[C@]1(C)C[C@H]([NH+]2CCOCC2)CCN1c1cc(F)ccc1-c1ccc(Cl)nn1 ZINC001164699205 719872486 /nfs/dbraw/zinc/87/24/86/719872486.db2.gz AXLRKQVLCBNXOF-ZHRRBRCNSA-N 1 1 448.926 3.169 20 0 IGADMO CCC[N@H+]1CCCC[C@@H]1c1ccc(N2C[C@@H]3COC[C@@H](C(=O)N4CCCCO4)[C@H]3C2)nc1 ZINC001164704184 719924679 /nfs/dbraw/zinc/92/46/79/719924679.db2.gz OPJVANAPMRASRS-KAOXLYBCSA-N 1 1 442.604 3.271 20 0 IGADMO COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1nc(Cl)nc(SC)n1)CC2 ZINC001164718556 720107044 /nfs/dbraw/zinc/10/70/44/720107044.db2.gz SETKMMZYSFTQKG-INIZCTEOSA-N 1 1 434.997 3.149 20 0 IGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(C(F)(F)c1ccc(C(=O)OC)nc1Cl)C2 ZINC001164807486 720111306 /nfs/dbraw/zinc/11/13/06/720111306.db2.gz CNIKMTQZTCDODC-MGPUTAFESA-N 1 1 443.922 3.251 20 0 IGADMO COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1nc(C)c(F)cc1C(=O)OC)CC2 ZINC001164719079 720119084 /nfs/dbraw/zinc/11/90/84/720119084.db2.gz VLTLWPVTMSEFNC-LJQANCHMSA-N 1 1 442.535 3.218 20 0 IGADMO COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1nc(C)c(F)cc1C(=O)OC)CC2 ZINC001164719078 720119312 /nfs/dbraw/zinc/11/93/12/720119312.db2.gz VLTLWPVTMSEFNC-IBGZPJMESA-N 1 1 442.535 3.218 20 0 IGADMO COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1nccc(N3CCCCC3)n1)CC2 ZINC001164714155 720128313 /nfs/dbraw/zinc/12/83/13/720128313.db2.gz WMYBDFHKTAEMGC-JOCHJYFZSA-N 1 1 436.604 3.369 20 0 IGADMO CCOC(=O)Cc1ccnc(N2CCC3(C[C@@H](COC)[N@@H+](Cc4ccccn4)C3)CC2)c1 ZINC001164715085 720156935 /nfs/dbraw/zinc/15/69/35/720156935.db2.gz SNWPMFUZQAZCGT-QFIPXVFZSA-N 1 1 438.572 3.090 20 0 IGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1cc([C@@H](CC(=O)OC)C3CC3)ccn1)C2 ZINC001164817892 720158186 /nfs/dbraw/zinc/15/81/86/720158186.db2.gz QQYPQMRSSNGWGR-WRALFONMSA-N 1 1 427.589 3.323 20 0 IGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1ccc(-c3ccc4c(c3)OCCO4)nn1)C2 ZINC001164814435 720171612 /nfs/dbraw/zinc/17/16/12/720171612.db2.gz GLEMDDXYFKSMGN-NLFFAJNJSA-N 1 1 436.556 3.100 20 0 IGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1ccc(-c3cc(OC)ccc3OC)nn1)C2 ZINC001164814405 720182259 /nfs/dbraw/zinc/18/22/59/720182259.db2.gz GCJNQBFANUMWRC-UQBPGWFLSA-N 1 1 438.572 3.346 20 0 IGADMO CSc1nc2sccc2c(N2CCCn3c(=O)cc(C[N@@H+](C)C(C)C)nc3C2)n1 ZINC001164815171 720213385 /nfs/dbraw/zinc/21/33/85/720213385.db2.gz WRSLQJMLLNRWKJ-UHFFFAOYSA-N 1 1 430.603 3.220 20 0 IGADMO CC(C)[N@@H+](C)Cc1cc(=O)n2c(n1)CN(C(F)(F)c1cnc(Cl)c(F)c1)CCC2 ZINC001164813430 720220322 /nfs/dbraw/zinc/22/03/22/720220322.db2.gz LZHYJSUVUJFQHM-UHFFFAOYSA-N 1 1 429.874 3.226 20 0 IGADMO Cc1cc(-c2cccc(F)c2)nnc1N1CCCn2c(=O)cc(C[N@H+](C)C(C)C)nc2C1 ZINC001164816903 720244063 /nfs/dbraw/zinc/24/40/63/720244063.db2.gz NVWLNZOBMAPCRG-UHFFFAOYSA-N 1 1 436.535 3.398 20 0 IGADMO CCC[N@H+]1CCCC[C@@H]1c1ccc(N2Cc3ccnn3C[C@@H](C(=O)N3CCCC3)C2)nc1 ZINC001164820234 720268420 /nfs/dbraw/zinc/26/84/20/720268420.db2.gz VETZKWLZNMOMGH-JTHBVZDNSA-N 1 1 436.604 3.474 20 0 IGADMO CCC[N@H+]1CCCC[C@@H]1c1ccc(N2CC[C@@H]3O[C@H](COCC(=O)N(C)C)CC[C@H]32)nc1 ZINC001164727239 720324507 /nfs/dbraw/zinc/32/45/07/720324507.db2.gz RVYGVSBIMASUNU-AFXVXQJMSA-N 1 1 444.620 3.250 20 0 IGADMO Cc1noc([C@@H]2CC[C@@H]3[C@H](CCN3c3ncnc4c3CC[N@H+](Cc3ccccc3)C4)O2)n1 ZINC001164826687 720403986 /nfs/dbraw/zinc/40/39/86/720403986.db2.gz CREOTLRZVXVMSW-FSSWDIPSSA-N 1 1 432.528 3.225 20 0 IGADMO Cc1noc([C@@H]2CC[C@@H]3[C@H](CCN3c3ncnc4c3CC[N@@H+](Cc3ccccc3)C4)O2)n1 ZINC001164826687 720403989 /nfs/dbraw/zinc/40/39/89/720403989.db2.gz CREOTLRZVXVMSW-FSSWDIPSSA-N 1 1 432.528 3.225 20 0 IGADMO Cc1noc([C@@H]2CC[C@H]3[C@H](CCN3c3ncnc4c3CC[N@H+](Cc3ccccc3)C4)O2)n1 ZINC001164826684 720404256 /nfs/dbraw/zinc/40/42/56/720404256.db2.gz CREOTLRZVXVMSW-FKBYEOEOSA-N 1 1 432.528 3.225 20 0 IGADMO Cc1noc([C@@H]2CC[C@H]3[C@H](CCN3c3ncnc4c3CC[N@@H+](Cc3ccccc3)C4)O2)n1 ZINC001164826684 720404267 /nfs/dbraw/zinc/40/42/67/720404267.db2.gz CREOTLRZVXVMSW-FKBYEOEOSA-N 1 1 432.528 3.225 20 0 IGADMO CC(C)NC(=O)C[C@@H]1COC[C@@H]2CN(c3ccc4c(n3)CC[N@H+](Cc3ccccc3)C4)C[C@H]21 ZINC001164827066 720417857 /nfs/dbraw/zinc/41/78/57/720417857.db2.gz QSQFJHKNAFEMSX-SGNDLWITSA-N 1 1 448.611 3.253 20 0 IGADMO c1ccc(N2CCN(c3cc(N4CC[C@H]5[C@H]4CC[N@@H+]5Cc4cccnc4)ncn3)CC2)cc1 ZINC001164730080 720460686 /nfs/dbraw/zinc/46/06/86/720460686.db2.gz HQQCJQFGVPEYCW-BJKOFHAPSA-N 1 1 441.583 3.051 20 0 IGADMO COc1cc2ncc(N3CC[C@@H]4[C@@H](C[C@H](Cn5cccn5)[N@H+]4C(C)C)C3)nc2cc1OC ZINC001164841437 720536999 /nfs/dbraw/zinc/53/69/99/720536999.db2.gz VUBRADZCXYRKDM-WAOWUJCRSA-N 1 1 436.560 3.221 20 0 IGADMO CCOC(=O)c1nc(N2CC[C@@H]3[C@@H](C[C@H](Cn4cccn4)[N@H+]3C(C)C)C2)ccc1Cl ZINC001164837748 720582606 /nfs/dbraw/zinc/58/26/06/720582606.db2.gz JCQSMUAWKFWPAO-YQVWRLOYSA-N 1 1 431.968 3.486 20 0 IGADMO COc1nnc(Cl)cc1C(F)(F)N1CC[C@@H]2[C@H](C[C@H](Cn3cccn3)[N@H+]2C(C)C)C1 ZINC001164843179 720646275 /nfs/dbraw/zinc/64/62/75/720646275.db2.gz UORUFZSPNYGZPE-BFYDXBDKSA-N 1 1 440.926 3.258 20 0 IGADMO C[N@H+](Cc1ccccc1)[C@@H]1COC2(C1)CCN(c1nc(Cl)nc3c1CCNC3)CC2 ZINC001164840966 720671453 /nfs/dbraw/zinc/67/14/53/720671453.db2.gz OJGMGNZGFSSPQX-SFHVURJKSA-N 1 1 427.980 3.036 20 0 IGADMO C[N@@H+](Cc1ccccc1)[C@@H]1COC2(C1)CCN(c1nc(Cl)nc3c1CCNC3)CC2 ZINC001164840966 720671458 /nfs/dbraw/zinc/67/14/58/720671458.db2.gz OJGMGNZGFSSPQX-SFHVURJKSA-N 1 1 427.980 3.036 20 0 IGADMO CSc1ccc(C(F)(F)N2CC[N@@H+]3C[C@@H](Oc4cncnc4)C[C@H]3C2)nc1Cl ZINC001164739668 720713659 /nfs/dbraw/zinc/71/36/59/720713659.db2.gz OOGFNJLQSOOKGZ-STQMWFEESA-N 1 1 427.908 3.134 20 0 IGADMO CSc1ccc(C(F)(F)N2CC[N@H+]3C[C@@H](Oc4cncnc4)C[C@H]3C2)nc1Cl ZINC001164739668 720713670 /nfs/dbraw/zinc/71/36/70/720713670.db2.gz OOGFNJLQSOOKGZ-STQMWFEESA-N 1 1 427.908 3.134 20 0 IGADMO CN1CCc2nc(Cl)nc(N3CCC4(C[C@@H]([N@@H+](C)Cc5ccccc5)CO4)CC3)c2C1 ZINC001164836488 720726488 /nfs/dbraw/zinc/72/64/88/720726488.db2.gz BJTPTQJKNSMPEN-LJQANCHMSA-N 1 1 442.007 3.378 20 0 IGADMO Fc1ccc(Oc2ccc(Cl)nn2)c(N2CC[N@H+]3C[C@@H](Oc4cncnc4)C[C@H]3C2)c1 ZINC001164743400 720760061 /nfs/dbraw/zinc/76/00/61/720760061.db2.gz PVAYLBWCAHZENS-HOTGVXAUSA-N 1 1 442.882 3.193 20 0 IGADMO O=C1[C@@H]2CN(c3ccc4c(n3)CC[N@H+](Cc3ccccc3)C4)C[C@@H]2CN1Cc1ccncc1 ZINC001164851982 720810635 /nfs/dbraw/zinc/81/06/35/720810635.db2.gz MEYKJBQCEPRYAJ-DNQXCXABSA-N 1 1 439.563 3.130 20 0 IGADMO FC(F)(Oc1ccc(Cl)nc1)N1CC[C@@H]2[C@H](C[C@@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164745993 720820680 /nfs/dbraw/zinc/82/06/80/720820680.db2.gz XRFYIZRUUVCRGZ-SOLBZPMBSA-N 1 1 438.910 3.131 20 0 IGADMO FC(F)(Oc1cccc(Cl)n1)N1CC[C@@H]2[C@H](C[C@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164738786 720820992 /nfs/dbraw/zinc/82/09/92/720820992.db2.gz GNCWLIOVBBZFIV-BRWVUGGUSA-N 1 1 438.910 3.131 20 0 IGADMO Fc1ccc(Cl)nc1C(F)(F)N1CC[C@@H]2[C@H](C[C@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164737386 720827230 /nfs/dbraw/zinc/82/72/30/720827230.db2.gz ASACVSKRXLHMBE-BFYDXBDKSA-N 1 1 440.901 3.390 20 0 IGADMO CCc1c(Cl)nnc(N2CC[C@@H]3[C@H](C[C@@H](Cn4cncn4)[N@H+]3CC3CC3)C2)c1CC ZINC001164743291 720829920 /nfs/dbraw/zinc/82/99/20/720829920.db2.gz RYAOIVSEEREMPN-FUHIMQAGSA-N 1 1 430.000 3.226 20 0 IGADMO COc1cc2ccnc(N3CC[C@@H]4[C@H](C[C@H](Cn5cncn5)[N@@H+]4CC4CC4)C3)c2cc1OC ZINC001164745571 720831978 /nfs/dbraw/zinc/83/19/78/720831978.db2.gz WVNJZCOGBKSZTQ-KCZVDYSFSA-N 1 1 448.571 3.223 20 0 IGADMO COc1cc2ccnc(N3CC[C@@H]4[C@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)c2cc1OC ZINC001164745571 720831981 /nfs/dbraw/zinc/83/19/81/720831981.db2.gz WVNJZCOGBKSZTQ-KCZVDYSFSA-N 1 1 448.571 3.223 20 0 IGADMO COCC[N@H+]1CCO[C@H]2CN(C(F)(F)c3nc(Cl)c4cccc(F)c4n3)CC[C@H]2C1 ZINC001164855920 720842770 /nfs/dbraw/zinc/84/27/70/720842770.db2.gz VONYTTZUJYEEGN-BBRMVZONSA-N 1 1 444.885 3.141 20 0 IGADMO COc1ccc(-c2ccc(N3CC[C@@H]4[C@@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)nn2)cc1 ZINC001164745154 720846245 /nfs/dbraw/zinc/84/62/45/720846245.db2.gz LWFDSCZXVQFHRZ-AWRGLXIESA-N 1 1 445.571 3.123 20 0 IGADMO COc1cccc(-c2ccc(N3CC[C@@H]4[C@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)nn2)c1 ZINC001164739957 720847742 /nfs/dbraw/zinc/84/77/42/720847742.db2.gz BDAOGOJTTQTVHH-ZFGGDYGUSA-N 1 1 445.571 3.123 20 0 IGADMO Fc1cc2ncc(Cl)nc2cc1N1CC[C@@H]2[C@@H](C[C@@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164744647 720850815 /nfs/dbraw/zinc/85/08/15/720850815.db2.gz LABSMUIOUUJJRN-TWOQFEAHSA-N 1 1 441.942 3.393 20 0 IGADMO COc1cc2ccnc(N3CC[C@@H]4[C@@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)c2cc1F ZINC001164744688 720858527 /nfs/dbraw/zinc/85/85/27/720858527.db2.gz CFGHZSZCAPEJGJ-CNNODRBYSA-N 1 1 436.535 3.353 20 0 IGADMO Cc1c[nH]c2ncnc(N3CC[C@]4(C3)C[N@@H+](CC3CC3)C[C@H]4COCc3cccnc3)c12 ZINC001164753437 720868068 /nfs/dbraw/zinc/86/80/68/720868068.db2.gz PMUOJZHWFVZNOO-SQJMNOBHSA-N 1 1 432.572 3.416 20 0 IGADMO COC(=O)c1cccc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COCc2cccnc2)n1 ZINC001164754941 720872029 /nfs/dbraw/zinc/87/20/29/720872029.db2.gz UUIHVQWOKHYISX-OFVILXPXSA-N 1 1 436.556 3.018 20 0 IGADMO Fc1cc2c(cn1)ncnc2N1CC[C@@]2(C1)C[N@@H+](CC1CC1)C[C@@H]2COCc1cccnc1 ZINC001164752190 720881641 /nfs/dbraw/zinc/88/16/41/720881641.db2.gz LYZAMSAJIYDMHK-NLFFAJNJSA-N 1 1 448.546 3.314 20 0 IGADMO COCC[N@H+]1CCO[C@H]2CN(c3ncnc4cc(OCc5ccccc5)ccc43)CC[C@@H]2C1 ZINC001164863794 720888052 /nfs/dbraw/zinc/88/80/52/720888052.db2.gz UICRVPMMCTZADK-BWKNWUBXSA-N 1 1 448.567 3.382 20 0 IGADMO COCC[N@H+]1CCO[C@@H]2CN(c3cnc(Cl)nc3Oc3cccc(C)c3)CC[C@H]2C1 ZINC001164865086 720888826 /nfs/dbraw/zinc/88/88/26/720888826.db2.gz YERVUBFAMHEJGU-FXAWDEMLSA-N 1 1 432.952 3.404 20 0 IGADMO CSc1cncc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COCc2cccnc2)n1 ZINC001164755259 720923662 /nfs/dbraw/zinc/92/36/62/720923662.db2.gz ZZRIVSOUMQTPHB-NZQKXSOJSA-N 1 1 425.602 3.349 20 0 IGADMO Cc1noc2ncnc(N3CC[C@@]4(C3)C[N@@H+](CC3CC3)C[C@H]4COCc3cccnc3)c12 ZINC001164749107 720925485 /nfs/dbraw/zinc/92/54/85/720925485.db2.gz HSZVOYVNZOBXBQ-RDPSFJRHSA-N 1 1 434.544 3.076 20 0 IGADMO CCC[N@H+]1CCCC[C@@H]1c1ccc(N2CC[C@@H]3CO[C@H](CNC(=O)N(C)C)[C@@H]3C2)nc1 ZINC001164757350 721000111 /nfs/dbraw/zinc/00/01/11/721000111.db2.gz OMBPJWPRANFFRE-GXRSIYKFSA-N 1 1 429.609 3.131 20 0 IGADMO CC(C)(c1ccnc(Cl)c1)[N@H+]1CC[C@@H]2OCC[C@@H](C(=O)NCc3ccccn3)[C@H]2C1 ZINC001164760080 721023139 /nfs/dbraw/zinc/02/31/39/721023139.db2.gz NUGJHBREKKCZRS-AQNXPRMDSA-N 1 1 428.964 3.409 20 0 IGADMO COCc1cc(N2CC[N@H+]3C[C@@H](OCc4cccnc4)C[C@@H]3C2)nc(-c2ccccc2)n1 ZINC001164865857 721051330 /nfs/dbraw/zinc/05/13/30/721051330.db2.gz APVCQYMHTWBYLB-PKTZIBPZSA-N 1 1 431.540 3.165 20 0 IGADMO CCOC(=O)c1c(C)cc(Cl)nc1N1CC[N@H+]2C[C@@H](OCc3cccnc3)C[C@@H]2C1 ZINC001164871474 721072848 /nfs/dbraw/zinc/07/28/48/721072848.db2.gz YYZSWKMLQMFWGW-MSOLQXFVSA-N 1 1 430.936 3.095 20 0 IGADMO CCOC(=O)c1cnc(Cl)c(N2C[C@@H]3C[N@H+](Cc4cnn(C)c4)CC[C@@H]3C2)c1Cl ZINC001164768278 721097807 /nfs/dbraw/zinc/09/78/07/721097807.db2.gz MTIQFUPMFRMEKS-CABCVRRESA-N 1 1 438.359 3.257 20 0 IGADMO COc1cccc2nc(Cl)nc(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@@H]4C3)c21 ZINC001164866193 721098078 /nfs/dbraw/zinc/09/80/78/721098078.db2.gz RUEYRKTWXARRMP-SJORKVTESA-N 1 1 425.920 3.167 20 0 IGADMO CCN(CC)C(=O)c1cc(Cl)nc(N2CC[N@H+]3C[C@@H](OCc4cccnc4)C[C@@H]3C2)c1 ZINC001164867221 721101491 /nfs/dbraw/zinc/10/14/91/721101491.db2.gz XAZYTGVYQRQDBJ-UXHICEINSA-N 1 1 443.979 3.092 20 0 IGADMO FC(F)(c1nc2ccc(Cl)nc2[nH]1)N1CC[N@H+]2C[C@H](OCc3cccnc3)C[C@H]2C1 ZINC001164878426 721157312 /nfs/dbraw/zinc/15/73/12/721157312.db2.gz QCJYFTSZIXNVGW-LSDHHAIUSA-N 1 1 434.878 3.031 20 0 IGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(C(F)(F)c4nc(-c5ccc(Cl)nc5)no4)C[C@@H]3C2)cn1 ZINC001164764784 721229093 /nfs/dbraw/zinc/22/90/93/721229093.db2.gz QESUZVSGNXIZDQ-CVEARBPZSA-N 1 1 449.893 3.022 20 0 IGADMO CN(C)C(=O)C[N@H+]1CCOCC2(CCN(c3cc(Cl)nc4ccc(F)cc43)CC2)C1 ZINC001164869910 721268511 /nfs/dbraw/zinc/26/85/11/721268511.db2.gz UKJZMLROABEXOV-UHFFFAOYSA-N 1 1 434.943 3.034 20 0 IGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@@]2(CCCN(c3ncc(C)c(NCC4CC4)n3)C2)C1 ZINC001164778115 721330665 /nfs/dbraw/zinc/33/06/65/721330665.db2.gz UNQVHVMQXUHIJB-DEOSSOPVSA-N 1 1 440.592 3.331 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@@]2(CCCN(c3ncc(C)c(NCC4CC4)n3)C2)C1 ZINC001164778115 721330669 /nfs/dbraw/zinc/33/06/69/721330669.db2.gz UNQVHVMQXUHIJB-DEOSSOPVSA-N 1 1 440.592 3.331 20 0 IGADMO COc1cccc2cnc(N3CCC[C@]4(C3)COCC[N@H+](Cc3c(C)noc3C)C4)nc21 ZINC001164777434 721352784 /nfs/dbraw/zinc/35/27/84/721352784.db2.gz GZGGHQLZMHQLAM-DEOSSOPVSA-N 1 1 437.544 3.362 20 0 IGADMO COc1cccc2cnc(N3CCC[C@]4(C3)COCC[N@@H+](Cc3c(C)noc3C)C4)nc21 ZINC001164777434 721352786 /nfs/dbraw/zinc/35/27/86/721352786.db2.gz GZGGHQLZMHQLAM-DEOSSOPVSA-N 1 1 437.544 3.362 20 0 IGADMO O=C1C[C@@H]2[C@H](CCN2c2ncnc3c2CC[N@H+](Cc2ccccc2)C3)N1c1ccsc1 ZINC001164883204 721355865 /nfs/dbraw/zinc/35/58/65/721355865.db2.gz ODFGCKFAKNYPQX-FCHUYYIVSA-N 1 1 431.565 3.481 20 0 IGADMO O=C1C[C@@H]2[C@H](CCN2c2ncnc3c2CC[N@@H+](Cc2ccccc2)C3)N1c1ccsc1 ZINC001164883204 721355868 /nfs/dbraw/zinc/35/58/68/721355868.db2.gz ODFGCKFAKNYPQX-FCHUYYIVSA-N 1 1 431.565 3.481 20 0 IGADMO O=C1CO[C@@H]2CN(c3nc(Cl)ccc3C[NH+]3CCCC3)C[C@@H]2N1c1cccc(F)c1 ZINC001164882611 721365115 /nfs/dbraw/zinc/36/51/15/721365115.db2.gz KFWCRMBCOHATSX-RBUKOAKNSA-N 1 1 430.911 3.091 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@@]2(CCCN(c3cc4c(nn3)CC[C@@H](C)C4)C2)C1 ZINC001164785267 721372147 /nfs/dbraw/zinc/37/21/47/721372147.db2.gz SWFHLZFWWGEXAM-OSPHWJPCSA-N 1 1 425.577 3.325 20 0 IGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@@]2(CCCN(c3cc4c(nn3)CC[C@@H](C)C4)C2)C1 ZINC001164785267 721372154 /nfs/dbraw/zinc/37/21/54/721372154.db2.gz SWFHLZFWWGEXAM-OSPHWJPCSA-N 1 1 425.577 3.325 20 0 IGADMO CS(=O)(=O)N1CCCC[C@]12CCCN(c1nc(Cl)ccc1C[NH+]1CCCC1)C2 ZINC001164886712 721376074 /nfs/dbraw/zinc/37/60/74/721376074.db2.gz NIRPUDGVNFIBKB-HXUWFJFHSA-N 1 1 427.014 3.115 20 0 IGADMO CCOC(=O)c1sc2ncnc(N3C[C@@H]4C[NH+](Cc5nccs5)C[C@H]4C3)c2c1C ZINC001164787801 721388899 /nfs/dbraw/zinc/38/88/99/721388899.db2.gz XNOWTJULHXLNSJ-KBPBESRZSA-N 1 1 429.571 3.201 20 0 IGADMO Cc1ccc2nc(N3CC[C@@]4(C3)CCC[C@@H](CN3CC[NH+](C)CC3)O4)c(Cl)nc2c1 ZINC001164888934 721407066 /nfs/dbraw/zinc/40/70/66/721407066.db2.gz PPXXNKVIJOYHOZ-FDDCHVKYSA-N 1 1 429.996 3.357 20 0 IGADMO CSc1nc2ccsc2c(N2CC[C@@]3(C2)CCC[C@@H](CN2CC[NH+](C)CC2)O3)n1 ZINC001164891952 721407276 /nfs/dbraw/zinc/40/72/76/721407276.db2.gz WYHKHUKNHXAFKV-HRAATJIYSA-N 1 1 433.647 3.179 20 0 IGADMO Cc1cccc2c(Cl)nnc(N3CC[C@]4(C3)CCC[C@@H](CN3CC[NH+](C)CC3)O4)c12 ZINC001164885257 721408601 /nfs/dbraw/zinc/40/86/01/721408601.db2.gz GJDYFKSSNWKJMO-MBSDFSHPSA-N 1 1 429.996 3.357 20 0 IGADMO Cc1sc2nc(C)nc(N3CC[C@@]4(C3)CCC[C@@H](CN3CC[NH+](C)CC3)O4)c2c1C ZINC001164891926 721409425 /nfs/dbraw/zinc/40/94/25/721409425.db2.gz WQWHNHSLVBINLO-WMZHIEFXSA-N 1 1 429.634 3.382 20 0 IGADMO Clc1nc2c(ncn2[C@@H]2CCCCO2)c(N2C[C@@H]3C[N@@H+](Cc4nccs4)C[C@@H]3C2)n1 ZINC001164786257 721409600 /nfs/dbraw/zinc/40/96/00/721409600.db2.gz OQHBSMJIVNGSIF-LZWOXQAQSA-N 1 1 445.980 3.204 20 0 IGADMO Clc1nc2c(ncn2[C@@H]2CCCCO2)c(N2C[C@@H]3C[N@H+](Cc4nccs4)C[C@@H]3C2)n1 ZINC001164786257 721409602 /nfs/dbraw/zinc/40/96/02/721409602.db2.gz OQHBSMJIVNGSIF-LZWOXQAQSA-N 1 1 445.980 3.204 20 0 IGADMO CCOC(=O)c1c(Cl)nc(SC)nc1N1C[C@H]2C[NH+](Cc3nccs3)C[C@@H]2C1 ZINC001164784675 721409868 /nfs/dbraw/zinc/40/98/68/721409868.db2.gz KYBQFHGZMVIDDL-VXGBXAGGSA-N 1 1 439.994 3.053 20 0 IGADMO C[NH+]1CCN(C[C@@H]2CCC[C@@]3(CCN(C(F)(F)c4cc(Cl)ncc4F)C3)O2)CC1 ZINC001164886677 721410118 /nfs/dbraw/zinc/41/01/18/721410118.db2.gz KSMBAAUTEZJEGP-KXBFYZLASA-N 1 1 432.918 3.184 20 0 IGADMO Fc1cccc(Oc2nc(Cl)nc(N3C[C@@H]4C[N@@H+](Cc5nccs5)C[C@@H]4C3)n2)c1 ZINC001164781728 721417725 /nfs/dbraw/zinc/41/77/25/721417725.db2.gz DJUXGIBDGNGNMP-BETUJISGSA-N 1 1 432.912 3.481 20 0 IGADMO Fc1cccc(Oc2nc(Cl)nc(N3C[C@@H]4C[N@H+](Cc5nccs5)C[C@@H]4C3)n2)c1 ZINC001164781728 721417726 /nfs/dbraw/zinc/41/77/26/721417726.db2.gz DJUXGIBDGNGNMP-BETUJISGSA-N 1 1 432.912 3.481 20 0 IGADMO Cc1nc(C(F)(F)N2CC[C@@]3(C2)CCC[C@H](CN2CC[NH+](C)CC2)O3)nc(Cl)c1C ZINC001164883896 721421235 /nfs/dbraw/zinc/42/12/35/721421235.db2.gz CKGCDUDYJCLBDA-YLJYHZDGSA-N 1 1 443.970 3.057 20 0 IGADMO Cc1ccc(Cl)nc1C(F)(F)N1CC[C@]2(C1)CCC[C@@H](CN1CC[NH+](C)CC1)O2 ZINC001164886283 721421348 /nfs/dbraw/zinc/42/13/48/721421348.db2.gz IPSBFXKMQKEMMO-PXNSSMCTSA-N 1 1 428.955 3.354 20 0 IGADMO C[NH+]1CCN(C[C@H]2CCC[C@]3(CCN(c4nccc(Oc5cccc(F)c5)n4)C3)O2)CC1 ZINC001164890247 721427860 /nfs/dbraw/zinc/42/78/60/721427860.db2.gz CQVGCZNONBOMQD-ZJSXRUAMSA-N 1 1 441.551 3.173 20 0 IGADMO C[NH+]1CCN(C[C@H]2CCC[C@]3(CCN(c4cc(F)cc5ncnc(Cl)c54)C3)O2)CC1 ZINC001164892365 721428761 /nfs/dbraw/zinc/42/87/61/721428761.db2.gz IGVOPBSYAMKHRQ-VGOFRKELSA-N 1 1 433.959 3.188 20 0 IGADMO CCc1ccc(-c2ccc(N3CC[C@@]4(C3)CCC[C@@H](CN3CC[NH+](C)CC3)O4)nn2)cc1 ZINC001164894429 721440741 /nfs/dbraw/zinc/44/07/41/721440741.db2.gz MOLMXXAQOFTUHX-JYFHCDHNSA-N 1 1 435.616 3.471 20 0 IGADMO C[NH+]1CCN(C[C@@H]2CCC[C@@]3(CCN(c4ccc(-c5ccccc5F)nn4)C3)O2)CC1 ZINC001164899171 721441579 /nfs/dbraw/zinc/44/15/79/721441579.db2.gz YBNFJRGPEXNXAW-CYFREDJKSA-N 1 1 425.552 3.048 20 0 IGADMO CSc1ccc2ncnc(N3CC[C@]4(C3)CCC[C@@H](CN3CC[NH+](C)CC3)O4)c2c1 ZINC001164886525 721447009 /nfs/dbraw/zinc/44/70/09/721447009.db2.gz GYJSWKWUEBLNJP-MBSDFSHPSA-N 1 1 427.618 3.117 20 0 IGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1ccc3nc(C)n(C)c3n1)CC2 ZINC001164784012 721459986 /nfs/dbraw/zinc/45/99/86/721459986.db2.gz GQACWNMPPOOLOT-HXUWFJFHSA-N 1 1 427.593 3.011 20 0 IGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1cnc3ccc(OC)cc3n1)CC2 ZINC001164788588 721459994 /nfs/dbraw/zinc/45/99/94/721459994.db2.gz ULBQCZYSOMCUIA-HXUWFJFHSA-N 1 1 440.588 3.372 20 0 IGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1nc3ccc(Cl)nc3[nH]1)CC2 ZINC001164782721 721464119 /nfs/dbraw/zinc/46/41/19/721464119.db2.gz BDQGELDTYFOGPY-KRWDZBQOSA-N 1 1 433.984 3.345 20 0 IGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1ncccc1-c1nc(C)no1)CC2 ZINC001164790688 721467490 /nfs/dbraw/zinc/46/74/90/721467490.db2.gz UVLWJPCYLLOELH-HXUWFJFHSA-N 1 1 441.576 3.174 20 0 IGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2ncccc2C(=O)NC2CCCCC2)[C@H]2CCCO[C@H]12 ZINC001164810526 721531547 /nfs/dbraw/zinc/53/15/47/721531547.db2.gz XFHRBYOCOWWQQI-VXNXHJTFSA-N 1 1 449.599 3.407 20 0 IGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2ncccc2C(=O)NC2CCCCC2)[C@H]2CCCO[C@H]12 ZINC001164810526 721531550 /nfs/dbraw/zinc/53/15/50/721531550.db2.gz XFHRBYOCOWWQQI-VXNXHJTFSA-N 1 1 449.599 3.407 20 0 IGADMO CCOC(=O)c1nc2ccccc2c(N2C[C@H]([N@H+](C)Cc3cccnc3)[C@H]3OCCC[C@H]32)n1 ZINC001164811180 721532339 /nfs/dbraw/zinc/53/23/39/721532339.db2.gz ZFOIWVLOUPMTAQ-FSSWDIPSSA-N 1 1 447.539 3.070 20 0 IGADMO CCOC(=O)c1nc2ccccc2c(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@H]3OCCC[C@H]32)n1 ZINC001164811180 721532342 /nfs/dbraw/zinc/53/23/42/721532342.db2.gz ZFOIWVLOUPMTAQ-FSSWDIPSSA-N 1 1 447.539 3.070 20 0 IGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2nnc(Cl)cc2-c2ccncc2)[C@@H]2CCCO[C@H]21 ZINC001164807801 721535205 /nfs/dbraw/zinc/53/52/05/721535205.db2.gz RJFACWKGVZZSSE-KCZVDYSFSA-N 1 1 436.947 3.455 20 0 IGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2nnc(Cl)cc2-c2ccncc2)[C@@H]2CCCO[C@H]21 ZINC001164807801 721535208 /nfs/dbraw/zinc/53/52/08/721535208.db2.gz RJFACWKGVZZSSE-KCZVDYSFSA-N 1 1 436.947 3.455 20 0 IGADMO CCOC(=O)c1c(C)cc(Cl)nc1N1C[C@H]([N@H+](C)Cc2cccnc2)[C@H]2OCCC[C@H]21 ZINC001164801530 721543939 /nfs/dbraw/zinc/54/39/39/721543939.db2.gz FOIWUCUBPQKYHG-LQWHRVPQSA-N 1 1 444.963 3.483 20 0 IGADMO CCOC(=O)c1c(C)cc(Cl)nc1N1C[C@H]([N@@H+](C)Cc2cccnc2)[C@H]2OCCC[C@H]21 ZINC001164801530 721543946 /nfs/dbraw/zinc/54/39/46/721543946.db2.gz FOIWUCUBPQKYHG-LQWHRVPQSA-N 1 1 444.963 3.483 20 0 IGADMO COC(=O)c1cc2c(N3CC[N@H+]4C[C@@H](Oc5cccc(F)c5)C[C@@H]4C3)[nH]c(Cl)cc-2n1 ZINC001164908810 721545697 /nfs/dbraw/zinc/54/56/97/721545697.db2.gz QQRIZYUWZNKVAV-ZBFHGGJFSA-N 1 1 444.894 3.484 20 0 IGADMO COC(=O)c1cc2c(N3CC[N@H+]4C[C@H](Oc5cccc(F)c5)C[C@@H]4C3)[nH]c(Cl)cc-2n1 ZINC001164908807 721546026 /nfs/dbraw/zinc/54/60/26/721546026.db2.gz QQRIZYUWZNKVAV-GDBMZVCRSA-N 1 1 444.894 3.484 20 0 IGADMO CSc1nc2c(c(N3C[C@H]([N@@H+](C)Cc4cccnc4)[C@@H]4OCCC[C@H]43)n1)CCCC2 ZINC001164803013 721551167 /nfs/dbraw/zinc/55/11/67/721551167.db2.gz HDZRXNUOCJGCPV-QHAWAJNXSA-N 1 1 425.602 3.341 20 0 IGADMO CCOC(=O)c1ccc2ncnc(N3C[C@H]([N@H+](C)Cc4cccnc4)[C@H]4OCCC[C@@H]43)c2c1 ZINC001164805715 721555150 /nfs/dbraw/zinc/55/51/50/721555150.db2.gz OOYYFZHMUJZOEX-VABKMULXSA-N 1 1 447.539 3.070 20 0 IGADMO CCOC(=O)c1ccc2ncnc(N3C[C@H]([N@@H+](C)Cc4cccnc4)[C@H]4OCCC[C@@H]43)c2c1 ZINC001164805715 721555154 /nfs/dbraw/zinc/55/51/54/721555154.db2.gz OOYYFZHMUJZOEX-VABKMULXSA-N 1 1 447.539 3.070 20 0 IGADMO COc1cc2nc(C)nc(N3C[C@H]([N@@H+](C)Cc4cccnc4)[C@@H]4OCCC[C@H]43)c2cc1OC ZINC001164810531 721555910 /nfs/dbraw/zinc/55/59/10/721555910.db2.gz YQQJXZFHXJTLTI-ZFGGDYGUSA-N 1 1 449.555 3.219 20 0 IGADMO Cc1nc2c(nc(Cl)nc2N2C[C@H]([N@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@H]32)s1 ZINC001164798180 721559129 /nfs/dbraw/zinc/55/91/29/721559129.db2.gz ANRJESDIEJAJEC-HLLBOEOZSA-N 1 1 430.965 3.311 20 0 IGADMO Cc1nc2c(nc(Cl)nc2N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@H]32)s1 ZINC001164798180 721559132 /nfs/dbraw/zinc/55/91/32/721559132.db2.gz ANRJESDIEJAJEC-HLLBOEOZSA-N 1 1 430.965 3.311 20 0 IGADMO Fc1cccc(O[C@@H]2C[C@@H]3CN(c4nc(Cl)nc5c(Cl)ncnc54)CC[N@H+]3C2)c1 ZINC001164911078 721561661 /nfs/dbraw/zinc/56/16/61/721561661.db2.gz YHFGKRWYOMIASH-TZMCWYRMSA-N 1 1 435.290 3.208 20 0 IGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(C(F)(F)COc2cccc(Cl)n2)[C@@H]2CCCO[C@H]12 ZINC001164809381 721564480 /nfs/dbraw/zinc/56/44/80/721564480.db2.gz WRSHHTBMCNONLW-HLIPFELVSA-N 1 1 438.906 3.465 20 0 IGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(C(F)(F)COc2cccc(Cl)n2)[C@@H]2CCCO[C@H]12 ZINC001164809381 721564486 /nfs/dbraw/zinc/56/44/86/721564486.db2.gz WRSHHTBMCNONLW-HLIPFELVSA-N 1 1 438.906 3.465 20 0 IGADMO CSc1nc2ncnc(N3C[C@H]([N@H+](C)Cc4cccnc4)[C@@H]4OCCC[C@H]43)c2s1 ZINC001164807279 721568462 /nfs/dbraw/zinc/56/84/62/721568462.db2.gz SGXJGCXLQSXHKR-OWCLPIDISA-N 1 1 428.587 3.071 20 0 IGADMO CSc1nc2ncnc(N3C[C@H]([N@@H+](C)Cc4cccnc4)[C@@H]4OCCC[C@H]43)c2s1 ZINC001164807279 721568469 /nfs/dbraw/zinc/56/84/69/721568469.db2.gz SGXJGCXLQSXHKR-OWCLPIDISA-N 1 1 428.587 3.071 20 0 IGADMO CC(C)n1cnc2c1nc(Cl)nc2N1C[C@H]([N@H+](C)Cc2cccnc2)[C@@H]2OCCC[C@H]21 ZINC001164805352 721568919 /nfs/dbraw/zinc/56/89/19/721568919.db2.gz MSTHEPQOEIVTAY-ZIFCJYIRSA-N 1 1 441.967 3.324 20 0 IGADMO CC(C)n1cnc2c1nc(Cl)nc2N1C[C@H]([N@@H+](C)Cc2cccnc2)[C@@H]2OCCC[C@H]21 ZINC001164805352 721568923 /nfs/dbraw/zinc/56/89/23/721568923.db2.gz MSTHEPQOEIVTAY-ZIFCJYIRSA-N 1 1 441.967 3.324 20 0 IGADMO CCOC(=O)c1nc(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@H]3OCCC[C@@H]32)ccc1Cl ZINC001164800258 721570730 /nfs/dbraw/zinc/57/07/30/721570730.db2.gz DLHHBEPJUWUWEV-WFXMLNOXSA-N 1 1 430.936 3.175 20 0 IGADMO COc1ccc(-c2ccc(N3C[C@H]([N@H+](C)Cc4cccnc4)[C@H]4OCCC[C@@H]43)nn2)cc1 ZINC001164800742 721577166 /nfs/dbraw/zinc/57/71/66/721577166.db2.gz FODNHHIURZKTSU-LSQMVHIFSA-N 1 1 431.540 3.415 20 0 IGADMO COc1ccc(-c2ccc(N3C[C@H]([N@@H+](C)Cc4cccnc4)[C@H]4OCCC[C@@H]43)nn2)cc1 ZINC001164800742 721577167 /nfs/dbraw/zinc/57/71/67/721577167.db2.gz FODNHHIURZKTSU-LSQMVHIFSA-N 1 1 431.540 3.415 20 0 IGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(C(F)(F)c2nc3ccc(Cl)nc3[nH]2)[C@@H]2CCCO[C@@H]12 ZINC001164808343 721582284 /nfs/dbraw/zinc/58/22/84/721582284.db2.gz QUKZNNMJIXEXST-JFIYKMOQSA-N 1 1 448.905 3.419 20 0 IGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(C(F)(F)c2nc3ccc(Cl)nc3[nH]2)[C@@H]2CCCO[C@@H]12 ZINC001164808343 721582288 /nfs/dbraw/zinc/58/22/88/721582288.db2.gz QUKZNNMJIXEXST-JFIYKMOQSA-N 1 1 448.905 3.419 20 0 IGADMO O=C(c1cccnc1N1CCC(F)(F)[C@]2(CC[N@@H+](Cc3ccccn3)C2)C1)N1CCCC1 ZINC001164901769 721583249 /nfs/dbraw/zinc/58/32/49/721583249.db2.gz AKZFAHHBGGWQRL-QHCPKHFHSA-N 1 1 441.526 3.450 20 0 IGADMO Cc1nc(-c2ccccn2)nc(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@@H]32)c1C ZINC001164802570 721584886 /nfs/dbraw/zinc/58/48/86/721584886.db2.gz GMKVJAPKSYFLDR-RJGXRXQPSA-N 1 1 430.556 3.419 20 0 IGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2ncnc3c2ncn3-c2ccccc2)[C@@H]2CCCO[C@@H]12 ZINC001164799366 721587305 /nfs/dbraw/zinc/58/73/05/721587305.db2.gz AZNKUYQHPUAKAQ-MQSCRBSSSA-N 1 1 441.539 3.079 20 0 IGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2ncnc3c2ncn3-c2ccccc2)[C@@H]2CCCO[C@@H]12 ZINC001164799366 721587307 /nfs/dbraw/zinc/58/73/07/721587307.db2.gz AZNKUYQHPUAKAQ-MQSCRBSSSA-N 1 1 441.539 3.079 20 0 IGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2CC[C@]3(C2)COCc2c(C)nc(N(C)C)nc23)nc1 ZINC001164799753 721606790 /nfs/dbraw/zinc/60/67/90/721606790.db2.gz BPEANRDCCBIODG-BWKNWUBXSA-N 1 1 436.604 3.471 20 0 IGADMO Cc1nc2nc(Cl)nc(N3CCC(F)(F)[C@@]4(CC[N@@H+](Cc5ccccn5)C4)C3)c2[nH]1 ZINC001164907405 721697030 /nfs/dbraw/zinc/69/70/30/721697030.db2.gz SGMWBYIRQKXUHH-LJQANCHMSA-N 1 1 433.894 3.447 20 0 IGADMO COC(=O)c1cc(F)c(C)nc1N1CCC(F)(F)[C@@]2(CC[N@@H+](Cc3ccccn3)C2)C1 ZINC001164905678 721705431 /nfs/dbraw/zinc/70/54/31/721705431.db2.gz IJCFBHSRZALZMP-OAQYLSRUSA-N 1 1 434.462 3.448 20 0 IGADMO C[C@@H]1CC(=O)Nc2ncnc(N3CCC(F)(F)[C@]4(CC[N@@H+](Cc5ccccn5)C4)C3)c21 ZINC001164906649 721706447 /nfs/dbraw/zinc/70/64/47/721706447.db2.gz NMYILNXCQSAXDL-VFNWGFHPSA-N 1 1 428.487 3.055 20 0 IGADMO CCOC(=O)c1cnc(N2CCC(F)(F)[C@]3(CC[N@@H+](Cc4ccccn4)C3)C2)c(OC)c1 ZINC001164906458 721712198 /nfs/dbraw/zinc/71/21/98/721712198.db2.gz MAQAWCJMFSZUKZ-QFIPXVFZSA-N 1 1 446.498 3.400 20 0 IGADMO COc1cnc2c(c1)ncnc2N1CCC(F)(F)[C@]2(CC[N@@H+](Cc3ccccn3)C2)C1 ZINC001164904251 721718890 /nfs/dbraw/zinc/71/88/90/721718890.db2.gz AYLPKIZDMCXPOH-NRFANRHFSA-N 1 1 426.471 3.166 20 0 IGADMO CCOC(=O)c1cnc(Cl)nc1N1CCc2c(C[N@H+](C)Cc3ccco3)cncc2C1 ZINC001164910004 721744243 /nfs/dbraw/zinc/74/42/43/721744243.db2.gz XMAMBGHNGZHSNS-UHFFFAOYSA-N 1 1 441.919 3.489 20 0 IGADMO CCOC(=O)c1cnc(Cl)nc1N1CCc2c(C[N@@H+](C)Cc3ccco3)cncc2C1 ZINC001164910004 721744247 /nfs/dbraw/zinc/74/42/47/721744247.db2.gz XMAMBGHNGZHSNS-UHFFFAOYSA-N 1 1 441.919 3.489 20 0 IGADMO COc1ccc2c(C)cc(N3CCO[C@@]4(C3)COCCN(Cc3cccnc3)C4)[nH+]c2c1 ZINC001164915997 721788913 /nfs/dbraw/zinc/78/89/13/721788913.db2.gz NCZYHTQUELWBDU-VWLOTQADSA-N 1 1 434.540 3.055 20 0 IGADMO FC(F)c1nc2ccccc2c(N2CCO[C@]3(C2)COCC[N@H+](Cc2cccnc2)C3)n1 ZINC001164913995 721796000 /nfs/dbraw/zinc/79/60/00/721796000.db2.gz JQOKFBDHOJLLMJ-HSZRJFAPSA-N 1 1 441.482 3.070 20 0 IGADMO FC(F)c1nc2ccccc2c(N2CCO[C@]3(C2)COCC[N@@H+](Cc2cccnc2)C3)n1 ZINC001164913995 721796002 /nfs/dbraw/zinc/79/60/02/721796002.db2.gz JQOKFBDHOJLLMJ-HSZRJFAPSA-N 1 1 441.482 3.070 20 0 IGADMO CCOC(=O)c1nnc(Cl)cc1N1C[C@@H]2CCC[C@H]([N@@H+](C)Cc3ccccn3)[C@@H]2C1 ZINC001165025949 721809987 /nfs/dbraw/zinc/80/99/87/721809987.db2.gz OLEGZMDCSFFREG-JQHSSLGASA-N 1 1 429.952 3.439 20 0 IGADMO C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@H]2CN(c3nc(Cl)ncc3N3CCOCC3)C[C@@H]21 ZINC001165028962 721813094 /nfs/dbraw/zinc/81/30/94/721813094.db2.gz YFDDFYAWPKLCGK-YSIASYRMSA-N 1 1 442.995 3.099 20 0 IGADMO CN(C)CC[N@H+]1CC[C@@H]2[C@H]1CCN2c1nc(-c2cccnc2)nc2sc3c(c21)CCC3 ZINC001164929423 721879597 /nfs/dbraw/zinc/87/95/97/721879597.db2.gz BGSIJTADGUTBJL-RTBURBONSA-N 1 1 434.613 3.457 20 0 IGADMO C[NH+](C)CCN1CC[C@@H]2[C@H]1CCN2c1nc(-c2cccnc2)nc2sc3c(c21)CCC3 ZINC001164929423 721879599 /nfs/dbraw/zinc/87/95/99/721879599.db2.gz BGSIJTADGUTBJL-RTBURBONSA-N 1 1 434.613 3.457 20 0 IGADMO CN(C)CC[N@H+]1CC[C@@H]2[C@@H]1CCN2c1nc(-c2cccnc2)nc2sc3c(c21)CCC3 ZINC001164929418 721879718 /nfs/dbraw/zinc/87/97/18/721879718.db2.gz BGSIJTADGUTBJL-RBUKOAKNSA-N 1 1 434.613 3.457 20 0 IGADMO C[NH+](C)CCN1CC[C@@H]2[C@@H]1CCN2c1nc(-c2cccnc2)nc2sc3c(c21)CCC3 ZINC001164929418 721879720 /nfs/dbraw/zinc/87/97/20/721879720.db2.gz BGSIJTADGUTBJL-RBUKOAKNSA-N 1 1 434.613 3.457 20 0 IGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2CC[C@]3(C[C@@H](OCC(=O)N4CCCC4)CO3)C2)nc1 ZINC001164937298 721919426 /nfs/dbraw/zinc/91/94/26/721919426.db2.gz BEPKSTIBEXEZSW-RQTOMXEWSA-N 1 1 442.604 3.005 20 0 IGADMO c1ccc(OCC[NH+]2CCN(c3ccc(-c4ccc(N5CCOCC5)cc4)nn3)CC2)cc1 ZINC001165044395 721961343 /nfs/dbraw/zinc/96/13/43/721961343.db2.gz KFSHNNMXVSXXLL-UHFFFAOYSA-N 1 1 445.567 3.181 20 0 IGADMO COc1ccc(CN(C)c2ccnc(N3CC[NH+](CCOc4ccccc4)CC3)n2)cc1 ZINC001165044885 721961502 /nfs/dbraw/zinc/96/15/02/721961502.db2.gz PUXMBCODQYVJSA-UHFFFAOYSA-N 1 1 433.556 3.323 20 0 IGADMO CC(=O)N1CC[C@@]2(c3ccccc3)CCN(c3cc(OC4CC[NH+](C)CC4)ccn3)C[C@@H]12 ZINC001164947131 721968012 /nfs/dbraw/zinc/96/80/12/721968012.db2.gz PQFUPJKKANZAGI-AOYPEHQESA-N 1 1 434.584 3.324 20 0 IGADMO O=C1NCC[N@@H+](Cc2ccccc2)C12CCN(c1nc(Cl)nc3cccc(F)c31)CC2 ZINC001164944528 721972890 /nfs/dbraw/zinc/97/28/90/721972890.db2.gz JVAIWAOQMIUZOS-UHFFFAOYSA-N 1 1 439.922 3.393 20 0 IGADMO O=C1NCC[N@H+](Cc2ccccc2)C12CCN(c1nc(Cl)nc3cccc(F)c31)CC2 ZINC001164944528 721972891 /nfs/dbraw/zinc/97/28/91/721972891.db2.gz JVAIWAOQMIUZOS-UHFFFAOYSA-N 1 1 439.922 3.393 20 0 IGADMO CCOC(=O)c1cnc(Cl)cc1N1CCC2(CC1)COCC[N@@H+](Cc1ccncc1)C2 ZINC001164960519 722051900 /nfs/dbraw/zinc/05/19/00/722051900.db2.gz QYXZHRISHUMTJE-UHFFFAOYSA-N 1 1 444.963 3.426 20 0 IGADMO Cc1c[nH]c2nc(Cl)nc(N3CCC4(CC3)COCC[N@@H+](Cc3ccncc3)C4)c12 ZINC001164964660 722054426 /nfs/dbraw/zinc/05/44/26/722054426.db2.gz WKZVAABUWUKDPH-UHFFFAOYSA-N 1 1 426.952 3.434 20 0 IGADMO CCOC(=O)/C=C/c1ccc(N2CCC3(CC2)COCC[N@@H+](Cc2ccncc2)C3)nc1 ZINC001164961649 722057870 /nfs/dbraw/zinc/05/78/70/722057870.db2.gz NQKDRLPNTYICJU-GQCTYLIASA-N 1 1 436.556 3.172 20 0 IGADMO CC(C)(C)NC(=O)c1ccnc(N2CCC3(CC2)COCC[N@@H+](Cc2ccncc2)C3)c1 ZINC001164962465 722058191 /nfs/dbraw/zinc/05/81/91/722058191.db2.gz SFFKJYAXDQLVMV-UHFFFAOYSA-N 1 1 437.588 3.124 20 0 IGADMO CC1CCN(c2ccc(N3CCC4(CC3)COCC[N@@H+](Cc3ccncc3)C4)nn2)CC1 ZINC001164960002 722060026 /nfs/dbraw/zinc/06/00/26/722060026.db2.gz CIRHDSZHFJBIDS-UHFFFAOYSA-N 1 1 436.604 3.227 20 0 IGADMO FC(F)(Oc1cnc(Cl)cn1)N1CCC2(CC1)COCC[N@@H+](Cc1ccncc1)C2 ZINC001164966915 722062288 /nfs/dbraw/zinc/06/22/88/722062288.db2.gz YZVLOWGLDLXBKK-UHFFFAOYSA-N 1 1 439.894 3.069 20 0 IGADMO C[N@@H+](Cc1ccc(N2CC[C@@H]3C(=O)N(Cc4cccc(F)c4)CCO[C@@H]3C2)nc1)C1CC1 ZINC001164968584 722082551 /nfs/dbraw/zinc/08/25/51/722082551.db2.gz DUPJVUGVRZHIOX-XZOQPEGZSA-N 1 1 438.547 3.069 20 0 IGADMO Clc1nc2c(c(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)n1)CSCC2 ZINC001164979995 722104125 /nfs/dbraw/zinc/10/41/25/722104125.db2.gz IQNNPOPKMBPNFO-QFBILLFUSA-N 1 1 431.993 3.042 20 0 IGADMO CSc1nc2c(c(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)n1)CCCC2 ZINC001164981839 722113985 /nfs/dbraw/zinc/11/39/85/722113985.db2.gz VIJOXCFJQBTWQP-GHTZIAJQSA-N 1 1 425.602 3.200 20 0 IGADMO COc1ccc2nc(Cl)cc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)c2n1 ZINC001164983766 722122357 /nfs/dbraw/zinc/12/23/57/722122357.db2.gz ZZGUVYIYLKXMRF-YLJYHZDGSA-N 1 1 439.947 3.414 20 0 IGADMO COc1cccc2nc(Cl)nc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)c21 ZINC001164972442 722123604 /nfs/dbraw/zinc/12/36/04/722123604.db2.gz FJQPCRMFCWBHHD-YLJYHZDGSA-N 1 1 439.947 3.414 20 0 IGADMO COc1cc2ccc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)nc2cc1OC ZINC001164974044 722126933 /nfs/dbraw/zinc/12/69/33/722126933.db2.gz IHKCNGJZYURZGF-HYBUGGRVSA-N 1 1 434.540 3.374 20 0 IGADMO c1ccc2c(c1)CCc1cnc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)nc1-2 ZINC001164982289 722134520 /nfs/dbraw/zinc/13/45/20/722134520.db2.gz RNVYZQOSMSFYAI-VWNXMTODSA-N 1 1 427.552 3.365 20 0 IGADMO COc1ccc(-c2ccc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)nn2)cc1 ZINC001164973385 722140165 /nfs/dbraw/zinc/14/01/65/722140165.db2.gz CAYTWHUUAHENNE-URXFXBBRSA-N 1 1 431.540 3.275 20 0 IGADMO COc1cccc(-c2ccc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)nn2)c1 ZINC001164983313 722141755 /nfs/dbraw/zinc/14/17/55/722141755.db2.gz TYLBEAXEHZUASK-XUZZJYLKSA-N 1 1 431.540 3.275 20 0 IGADMO Clc1cc(-c2ccncc2)nc(N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)n1 ZINC001164971602 722153990 /nfs/dbraw/zinc/15/39/90/722153990.db2.gz CFKWRGUNISGHFO-CTNGQTDRSA-N 1 1 436.947 3.314 20 0 IGADMO NC(=S)c1cnc(N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)c2sccc21 ZINC001164972234 722158042 /nfs/dbraw/zinc/15/80/42/722158042.db2.gz HLJREFZNFKBFIU-LPHOPBHVSA-N 1 1 439.610 3.053 20 0 IGADMO O=S(=O)(c1ccc(N2CCC[C@@]3(CC[N@@H+]3Cc3cccc(F)c3)C2)nc1)N1CCCC1 ZINC001164994041 722208166 /nfs/dbraw/zinc/20/81/66/722208166.db2.gz DRWXRYLRPOBXKJ-HSZRJFAPSA-N 1 1 444.576 3.250 20 0 IGADMO c1nc2c(nc(N3CCC[C@H]4C[N@H+](Cc5ccccc5)C[C@H]43)nc2N2CCOCC2)s1 ZINC001164627953 719069446 /nfs/dbraw/zinc/06/94/46/719069446.db2.gz RMUIDPVIJCJYEF-RBUKOAKNSA-N 1 1 436.585 3.024 20 0 IGADMO CCOC(=O)C1CCN(c2ccc(N3CCC[C@H]4C[N@@H+](Cc5ccccc5)C[C@@H]43)nn2)CC1 ZINC001164629066 719086939 /nfs/dbraw/zinc/08/69/39/719086939.db2.gz QTFGMHYFBSATJF-GOTSBHOMSA-N 1 1 449.599 3.357 20 0 IGADMO COC(=O)c1cc(Cl)nc(C(F)(F)N2CCc3c(C[NH+](C)C)nn(C(C)C)c3C2)c1 ZINC001164648309 719312429 /nfs/dbraw/zinc/31/24/29/719312429.db2.gz HSPHQGCBGUTWFI-UHFFFAOYSA-N 1 1 441.910 3.468 20 0 IGADMO Fc1ccc(CN2CCOCC23CCN(c2nc(N4CCCCC4)cc[nH+]2)CC3)cc1 ZINC001164671649 719515577 /nfs/dbraw/zinc/51/55/77/719515577.db2.gz GSGFXZKLVNRSEL-UHFFFAOYSA-N 1 1 425.552 3.477 20 0 IGADMO COC(=O)Cc1c(Cl)ncnc1N1CCC2(CCC[N@H+]2Cc2csc(C)n2)CC1 ZINC001164692491 719807212 /nfs/dbraw/zinc/80/72/12/719807212.db2.gz IELJRWNWKUOXNJ-UHFFFAOYSA-N 1 1 435.981 3.245 20 0 IGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2Cc3nnn(C)c3[C@@H](COCc3cccnc3)C2)nc1 ZINC001164695442 719835591 /nfs/dbraw/zinc/83/55/91/719835591.db2.gz MYOOGJXICCHQDC-FYYLOGMGSA-N 1 1 447.587 3.473 20 0 IGADMO COc1nc(-c2ccccc2)nc(N2CCC3(CC2)C[N@H+](Cc2cccs2)CCO3)n1 ZINC001164697500 719894633 /nfs/dbraw/zinc/89/46/33/719894633.db2.gz KEZKLCNGGFHFAK-UHFFFAOYSA-N 1 1 437.569 3.480 20 0 IGADMO COc1nc(-c2ccccc2)nc(N2CCC3(CC2)C[N@@H+](Cc2cccs2)CCO3)n1 ZINC001164697500 719894634 /nfs/dbraw/zinc/89/46/34/719894634.db2.gz KEZKLCNGGFHFAK-UHFFFAOYSA-N 1 1 437.569 3.480 20 0 IGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1nc3cc(C(=O)OC)ccc3nc1Cl)C2 ZINC001164810416 720078509 /nfs/dbraw/zinc/07/85/09/720078509.db2.gz LSSCXCQMXSQZIR-UZUQRXQVSA-N 1 1 444.963 3.255 20 0 IGADMO COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1ncc(OC)c(NC(C)C)n1)CC2 ZINC001164710177 720092290 /nfs/dbraw/zinc/09/22/90/720092290.db2.gz GRLHWKQZHCWVHO-HXUWFJFHSA-N 1 1 440.592 3.208 20 0 IGADMO COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1ccc(N3CCCCC3)nn1)CC2 ZINC001164710655 720094679 /nfs/dbraw/zinc/09/46/79/720094679.db2.gz KNUFVLLKGIGTAV-QFIPXVFZSA-N 1 1 436.604 3.369 20 0 IGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(C(F)(F)c1cnc(Cl)c(C(=O)OC)c1)C2 ZINC001164809259 720096448 /nfs/dbraw/zinc/09/64/48/720096448.db2.gz IZPBYZXUIAURQY-UZLBHIALSA-N 1 1 443.922 3.251 20 0 IGADMO CCOC(=O)c1cnc(N2CCC3(C[C@@H](COC)[N@@H+](Cc4ccccn4)C3)CC2)c(C)c1 ZINC001164714171 720108053 /nfs/dbraw/zinc/10/80/53/720108053.db2.gz AJKGMLADWJWCNM-QFIPXVFZSA-N 1 1 438.572 3.469 20 0 IGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(C(F)(F)c1ccc(Cl)nc1C(=O)OC)C2 ZINC001164814992 720109462 /nfs/dbraw/zinc/10/94/62/720109462.db2.gz VCAYXZNGYZXRJO-YWZLYKJASA-N 1 1 443.922 3.251 20 0 IGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(C(F)(F)c1ccc(C(=O)OC)nc1Cl)C2 ZINC001164807487 720110514 /nfs/dbraw/zinc/11/05/14/720110514.db2.gz CNIKMTQZTCDODC-QRWLVFNGSA-N 1 1 443.922 3.251 20 0 IGADMO COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1ccnc(-c3cccnc3)n1)CC2 ZINC001164718074 720125025 /nfs/dbraw/zinc/12/50/25/720125025.db2.gz RKMUDKBXMWONRG-JOCHJYFZSA-N 1 1 430.556 3.441 20 0 IGADMO CCN(CC)C(=O)c1cc(Cl)nc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COC)c1 ZINC001164815918 720128131 /nfs/dbraw/zinc/12/81/31/720128131.db2.gz XKYXMPKCULBRIH-CVDCTZTESA-N 1 1 435.012 3.402 20 0 IGADMO CCOC(=O)c1c(C)ccnc1N1CCC2(C[C@H](COC)[N@@H+](Cc3ccccn3)C2)CC1 ZINC001164712235 720133169 /nfs/dbraw/zinc/13/31/69/720133169.db2.gz LLHGHKGUVAUHNM-OAQYLSRUSA-N 1 1 438.572 3.469 20 0 IGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(C(F)(F)c1ccc3ncnc(Cl)c3n1)C2 ZINC001164815511 720136417 /nfs/dbraw/zinc/13/64/17/720136417.db2.gz WCQCQXVWFGJCTO-QRWLVFNGSA-N 1 1 437.922 3.408 20 0 IGADMO COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1nccnc1OCC(C)C)CC2 ZINC001164714010 720150061 /nfs/dbraw/zinc/15/00/61/720150061.db2.gz VCLJXHSDAKYAQJ-OAQYLSRUSA-N 1 1 425.577 3.414 20 0 IGADMO COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN([C@H](F)Oc1cncc(Cl)n1)CC2 ZINC001164713092 720153765 /nfs/dbraw/zinc/15/37/65/720153765.db2.gz QOUSCMRQVQUXDI-PXNSSMCTSA-N 1 1 435.931 3.160 20 0 IGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1ncccc1C(=O)N1CCc3ccccc31)C2 ZINC001164815553 720164052 /nfs/dbraw/zinc/16/40/52/720164052.db2.gz IDPCDQJFUNNDCT-AJTFRIOCSA-N 1 1 446.595 3.469 20 0 IGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1nc(C(=O)OC)c(OC)c3ccccc31)C2 ZINC001164818349 720183675 /nfs/dbraw/zinc/18/36/75/720183675.db2.gz SKIRQTPZBVCNSA-IQGLISFBSA-N 1 1 439.556 3.215 20 0 IGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1nc(C(=O)OC)c(OC)c3ccccc31)C2 ZINC001164818339 720184043 /nfs/dbraw/zinc/18/40/43/720184043.db2.gz SKIRQTPZBVCNSA-AVRWGWEMSA-N 1 1 439.556 3.215 20 0 IGADMO Cc1cc(C(F)(F)N2CCCn3c(=O)cc(C[N@H+](C)C(C)C)nc3C2)cc(Cl)n1 ZINC001164814581 720210900 /nfs/dbraw/zinc/21/09/00/720210900.db2.gz UPHAPEXNAIWWDH-UHFFFAOYSA-N 1 1 425.911 3.396 20 0 IGADMO COCc1cc(N2CCCn3c(=O)cc(C[N@@H+](C)C(C)C)nc3C2)nc(-c2ccccc2)n1 ZINC001164812899 720212625 /nfs/dbraw/zinc/21/26/25/720212625.db2.gz NBPYVZWITXOZKW-UHFFFAOYSA-N 1 1 448.571 3.097 20 0 IGADMO Cc1cccc2c1nc(Cl)nc2N1CCCn2c(=O)cc(C[N@H+](C)C(C)C)nc2C1 ZINC001164814709 720218539 /nfs/dbraw/zinc/21/85/39/720218539.db2.gz VYDZLMCMVCVTTK-UHFFFAOYSA-N 1 1 426.952 3.399 20 0 IGADMO CC(C)[N@@H+](C)Cc1cc(=O)n2c(n1)CN(c1ncccc1OCc1ccccc1)CCC2 ZINC001164813493 720234421 /nfs/dbraw/zinc/23/44/21/720234421.db2.gz OXHHTSFQRKTGIF-UHFFFAOYSA-N 1 1 433.556 3.468 20 0 IGADMO CC(C)[N@@H+](C)Cc1cc(=O)n2c(n1)CN(c1nc(C(F)F)nc3ccccc31)CCC2 ZINC001164813960 720239544 /nfs/dbraw/zinc/23/95/44/720239544.db2.gz SJRZNUOCZZQCDX-UHFFFAOYSA-N 1 1 428.487 3.375 20 0 IGADMO CC(C)c1noc(-c2ccnc(N3CCCn4c(=O)cc(C[N@H+](C)C(C)C)nc4C3)c2)n1 ZINC001164814532 720242901 /nfs/dbraw/zinc/24/29/01/720242901.db2.gz XEZJQHNYIGOBCV-UHFFFAOYSA-N 1 1 437.548 3.062 20 0 IGADMO COc1cc2ccnc(N3CCCn4c(=O)cc(C[N@@H+](C)C(C)C)nc4C3)c2cc1F ZINC001164817225 720246006 /nfs/dbraw/zinc/24/60/06/720246006.db2.gz PZHQRQKZABOMIL-UHFFFAOYSA-N 1 1 425.508 3.190 20 0 IGADMO COc1cc2ccnc(N3CC[C@H]4[C@H]3CCC(=O)N4CC3CC[NH+](C)CC3)c2cc1OC ZINC001164831925 720321772 /nfs/dbraw/zinc/32/17/72/720321772.db2.gz SEBZQSXAPXPRRI-RTWAWAEBSA-N 1 1 438.572 3.164 20 0 IGADMO Fc1ccccc1Cn1cnc2c1ncnc2N1CC[C@@H]2[C@H]1CC[N@H+]2Cc1cccnc1 ZINC001164731012 720401116 /nfs/dbraw/zinc/40/11/16/720401116.db2.gz XZVDWJWULUJWRW-NHCUHLMSSA-N 1 1 429.503 3.262 20 0 IGADMO O=C(Nc1cccnc1)[C@@]12CCO[C@@H]1CCN(c1nc(Cl)ccc1C[NH+]1CCCC1)C2 ZINC001164725798 720501403 /nfs/dbraw/zinc/50/14/03/720501403.db2.gz KLJJHWNJTXDVQM-AUSIDOKSSA-N 1 1 441.963 3.350 20 0 IGADMO CC(C)[N@@H+]1[C@@H]2CCN(c3nc(Cl)nc4c3COC4(C)C)C[C@H]2C[C@H]1Cn1cccn1 ZINC001164836049 720524820 /nfs/dbraw/zinc/52/48/20/720524820.db2.gz LXLRUTYMMFFLGV-SOLBZPMBSA-N 1 1 430.984 3.470 20 0 IGADMO CCOC(=O)c1cnc(C2CC2)nc1N1CC[C@@H]2[C@@H](C[C@@H](Cn3cccn3)[N@H+]2C(C)C)C1 ZINC001164835023 720543964 /nfs/dbraw/zinc/54/39/64/720543964.db2.gz GTJGMRKEALXJJU-IRFCIJBXSA-N 1 1 438.576 3.105 20 0 IGADMO CC(C)[N@@H+]1[C@@H]2CCN(C(F)(F)COc3cncc(Cl)n3)C[C@H]2C[C@H]1Cn1cccn1 ZINC001164844165 720611369 /nfs/dbraw/zinc/61/13/69/720611369.db2.gz ZNSYKAIUXXPPHV-IXDOHACOSA-N 1 1 440.926 3.172 20 0 IGADMO CC(C)[N@@H+]1[C@@H]2CCN(C(F)(F)COc3cncc(Cl)n3)C[C@@H]2C[C@H]1Cn1cccn1 ZINC001164844167 720612147 /nfs/dbraw/zinc/61/21/47/720612147.db2.gz ZNSYKAIUXXPPHV-YESZJQIVSA-N 1 1 440.926 3.172 20 0 IGADMO COC(=O)c1cc(Cl)c(N2CC[C@@H]3[C@@H](C[C@H](Cn4cccn4)[N@H+]3C(C)C)C2)nc1C ZINC001164840238 720639201 /nfs/dbraw/zinc/63/92/01/720639201.db2.gz PFOKWATWBPGEJR-SQGPQFPESA-N 1 1 431.968 3.404 20 0 IGADMO COC(=O)c1cnc(Cl)nc1N1CCC2(C[C@@H]([N@@H+](C)Cc3ccccc3)CO2)CC1 ZINC001164838874 720661919 /nfs/dbraw/zinc/66/19/19/720661919.db2.gz IDNIXRYIIGVUMT-QGZVFWFLSA-N 1 1 430.936 3.177 20 0 IGADMO C[N@@H+](Cc1ccccc1)[C@H]1COC2(C1)CCN(c1ccc(CN3CCOCC3)cn1)CC2 ZINC001164839136 720663450 /nfs/dbraw/zinc/66/34/50/720663450.db2.gz ITBFGTONJZWSKE-XMMPIXPASA-N 1 1 436.600 3.174 20 0 IGADMO C[N@@H+](Cc1ccccc1)[C@H]1COC2(C1)CCN(c1nc(Cl)c(F)cc1C(N)=O)CC2 ZINC001164837609 720677093 /nfs/dbraw/zinc/67/70/93/720677093.db2.gz DJSHKHDPTAYJDI-MRXNPFEDSA-N 1 1 432.927 3.233 20 0 IGADMO COC(=O)Cc1c(Cl)ncnc1N1CCC2(C[C@@H]([N@@H+](C)Cc3ccccc3)CO2)CC1 ZINC001164843814 720680945 /nfs/dbraw/zinc/68/09/45/720680945.db2.gz RBZRHRMZBYWPRJ-GOSISDBHSA-N 1 1 444.963 3.105 20 0 IGADMO COCCn1ccc2c1ncnc2N1CCC2(C[C@@H]([N@@H+](C)Cc3ccccc3)CO2)CC1 ZINC001164841063 720694803 /nfs/dbraw/zinc/69/48/03/720694803.db2.gz HIZKVBIAYVJQCC-OAQYLSRUSA-N 1 1 435.572 3.338 20 0 IGADMO CSc1ccc(C(F)(F)N2CC[N@@H+]3C[C@H](Oc4cncnc4)C[C@H]3C2)nc1Cl ZINC001164739665 720713700 /nfs/dbraw/zinc/71/37/00/720713700.db2.gz OOGFNJLQSOOKGZ-QWHCGFSZSA-N 1 1 427.908 3.134 20 0 IGADMO CSc1ccc(C(F)(F)N2CC[N@H+]3C[C@H](Oc4cncnc4)C[C@H]3C2)nc1Cl ZINC001164739665 720713710 /nfs/dbraw/zinc/71/37/10/720713710.db2.gz OOGFNJLQSOOKGZ-QWHCGFSZSA-N 1 1 427.908 3.134 20 0 IGADMO COCCOC(=O)c1ccnc(N2CCC3(C[C@H]([N@@H+](C)Cc4ccccc4)CO3)CC2)c1 ZINC001164842283 720724120 /nfs/dbraw/zinc/72/41/20/720724120.db2.gz XOMWBFHKVFRTOA-QFIPXVFZSA-N 1 1 439.556 3.145 20 0 IGADMO c1cc(-c2nc3ccccc3c(N3CC[N@@H+]4C[C@@H](Oc5cncnc5)C[C@H]4C3)n2)cs1 ZINC001164745387 720766956 /nfs/dbraw/zinc/76/69/56/720766956.db2.gz VNUDMFMOJPSLMW-ROUUACIJSA-N 1 1 430.537 3.490 20 0 IGADMO FC(F)c1nc2ccc(Cl)cc2c(N2CC[N@H+]3C[C@H](Oc4cncnc4)C[C@H]3C2)n1 ZINC001164747683 720800179 /nfs/dbraw/zinc/80/01/79/720800179.db2.gz PAXMLSNWABZTBJ-UONOGXRCSA-N 1 1 432.862 3.353 20 0 IGADMO Fc1cccc2nc(Cl)nc(N3CC[C@@H]4[C@@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)c12 ZINC001164746261 720822115 /nfs/dbraw/zinc/82/21/15/720822115.db2.gz YSULPUPZRMLIMO-FRQCXROJSA-N 1 1 441.942 3.393 20 0 IGADMO Clc1ncnc2scc(N3CC[C@@H]4[C@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)c21 ZINC001164741751 720822685 /nfs/dbraw/zinc/82/26/85/720822685.db2.gz OCJIHNAEMHBMMB-OWCLPIDISA-N 1 1 429.981 3.316 20 0 IGADMO CCC[N@H+]1CCCC[C@@H]1c1ccc(N2CC[C@@H]3O[C@@H](C(=O)N4CCCO4)CC[C@@H]32)nc1 ZINC001164848842 720822971 /nfs/dbraw/zinc/82/29/71/720822971.db2.gz NKVWGKLJAMYJJF-CLAROIROSA-N 1 1 428.577 3.309 20 0 IGADMO CC(C)(C)OC(=O)c1ccc(N2CC[C@@H]3[C@H](C[C@@H](Cn4cncn4)[N@H+]3CC3CC3)C2)nc1 ZINC001164743837 720827971 /nfs/dbraw/zinc/82/79/71/720827971.db2.gz SSIJZNLBVPEPNB-QHAWAJNXSA-N 1 1 438.576 3.008 20 0 IGADMO COc1cc2ccnc(N3CC[C@@H]4[C@H](C[C@@H](Cn5cncn5)[N@@H+]4CC4CC4)C3)c2cc1OC ZINC001164745572 720832137 /nfs/dbraw/zinc/83/21/37/720832137.db2.gz WVNJZCOGBKSZTQ-RZUBCFFCSA-N 1 1 448.571 3.223 20 0 IGADMO COc1cc2ccnc(N3CC[C@@H]4[C@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)c2cc1OC ZINC001164745572 720832142 /nfs/dbraw/zinc/83/21/42/720832142.db2.gz WVNJZCOGBKSZTQ-RZUBCFFCSA-N 1 1 448.571 3.223 20 0 IGADMO COCC[N@H+]1CCO[C@H]2CN(C(F)(F)c3ccc4ncc(Cl)nc4c3)CC[C@@H]2C1 ZINC001164849645 720842109 /nfs/dbraw/zinc/84/21/09/720842109.db2.gz CENNBMYQEUIQPI-KDOFPFPSSA-N 1 1 426.895 3.002 20 0 IGADMO COCC[N@H+]1CCO[C@H]2CN(C(F)(F)c3nc4ccsc4c(Cl)n3)CC[C@@H]2C1 ZINC001164853347 720842710 /nfs/dbraw/zinc/84/27/10/720842710.db2.gz OJFOAWNWFFNEQT-OCCSQVGLSA-N 1 1 432.924 3.063 20 0 IGADMO COCC[N@H+]1CCO[C@H]2CN(C(F)(F)c3ccc4ncnc(Cl)c4c3)CC[C@H]2C1 ZINC001164853715 720849037 /nfs/dbraw/zinc/84/90/37/720849037.db2.gz OROWGZXWSANHIO-KSSFIOAISA-N 1 1 426.895 3.002 20 0 IGADMO COc1ccc(-c2cc(N3CC[C@@H]4[C@@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)ncn2)cc1 ZINC001164750328 720850104 /nfs/dbraw/zinc/85/01/04/720850104.db2.gz XGVDMKIUFPIZFA-AWRGLXIESA-N 1 1 445.571 3.123 20 0 IGADMO COc1ccccc1-c1cc(N2CC[C@@H]3[C@H](C[C@@H](Cn4cncn4)[N@H+]3CC3CC3)C2)ncn1 ZINC001164748792 720850359 /nfs/dbraw/zinc/85/03/59/720850359.db2.gz UXHSSUIANOWOFH-ZRCGQRJVSA-N 1 1 445.571 3.123 20 0 IGADMO CC(C)c1noc(-c2ccnc(N3CC[C@@H]4[C@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)c2)n1 ZINC001164751886 720853530 /nfs/dbraw/zinc/85/35/30/720853530.db2.gz RLOBLPGPLMYERA-NJDAHSKKSA-N 1 1 448.575 3.226 20 0 IGADMO c1ncn(C[C@@H]2C[C@@H]3CN(c4cncc(OCC5CCCC5)n4)CC[C@H]3[N@@H+]2CC2CC2)n1 ZINC001164752003 720858654 /nfs/dbraw/zinc/85/86/54/720858654.db2.gz SHZPGRJICZKWTM-BHIFYINESA-N 1 1 437.592 3.017 20 0 IGADMO COCC[N@H+]1CCO[C@@H]2CN(C(F)(F)c3ccc4cnc(Cl)nc4c3)CC[C@@H]2C1 ZINC001164852369 720863246 /nfs/dbraw/zinc/86/32/46/720863246.db2.gz CNDIORRNWHWLEG-CRAIPNDOSA-N 1 1 426.895 3.002 20 0 IGADMO CCN(C)c1ccnc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COCc2cccnc2)n1 ZINC001164747418 720868221 /nfs/dbraw/zinc/86/82/21/720868221.db2.gz BQKFUOIDCAFZGS-RCZVLFRGSA-N 1 1 436.604 3.083 20 0 IGADMO COC(=O)c1cccnc1N1CC[C@@]2(C1)C[N@@H+](CC1CC1)C[C@H]2COCc1cccnc1 ZINC001164754813 720876933 /nfs/dbraw/zinc/87/69/33/720876933.db2.gz SPERJGGXXDJWGW-OFVILXPXSA-N 1 1 436.556 3.018 20 0 IGADMO c1cncc(COC[C@H]2C[N@@H+](CC3CC3)C[C@]23CCN(c2ncnc4cnccc42)C3)c1 ZINC001164750132 720877926 /nfs/dbraw/zinc/87/79/26/720877926.db2.gz JAVCCWCBGHHMGC-BWKNWUBXSA-N 1 1 430.556 3.175 20 0 IGADMO COCC[N@H+]1CCO[C@H]2CN(c3nc(-c4cccc(OC)c4)nc4ccccc43)CC[C@@H]2C1 ZINC001164859831 720882623 /nfs/dbraw/zinc/88/26/23/720882623.db2.gz MVOMRVJDYUMWJR-YKSBVNFPSA-N 1 1 448.567 3.479 20 0 IGADMO Nc1cc(Cl)nc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COCc2cccnc2)c1 ZINC001164758447 720884260 /nfs/dbraw/zinc/88/42/60/720884260.db2.gz YDQRKWJHJRSPIU-AUSIDOKSSA-N 1 1 427.980 3.467 20 0 IGADMO COCC[N@H+]1CCO[C@H]2CN(c3cnc(Cl)nc3Oc3ccc(C)cc3)CC[C@@H]2C1 ZINC001164853767 720888702 /nfs/dbraw/zinc/88/87/02/720888702.db2.gz CRINLIZFSYJSJJ-XLIONFOSSA-N 1 1 432.952 3.404 20 0 IGADMO CC(=O)Nc1cccc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COCc2cccnc2)n1 ZINC001164756232 720889491 /nfs/dbraw/zinc/88/94/91/720889491.db2.gz ONMVXTNYKPAYKV-RCZVLFRGSA-N 1 1 435.572 3.190 20 0 IGADMO COCC[N@H+]1CCO[C@H]2CN(c3cnc(Cl)nc3Oc3cccc(OC)c3)CC[C@H]2C1 ZINC001164862154 720889721 /nfs/dbraw/zinc/88/97/21/720889721.db2.gz QWPMXOHCXMFUOI-JXFKEZNVSA-N 1 1 448.951 3.104 20 0 IGADMO COCC[N@H+]1CCO[C@H]2CN(c3cnc(Cl)nc3Oc3ccccc3OC)CC[C@@H]2C1 ZINC001164865032 720890223 /nfs/dbraw/zinc/89/02/23/720890223.db2.gz XZXUGOGBDFVXOK-UZLBHIALSA-N 1 1 448.951 3.104 20 0 IGADMO COc1nc(C)nc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COCc2cccnc2)c1C ZINC001164750152 720931386 /nfs/dbraw/zinc/93/13/86/720931386.db2.gz JJTSCNMWIJHWQB-RDGATRHJSA-N 1 1 437.588 3.252 20 0 IGADMO CCC[C@H](C)NS(=O)(=O)c1ccc(N2CCn3c(C[N@@H+](C)C(C)C)cnc3[C@H]2C)nc1 ZINC001164863547 721006924 /nfs/dbraw/zinc/00/69/24/721006924.db2.gz WBVXGOVNPCDAGV-ZWKOTPCHSA-N 1 1 448.637 3.166 20 0 IGADMO FC(F)(Oc1ccc(Cl)nc1Cl)N1CCc2[nH+]cc(Cn3cccn3)n2CC1 ZINC001164862070 721033771 /nfs/dbraw/zinc/03/37/71/721033771.db2.gz LWMGRTLEIHRPHA-UHFFFAOYSA-N 1 1 429.258 3.317 20 0 IGADMO COc1cccc2c1nc(Cl)nc2N1CC[N@H+]2C[C@H](OCc3cccnc3)C[C@@H]2C1 ZINC001164863348 721085961 /nfs/dbraw/zinc/08/59/61/721085961.db2.gz CBQNYWWBGAXRHQ-IAGOWNOFSA-N 1 1 425.920 3.167 20 0 IGADMO O=C(Nc1ccccc1)c1ccnc(N2CC[N@H+]3C[C@@H](OCc4cccnc4)C[C@@H]3C2)c1 ZINC001164865031 721092942 /nfs/dbraw/zinc/09/29/42/721092942.db2.gz IBYCSXMKJWDQMV-PKTZIBPZSA-N 1 1 429.524 3.209 20 0 IGADMO FC(F)(c1ccc2ncnc(Cl)c2n1)N1CC[N@H+]2C[C@@H](OCc3cccnc3)C[C@H]2C1 ZINC001164864570 721107538 /nfs/dbraw/zinc/10/75/38/721107538.db2.gz GLWNMVOGAOKLET-HOTGVXAUSA-N 1 1 446.889 3.098 20 0 IGADMO CN(C)c1ccc(-c2ccnc(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@@H]4C3)n2)cc1 ZINC001164880720 721122840 /nfs/dbraw/zinc/12/28/40/721122840.db2.gz XFLHOJYQPBHHGL-PKTZIBPZSA-N 1 1 430.556 3.084 20 0 IGADMO CN(C)c1ccc(-c2ccnc(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@H]4C3)n2)cc1 ZINC001164880721 721124177 /nfs/dbraw/zinc/12/41/77/721124177.db2.gz XFLHOJYQPBHHGL-XZOQPEGZSA-N 1 1 430.556 3.084 20 0 IGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4nc(Cl)ncc4OCc4ccccc4)C[C@H]3C2)cn1 ZINC001164765608 721140024 /nfs/dbraw/zinc/14/00/24/721140024.db2.gz JNNUIPNDBFSLOU-WOJBJXKFSA-N 1 1 438.963 3.401 20 0 IGADMO Cc1ccc(-c2nc3c(ncnc3N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@H]4C3)o2)cc1 ZINC001164871092 721150969 /nfs/dbraw/zinc/15/09/69/721150969.db2.gz DMUKKINMCNSPOD-SFTDATJTSA-N 1 1 442.523 3.468 20 0 IGADMO CCOc1ccc(-c2ccc(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@@H]4C3)nn2)cc1 ZINC001164872793 721162090 /nfs/dbraw/zinc/16/20/90/721162090.db2.gz IJXLSFKCRPTUHK-FYYLOGMGSA-N 1 1 431.540 3.417 20 0 IGADMO Cc1ccc(-c2nc3c(ncnc3N3C[C@H]4CC[N@H+](Cc5cnn(C)c5)C[C@@H]4C3)o2)cc1 ZINC001164771845 721206116 /nfs/dbraw/zinc/20/61/16/721206116.db2.gz REJLZNOWLDLNMZ-WOJBJXKFSA-N 1 1 429.528 3.285 20 0 IGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4ncc(C(=O)N5CCCCC5)cc4Cl)C[C@@H]3C2)cn1 ZINC001164761972 721208628 /nfs/dbraw/zinc/20/86/28/721208628.db2.gz BGYNKDUXRFZCDW-QUCCMNQESA-N 1 1 442.995 3.053 20 0 IGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4cncc(OCc5cccc(Cl)c5)n4)C[C@H]3C2)cn1 ZINC001164767902 721236888 /nfs/dbraw/zinc/23/68/88/721236888.db2.gz WYOCBRJFWYPFBV-WOJBJXKFSA-N 1 1 438.963 3.401 20 0 IGADMO CCC[N@H+]1CCCC[C@@H]1c1ccc(N2CCn3c(CNC(=O)c4ccno4)cnc3C2)nc1 ZINC001164764429 721269020 /nfs/dbraw/zinc/26/90/20/721269020.db2.gz GNPLNRYMQRPZFJ-HXUWFJFHSA-N 1 1 449.559 3.153 20 0 IGADMO C[N@@H+](Cc1ccc(N2CC[C@H]3CN(C(=O)c4ccsc4)CCO[C@H]3C2)nc1)C1CC1 ZINC001164876605 721299212 /nfs/dbraw/zinc/29/92/12/721299212.db2.gz JJAWOZJPZWEULU-RXVVDRJESA-N 1 1 426.586 3.105 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@@]2(CCCN(c3nc(Cl)nc4[nH]cc(F)c43)C2)C1 ZINC001164777033 721332015 /nfs/dbraw/zinc/33/20/15/721332015.db2.gz KNRXCMDKPKFNMX-NRFANRHFSA-N 1 1 448.930 3.474 20 0 IGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@@]2(CCCN(c3nc(Cl)nc4c3CCC4)C2)C1 ZINC001164776985 721337118 /nfs/dbraw/zinc/33/71/18/721337118.db2.gz JGKGEWPNRDXCPL-QFIPXVFZSA-N 1 1 431.968 3.343 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@@]2(CCCN(c3nc(Cl)nc4c3CCC4)C2)C1 ZINC001164776985 721337120 /nfs/dbraw/zinc/33/71/20/721337120.db2.gz JGKGEWPNRDXCPL-QFIPXVFZSA-N 1 1 431.968 3.343 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@]2(CCCN(c3nc(Cl)nc4ncccc43)C2)C1 ZINC001164778387 721338469 /nfs/dbraw/zinc/33/84/69/721338469.db2.gz VAGRFMCNDPPEEO-JOCHJYFZSA-N 1 1 442.951 3.402 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@@]2(CCCN(c3cc(Cl)nc4nc[nH]c43)C2)C1 ZINC001164779483 721347879 /nfs/dbraw/zinc/34/78/79/721347879.db2.gz UGIMYDPJJVFUKA-NRFANRHFSA-N 1 1 430.940 3.335 20 0 IGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@@]2(CCCN(c3cc(Cl)nc4[nH]cnc43)C2)C1 ZINC001164779483 721347886 /nfs/dbraw/zinc/34/78/86/721347886.db2.gz UGIMYDPJJVFUKA-NRFANRHFSA-N 1 1 430.940 3.335 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@@]2(CCCN(c3cc(Cl)nc4[nH]cnc43)C2)C1 ZINC001164779483 721347890 /nfs/dbraw/zinc/34/78/90/721347890.db2.gz UGIMYDPJJVFUKA-NRFANRHFSA-N 1 1 430.940 3.335 20 0 IGADMO O=C(c1cc(Cl)nc(N2C[C@H]3C[NH+](Cc4nccs4)C[C@@H]3C2)c1)N1CCCCC1 ZINC001164781634 721398056 /nfs/dbraw/zinc/39/80/56/721398056.db2.gz CIOHDZPVBQLDHM-IAGOWNOFSA-N 1 1 431.993 3.386 20 0 IGADMO O=C(c1cc(Cl)nc(N2C[C@@H]3C[NH+](Cc4nccs4)C[C@H]3C2)c1)N1CCCCC1 ZINC001164781636 721398525 /nfs/dbraw/zinc/39/85/25/721398525.db2.gz CIOHDZPVBQLDHM-IRXDYDNUSA-N 1 1 431.993 3.386 20 0 IGADMO Fc1ccc(Oc2nc(Cl)nc(N3C[C@@H]4C[N@@H+](Cc5nccs5)C[C@@H]4C3)n2)cc1 ZINC001164787153 721417154 /nfs/dbraw/zinc/41/71/54/721417154.db2.gz PIEZHHTZJSKHTG-BETUJISGSA-N 1 1 432.912 3.481 20 0 IGADMO Fc1ccc(Oc2nc(Cl)nc(N3C[C@@H]4C[N@H+](Cc5nccs5)C[C@@H]4C3)n2)cc1 ZINC001164787153 721417155 /nfs/dbraw/zinc/41/71/55/721417155.db2.gz PIEZHHTZJSKHTG-BETUJISGSA-N 1 1 432.912 3.481 20 0 IGADMO COc1ccc(C(F)(F)N2CC[C@@]3(C2)CCC[C@@H](CN2CC[NH+](C)CC2)O3)nc1Cl ZINC001164887737 721418147 /nfs/dbraw/zinc/41/81/47/721418147.db2.gz MWDPGDXEWJYCPB-OXJNMPFZSA-N 1 1 444.954 3.054 20 0 IGADMO C[NH+]1CCN(C[C@H]2CCC[C@@]3(CCN(c4cccc(OCc5ccccc5)n4)C3)O2)CC1 ZINC001164896718 721426120 /nfs/dbraw/zinc/42/61/20/721426120.db2.gz RVTCWMCKPRXVDE-BVAGGSTKSA-N 1 1 436.600 3.426 20 0 IGADMO O=C(c1cnc(N2C[C@H]3C[NH+](Cc4nccs4)C[C@@H]3C2)c(Cl)c1)N1CCCCC1 ZINC001164782549 721428851 /nfs/dbraw/zinc/42/88/51/721428851.db2.gz GPPKFZPRNHRRLM-IAGOWNOFSA-N 1 1 431.993 3.386 20 0 IGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1nc(Cl)nc3c1ccn3C)CC2 ZINC001164786373 721455664 /nfs/dbraw/zinc/45/56/64/721455664.db2.gz MGUPSTPMIHOPPP-GOSISDBHSA-N 1 1 448.011 3.356 20 0 IGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1nc3ccccc3c(OC)n1)CC2 ZINC001164785743 721461758 /nfs/dbraw/zinc/46/17/58/721461758.db2.gz NGAAMHPHNLSLBT-HXUWFJFHSA-N 1 1 440.588 3.372 20 0 IGADMO CCN(CC)c1cc(N2CCC3(C[C@@H](COCC4CC4)[N@@H+](CCOC)C3)CC2)ncn1 ZINC001164786827 721463649 /nfs/dbraw/zinc/46/36/49/721463649.db2.gz PQQLEVRBKJJNIY-NRFANRHFSA-N 1 1 431.625 3.057 20 0 IGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1nnc(OC)c3ccccc31)CC2 ZINC001164791687 721466192 /nfs/dbraw/zinc/46/61/92/721466192.db2.gz XOTWCCLMJJTIPR-FQEVSTJZSA-N 1 1 440.588 3.372 20 0 IGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1ncccc1-c1nc(C)no1)CC2 ZINC001164790687 721467317 /nfs/dbraw/zinc/46/73/17/721467317.db2.gz UVLWJPCYLLOELH-FQEVSTJZSA-N 1 1 441.576 3.174 20 0 IGADMO CCC[N@H+]1CCCC[C@@H]1c1ccc(N2CC[C@@H]3OCC[C@@H](C(=O)N4CCCO4)[C@H]3C2)nc1 ZINC001164789698 721483152 /nfs/dbraw/zinc/48/31/52/721483152.db2.gz BPTUHFSZPQPNCC-ODAXIHTASA-N 1 1 442.604 3.414 20 0 IGADMO CCC[N@H+]1CCCC[C@@H]1c1ccc(N2CC[C@@H]3OCC[C@H](C(=O)N4CCCO4)[C@H]3C2)nc1 ZINC001164789170 721483235 /nfs/dbraw/zinc/48/32/35/721483235.db2.gz BPTUHFSZPQPNCC-AFXVXQJMSA-N 1 1 442.604 3.414 20 0 IGADMO CCOC(=O)c1cnc(C2CC2)nc1N1CC[N@H+]2C[C@H](Oc3cccc(F)c3)C[C@@H]2C1 ZINC001164908262 721533738 /nfs/dbraw/zinc/53/37/38/721533738.db2.gz PPABFFFXUPWEFZ-IEBWSBKVSA-N 1 1 426.492 3.012 20 0 IGADMO COc1cc2nc(C)nc(N3C[C@H]([N@@H+](C)Cc4cccnc4)[C@@H]4OCCC[C@@H]43)c2cc1OC ZINC001164810520 721555761 /nfs/dbraw/zinc/55/57/61/721555761.db2.gz YQQJXZFHXJTLTI-AWRGLXIESA-N 1 1 449.555 3.219 20 0 IGADMO Fc1cccc(O[C@H]2C[C@H]3CN(c4nc(Cl)nc5c(Cl)ncnc54)CC[N@H+]3C2)c1 ZINC001164911072 721561649 /nfs/dbraw/zinc/56/16/49/721561649.db2.gz YHFGKRWYOMIASH-JSGCOSHPSA-N 1 1 435.290 3.208 20 0 IGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2cnc(OCc3ccccc3)cn2)[C@H]2CCCO[C@H]12 ZINC001164805631 721569404 /nfs/dbraw/zinc/56/94/04/721569404.db2.gz OGEPOMVLUUYTOD-FBLLAGFSSA-N 1 1 431.540 3.319 20 0 IGADMO CCOC(=O)c1nc(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@H]3OCCC[C@H]32)ccc1Cl ZINC001164800251 721571017 /nfs/dbraw/zinc/57/10/17/721571017.db2.gz DLHHBEPJUWUWEV-LQWHRVPQSA-N 1 1 430.936 3.175 20 0 IGADMO CCc1cc2c(nc(Cl)nc2N2C[C@H]([N@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@H]32)[nH]1 ZINC001164806049 721572730 /nfs/dbraw/zinc/57/27/30/721572730.db2.gz PFJQCNXTRFULHT-CEXWTWQISA-N 1 1 426.952 3.437 20 0 IGADMO CCc1cc2c(nc(Cl)nc2N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@H]32)[nH]1 ZINC001164806049 721572734 /nfs/dbraw/zinc/57/27/34/721572734.db2.gz PFJQCNXTRFULHT-CEXWTWQISA-N 1 1 426.952 3.437 20 0 IGADMO COc1ccccc1-c1ccc(N2C[C@H]([N@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@H]32)nn1 ZINC001164808939 721578507 /nfs/dbraw/zinc/57/85/07/721578507.db2.gz RVKCMTDUHRVIII-OTNCWRBYSA-N 1 1 431.540 3.415 20 0 IGADMO COc1ccccc1-c1ccc(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@H]32)nn1 ZINC001164808939 721578510 /nfs/dbraw/zinc/57/85/10/721578510.db2.gz RVKCMTDUHRVIII-OTNCWRBYSA-N 1 1 431.540 3.415 20 0 IGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(C(F)(F)c2c3c(nnc2Cl)CCC3)[C@H]2CCCO[C@@H]12 ZINC001164807647 721580266 /nfs/dbraw/zinc/58/02/66/721580266.db2.gz PBSUMZRQPUKOEA-NLWGTHIKSA-N 1 1 449.933 3.427 20 0 IGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(C(F)(F)c2c3c(nnc2Cl)CCC3)[C@H]2CCCO[C@@H]12 ZINC001164807647 721580267 /nfs/dbraw/zinc/58/02/67/721580267.db2.gz PBSUMZRQPUKOEA-NLWGTHIKSA-N 1 1 449.933 3.427 20 0 IGADMO CCCSc1ncnc(N2C[C@H]([N@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@@H]32)c1OC ZINC001164810816 721590411 /nfs/dbraw/zinc/59/04/11/721590411.db2.gz WGKVDRDBXXESOX-GBESFXJTSA-N 1 1 429.590 3.251 20 0 IGADMO CCCSc1ncnc(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@@H]32)c1OC ZINC001164810816 721590413 /nfs/dbraw/zinc/59/04/13/721590413.db2.gz WGKVDRDBXXESOX-GBESFXJTSA-N 1 1 429.590 3.251 20 0 IGADMO CCOc1ccc(C(=O)OC)c(N2CCC(F)(F)[C@]3(CC[N@@H+](Cc4ccccn4)C3)C2)n1 ZINC001164904806 721710818 /nfs/dbraw/zinc/71/08/18/721710818.db2.gz DEYXKECBQJDBGK-QFIPXVFZSA-N 1 1 446.498 3.400 20 0 IGADMO Cc1cn(-c2ccc(N3CCC(F)(F)[C@@]4(CC[N@@H+](Cc5ccccn5)C4)C3)nn2)cn1 ZINC001164906499 721715055 /nfs/dbraw/zinc/71/50/55/721715055.db2.gz MJIZZYODMMQCGO-OAQYLSRUSA-N 1 1 425.487 3.103 20 0 IGADMO FC1(F)CCN(c2cccc(N3CCOCC3)n2)C[C@]12CC[N@H+](Cc1ccccn1)C2 ZINC001164905579 721718068 /nfs/dbraw/zinc/71/80/68/721718068.db2.gz HUFBWCFAOKQMNV-JOCHJYFZSA-N 1 1 429.515 3.051 20 0 IGADMO FC1(F)CCN(c2cccc(N3CCOCC3)n2)C[C@]12CC[N@@H+](Cc1ccccn1)C2 ZINC001164905579 721718085 /nfs/dbraw/zinc/71/80/85/721718085.db2.gz HUFBWCFAOKQMNV-JOCHJYFZSA-N 1 1 429.515 3.051 20 0 IGADMO CN(C)C(=O)C[NH+]1CCC2(CCCN2C(F)(F)c2cc(C3CC3)nnc2Cl)CC1 ZINC001165010951 721745674 /nfs/dbraw/zinc/74/56/74/721745674.db2.gz RATNNAHJEPJCOD-UHFFFAOYSA-N 1 1 427.927 3.075 20 0 IGADMO O=C1[C@@H]2CN(c3ccc4c(n3)CC[N@H+](Cc3ccccc3)C4)C[C@H]2CN1c1cccnc1 ZINC001165024874 721790167 /nfs/dbraw/zinc/79/01/67/721790167.db2.gz UDHSTBBRASRLDA-JTHBVZDNSA-N 1 1 425.536 3.134 20 0 IGADMO Cc1c[nH]c2nc(Cl)cc(N3CCO[C@]4(C3)COCC[N@H+](Cc3cccnc3)C4)c12 ZINC001164914334 721793475 /nfs/dbraw/zinc/79/34/75/721793475.db2.gz LYHAFLCTEQSLKZ-JOCHJYFZSA-N 1 1 427.936 3.028 20 0 IGADMO Cc1c[nH]c2nc(Cl)cc(N3CCO[C@]4(C3)COCC[N@@H+](Cc3cccnc3)C4)c12 ZINC001164914334 721793477 /nfs/dbraw/zinc/79/34/77/721793477.db2.gz LYHAFLCTEQSLKZ-JOCHJYFZSA-N 1 1 427.936 3.028 20 0 IGADMO COC(=O)c1cc2c(OC)[nH]c(N3C[C@@H]4CCC[C@H]([N@@H+](C)Cc5ccccn5)[C@H]4C3)cc-2n1 ZINC001165027084 721811277 /nfs/dbraw/zinc/81/12/77/721811277.db2.gz SARAZBPAYUIDJS-BPXKWBHBSA-N 1 1 449.555 3.490 20 0 IGADMO C[NH+]1CCC(Oc2ccnc(N3CCO[C@H]4[C@H]3CC[C@H]4COCc3nccs3)c2)CC1 ZINC001164918643 721811575 /nfs/dbraw/zinc/81/15/75/721811575.db2.gz SKQLEPVJXVRSSB-XTQVGHSUSA-N 1 1 444.601 3.212 20 0 IGADMO C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@H]2CN(c3ccc(C(=O)NC4CCCC4)nn3)C[C@H]21 ZINC001165023125 721827107 /nfs/dbraw/zinc/82/71/07/721827107.db2.gz HSJDWKKMXIHFMT-QTGUNEKASA-N 1 1 434.588 3.281 20 0 IGADMO CCCNC(=O)c1cc(Cl)nc(N2C[C@@H]3CCC[C@@H]([N@@H+](C)Cc4ccccn4)[C@@H]3C2)n1 ZINC001165021379 721832134 /nfs/dbraw/zinc/83/21/34/721832134.db2.gz FFMCCOGIJWUYJH-ILZDJORESA-N 1 1 442.995 3.402 20 0 IGADMO Clc1ccc(C[NH+]2CCCC2)c(N2C[C@H]3COC[C@@]3(COCc3ccccn3)C2)n1 ZINC001164922156 721839198 /nfs/dbraw/zinc/83/91/98/721839198.db2.gz FWBSGUVUGNMNSC-WMZHIEFXSA-N 1 1 428.964 3.395 20 0 IGADMO COc1cccc(OC)c1CN1CCC(N(C)c2nccc(C3CC[NH2+]CC3)n2)CC1 ZINC001165021233 721842647 /nfs/dbraw/zinc/84/26/47/721842647.db2.gz ITQGYYXHRBEACU-UHFFFAOYSA-N 1 1 425.577 3.062 20 0 IGADMO CCOC(=O)c1ncnc(Cl)c1N(C)C1CC[NH+](Cc2c(OC)cccc2OC)CC1 ZINC001165022758 721843041 /nfs/dbraw/zinc/84/30/41/721843041.db2.gz UECDUSMWJBEIFM-UHFFFAOYSA-N 1 1 448.951 3.425 20 0 IGADMO c1ccc(OCC[NH+]2CCN(c3nccc(-c4cnc(N5CCCCC5)nc4)n3)CC2)cc1 ZINC001165044285 721957151 /nfs/dbraw/zinc/95/71/51/721957151.db2.gz KYAGFWSHXBGQMR-UHFFFAOYSA-N 1 1 445.571 3.125 20 0 IGADMO O=C1NCCc2[nH]c(-c3ccnc(N4CCC5(CC[N@@H+](Cc6cccnc6)C5)CC4)c3)cc21 ZINC001164951760 722016914 /nfs/dbraw/zinc/01/69/14/722016914.db2.gz DHUCUGCXQLCZFE-UHFFFAOYSA-N 1 1 442.567 3.250 20 0 IGADMO O=C(NCc1cccnc1)[C@H]1C[C@@]12CCN(c1nc(Cl)ccc1C[NH+]1CCCC1)C2 ZINC001164961462 722033863 /nfs/dbraw/zinc/03/38/63/722033863.db2.gz VVGGIEMDLKWHKO-AUSIDOKSSA-N 1 1 425.964 3.259 20 0 IGADMO COc1cc2ncnc(N3CCC4(CC3)COCC[N@@H+](Cc3ccncc3)C4)c2cc1OC ZINC001164958085 722053629 /nfs/dbraw/zinc/05/36/29/722053629.db2.gz BTJZLRRXLAYSRS-UHFFFAOYSA-N 1 1 449.555 3.161 20 0 IGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2CC[C@@H]3[C@H](C[C@H](Cn4cccn4)N3C(C)=O)C2)nc1 ZINC001164968973 722081217 /nfs/dbraw/zinc/08/12/17/722081217.db2.gz GVKJPSOITKGCJC-MOUTVQLLSA-N 1 1 436.604 3.341 20 0 IGADMO CC[NH+](CC)Cc1nc2sc(C)c(C)c2c(N2CCO[C@@]3(CCCN(C(C)=O)C3)C2)n1 ZINC001164969026 722083857 /nfs/dbraw/zinc/08/38/57/722083857.db2.gz JKWUCLWTEHOSQD-HSZRJFAPSA-N 1 1 445.633 3.368 20 0 IGADMO O=C(NC1CCC1)C1C[C@H]2CN(c3ncnc4c3CC[N@H+](Cc3ccccc3)C4)C[C@@H]2C1 ZINC001164978328 722084879 /nfs/dbraw/zinc/08/48/79/722084879.db2.gz YSPBKVIEVFHXQN-SFTDATJTSA-N 1 1 431.584 3.166 20 0 IGADMO O=C(NC1CCC1)C1C[C@H]2CN(c3ncnc4c3CC[N@@H+](Cc3ccccc3)C4)C[C@@H]2C1 ZINC001164978328 722084880 /nfs/dbraw/zinc/08/48/80/722084880.db2.gz YSPBKVIEVFHXQN-SFTDATJTSA-N 1 1 431.584 3.166 20 0 IGADMO CCOC(=O)c1cnc(Cl)cc1N1CC[C@H]2C[N@@H+](Cc3cccnc3)CCO[C@H]2C1 ZINC001164974653 722099896 /nfs/dbraw/zinc/09/98/96/722099896.db2.gz BFJGDAKKSSMEGS-PXNSSMCTSA-N 1 1 430.936 3.034 20 0 IGADMO Clc1nc2c(c(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)n1)CSCC2 ZINC001164979988 722104248 /nfs/dbraw/zinc/10/42/48/722104248.db2.gz IQNNPOPKMBPNFO-APWZRJJASA-N 1 1 431.993 3.042 20 0 IGADMO COc1cccc2c1nc(Cl)nc2N1CC[C@@H]2C[N@@H+](Cc3cccnc3)CCO[C@H]2C1 ZINC001164972534 722116203 /nfs/dbraw/zinc/11/62/03/722116203.db2.gz FYCXZNWDCOWFQO-XLIONFOSSA-N 1 1 439.947 3.414 20 0 IGADMO COc1cc2ccnc(N3CC[C@H]4C[N@H+](Cc5cccnc5)CCO[C@@H]4C3)c2cc1OC ZINC001164980559 722121933 /nfs/dbraw/zinc/12/19/33/722121933.db2.gz RVMYKNUHCLZGSO-GBXCKJPGSA-N 1 1 434.540 3.374 20 0 IGADMO COc1cc2ccnc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)c2cc1OC ZINC001164980559 722121940 /nfs/dbraw/zinc/12/19/40/722121940.db2.gz RVMYKNUHCLZGSO-GBXCKJPGSA-N 1 1 434.540 3.374 20 0 IGADMO COc1ccc(C(F)(F)N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)nc1Cl ZINC001164975587 722124923 /nfs/dbraw/zinc/12/49/23/722124923.db2.gz JXCZLSNJWSIGIU-SJLPKXTDSA-N 1 1 438.906 3.411 20 0 IGADMO COc1cccc(Oc2cncc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)n2)c1 ZINC001164977101 722131498 /nfs/dbraw/zinc/13/14/98/722131498.db2.gz ITAUVXURQIRPFN-NFBKMPQASA-N 1 1 447.539 3.400 20 0 IGADMO COc1cc2cnc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)cc2cc1OC ZINC001164983281 722145671 /nfs/dbraw/zinc/14/56/71/722145671.db2.gz SXSGLYYWXCSRGD-NTKDMRAZSA-N 1 1 434.540 3.374 20 0 IGADMO Cc1nc(-c2ccccn2)nc(N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)c1C ZINC001164978048 722148888 /nfs/dbraw/zinc/14/88/88/722148888.db2.gz JKDPXASXFDJEQS-FYYLOGMGSA-N 1 1 430.556 3.278 20 0 IGADMO COC(=O)c1cccc2nc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)ccc21 ZINC001164977095 722149447 /nfs/dbraw/zinc/14/94/47/722149447.db2.gz ISHDQROOVMDSNJ-AUSIDOKSSA-N 1 1 432.524 3.144 20 0 IGADMO Fc1ccc2c(c1)[nH]c1ncnc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)c21 ZINC001164971057 722158460 /nfs/dbraw/zinc/15/84/60/722158460.db2.gz ACBHSUXZBADJME-DYESRHJHSA-N 1 1 432.503 3.373 20 0 IGADMO Cc1nc(CN2CCO[C@H]3CCN(c4nc(NCC5CC5)c(C)c[nH+]4)CC[C@@H]32)cs1 ZINC001164988418 722173475 /nfs/dbraw/zinc/17/34/75/722173475.db2.gz QVUGMDHECNEGSN-PMACEKPBSA-N 1 1 428.606 3.242 20 0 IGADMO Cc1nc(CN2CCO[C@@H]3CCN(c4nc(N5CCCCC5)cc[nH+]4)CC[C@@H]32)cs1 ZINC001164987158 722184019 /nfs/dbraw/zinc/18/40/19/722184019.db2.gz GWLHHMBEZOUECV-VQTJNVASSA-N 1 1 428.606 3.102 20 0 IGADMO Cc1nc(CN2CCO[C@@H]3CCN(c4nc(N5CCCCC5)cc[nH+]4)CC[C@H]32)cs1 ZINC001164987159 722184051 /nfs/dbraw/zinc/18/40/51/722184051.db2.gz GWLHHMBEZOUECV-WOJBJXKFSA-N 1 1 428.606 3.102 20 0 IGADMO Cc1nc(CN2CCO[C@@H]3CCN(c4ccc(C[N@H+](C)C5CC5)cn4)CC[C@H]32)cs1 ZINC001164992988 722185690 /nfs/dbraw/zinc/18/56/90/722185690.db2.gz YMUIUHIXOQGNQH-FGZHOGPDSA-N 1 1 427.618 3.311 20 0 IGADMO C[NH+]1CCN(c2ncnc3c2CCN(c2c(Cl)ncc(Cl)c2Cl)CC3)CC1 ZINC001164997545 722233873 /nfs/dbraw/zinc/23/38/73/722233873.db2.gz PEBVEVASCHFDBU-UHFFFAOYSA-N 1 1 427.767 3.189 20 0 IGADMO C[NH+]1CCN(c2ncnc3c2CCN(c2cc(C(C)(C)C)nc(C(C)(C)C)n2)CC3)CC1 ZINC001165002773 722237089 /nfs/dbraw/zinc/23/70/89/722237089.db2.gz YQJYMMADUQSJRH-UHFFFAOYSA-N 1 1 437.636 3.219 20 0 IGADMO C[NH+]1CCN(c2ncnc3c2CCN(c2cc(Cl)nc4c(F)ccc(F)c24)CC3)CC1 ZINC001165005497 722240394 /nfs/dbraw/zinc/24/03/94/722240394.db2.gz TVYFMKNQUCANND-UHFFFAOYSA-N 1 1 444.917 3.313 20 0 IGADMO Cc1ccc(NC[C@H]2CO[C@@]3(C2)COCC[N@@H+](C(C)(C)c2ccnc(Cl)c2)C3)nn1 ZINC001164636759 719266937 /nfs/dbraw/zinc/26/69/37/719266937.db2.gz JZFAHVZIANLTBX-HTAPYJJXSA-N 1 1 431.968 3.288 20 0 IGADMO Cc1ccc(NC[C@H]2CO[C@@]3(C2)COCC[N@H+](C(C)(C)c2ccnc(Cl)c2)C3)nn1 ZINC001164636759 719266943 /nfs/dbraw/zinc/26/69/43/719266943.db2.gz JZFAHVZIANLTBX-HTAPYJJXSA-N 1 1 431.968 3.288 20 0 IGADMO O=C1CCCN1[C@@H]1CN(c2ccc3c(n2)CC[N@H+](Cc2ccccc2)C3)C[C@H]2CCCO[C@@H]21 ZINC001164656902 719303122 /nfs/dbraw/zinc/30/31/22/719303122.db2.gz ZFCISXRNSWURBE-GYZWWNDVSA-N 1 1 446.595 3.246 20 0 IGADMO Cc1nc2c(cc(-c3nc(N4C[C@@H]5OCC[N@@H+](C)[C@H]5C4)ncc3F)cc2F)n1C(C)C ZINC001164670238 719393863 /nfs/dbraw/zinc/39/38/63/719393863.db2.gz WIDSUCVLAKHECG-OALUTQOASA-N 1 1 428.487 3.180 20 0 IGADMO C[N@H+]1CCO[C@@H]2CN(c3nc(CN4CCCCC4)nc4sc5c(c43)CCCC5)C[C@H]21 ZINC001164675183 719441761 /nfs/dbraw/zinc/44/17/61/719441761.db2.gz ZMXNDFCLNPVMDT-QZTJIDSGSA-N 1 1 427.618 3.075 20 0 IGADMO C[C@@H]1CCc2c(sc3nc(CN4CCCCC4)nc(N4C[C@H]5OCC[N@@H+](C)[C@@H]5C4)c23)C1 ZINC001164667890 719443961 /nfs/dbraw/zinc/44/39/61/719443961.db2.gz IEABGVWDSJKXAJ-BHIYHBOVSA-N 1 1 441.645 3.321 20 0 IGADMO O=C([C@@H]1C[C@@H]2OCC[C@H]2N(c2ccc3c(n2)CC[N@H+](Cc2ccccc2)C3)C1)N1CCCC1 ZINC001164679226 719537690 /nfs/dbraw/zinc/53/76/90/719537690.db2.gz VZRPZQMEOQLXMD-GPXOXTDOSA-N 1 1 446.595 3.246 20 0 IGADMO CNC(=O)C[N@H+]1CCCC12CCN(C(F)(F)c1ccc([Si](C)(C)C)c(Cl)n1)CC2 ZINC001164684595 719732503 /nfs/dbraw/zinc/73/25/03/719732503.db2.gz IJUAIUFZYRGXIR-UHFFFAOYSA-N 1 1 445.030 3.006 20 0 IGADMO Cc1nc(C[N@H+]2CCCC23CCN(c2c(Cl)nc(Cl)nc2C(N)=O)CC3)cs1 ZINC001164693108 719809764 /nfs/dbraw/zinc/80/97/64/719809764.db2.gz QHFGZMOYXIXRHS-UHFFFAOYSA-N 1 1 441.388 3.282 20 0 IGADMO COC(=O)[C@]1(C)C[C@@H]([NH+]2CCOCC2)CCN1c1cc(Cl)nnc1-c1ccccc1 ZINC001164701930 719855112 /nfs/dbraw/zinc/85/51/12/719855112.db2.gz MCBVIQGKWPQHGE-JTSKRJEESA-N 1 1 430.936 3.030 20 0 IGADMO COC(=O)[C@]1(C)C[C@H]([NH+]2CCOCC2)CCN1c1nc(N2CCCC2)cc2ccccc21 ZINC001164707614 719870746 /nfs/dbraw/zinc/87/07/46/719870746.db2.gz UKCDDEZOXQBLLI-NLFFAJNJSA-N 1 1 438.572 3.068 20 0 IGADMO COC(=O)[C@]1(C)C[C@@H]([NH+]2CCOCC2)CCN1c1nc(N2CCCC2)cc2ccccc21 ZINC001164707612 719870914 /nfs/dbraw/zinc/87/09/14/719870914.db2.gz UKCDDEZOXQBLLI-CPJSRVTESA-N 1 1 438.572 3.068 20 0 IGADMO O=C(c1cccnc1N1CCC2(CC1)C[N@@H+](Cc1cccs1)CCO2)N1CCCC1 ZINC001164702797 719885969 /nfs/dbraw/zinc/88/59/69/719885969.db2.gz QKSOCGQGDLUKDE-UHFFFAOYSA-N 1 1 426.586 3.251 20 0 IGADMO c1csc(C[N@H+]2CCOC3(CCN(c4ncnc5cc6c(cc54)OCCO6)CC3)C2)c1 ZINC001164696121 719888006 /nfs/dbraw/zinc/88/80/06/719888006.db2.gz YFHWBMIVLIANBV-UHFFFAOYSA-N 1 1 438.553 3.334 20 0 IGADMO CCOC(=O)c1cc(Cl)nnc1N1CCC2(CC1)C[N@H+](Cc1cccs1)CCO2 ZINC001164695302 719889191 /nfs/dbraw/zinc/88/91/91/719889191.db2.gz MIDBHMMRCAKWIB-UHFFFAOYSA-N 1 1 436.965 3.240 20 0 IGADMO CCOC(=O)c1cc(Cl)nnc1N1CCC2(CC1)C[N@@H+](Cc1cccs1)CCO2 ZINC001164695302 719889192 /nfs/dbraw/zinc/88/91/92/719889192.db2.gz MIDBHMMRCAKWIB-UHFFFAOYSA-N 1 1 436.965 3.240 20 0 IGADMO COC(=O)c1cc2ccncc2nc1N1CCC2(CC1)C[N@@H+](Cc1cccs1)CCO2 ZINC001164697693 719893752 /nfs/dbraw/zinc/89/37/52/719893752.db2.gz NSDZMEKILGHMOQ-UHFFFAOYSA-N 1 1 438.553 3.349 20 0 IGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1ncnc3c1CN(Cc1ccccc1)CC3)C2 ZINC001164812330 720082981 /nfs/dbraw/zinc/08/29/81/720082981.db2.gz QPKQWOZEHXLTPE-HOFKKMOUSA-N 1 1 447.627 3.220 20 0 IGADMO COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1nc(Cl)nc3c1COC3)CC2 ZINC001164718012 720107436 /nfs/dbraw/zinc/10/74/36/720107436.db2.gz QBDJMXXAFSTRLU-KRWDZBQOSA-N 1 1 429.952 3.063 20 0 IGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1nc(Cl)nc3cc(C(=O)OC)ccc31)C2 ZINC001164813825 720119226 /nfs/dbraw/zinc/11/92/26/720119226.db2.gz RBNWMQOZFWSADZ-GAJHUEQPSA-N 1 1 444.963 3.255 20 0 IGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(C(F)(F)c1ccc3ncnc(Cl)c3n1)C2 ZINC001164815510 720135215 /nfs/dbraw/zinc/13/52/15/720135215.db2.gz WCQCQXVWFGJCTO-MGPUTAFESA-N 1 1 437.922 3.408 20 0 IGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(C(F)(F)c1ccc3ncnc(Cl)c3n1)C2 ZINC001164815509 720135357 /nfs/dbraw/zinc/13/53/57/720135357.db2.gz WCQCQXVWFGJCTO-FOIQADDNSA-N 1 1 437.922 3.408 20 0 IGADMO COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1cc(-c3ccccn3)ncn1)CC2 ZINC001164714788 720144435 /nfs/dbraw/zinc/14/44/35/720144435.db2.gz ZBXCSYVEMBEOGV-NRFANRHFSA-N 1 1 430.556 3.441 20 0 IGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(C(F)(F)c1cc(Cl)ncc1C(=O)OC)C2 ZINC001164812417 720165299 /nfs/dbraw/zinc/16/52/99/720165299.db2.gz AMSKCXBCXLMONE-FOIQADDNSA-N 1 1 443.922 3.251 20 0 IGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1ncccc1C(=O)N1CCC(C)CC1)C2 ZINC001164820270 720166727 /nfs/dbraw/zinc/16/67/27/720166727.db2.gz ZWBPIVUNYPJRPD-SQJMNOBHSA-N 1 1 426.605 3.138 20 0 IGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(C(F)(F)c1c3c(nnc1Cl)CCC3)C2 ZINC001164817150 720172653 /nfs/dbraw/zinc/17/26/53/720172653.db2.gz OGILFIGBAYVNKP-MGPUTAFESA-N 1 1 426.939 3.348 20 0 IGADMO CC(C)[N@@H+](C)Cc1cc(=O)n2c(n1)CN(C(F)(F)c1nc(Cl)ncc1Cl)CCC2 ZINC001164810776 720215797 /nfs/dbraw/zinc/21/57/97/720215797.db2.gz CPDXIEYKEJVMIJ-UHFFFAOYSA-N 1 1 447.317 3.136 20 0 IGADMO Cc1cc(OCc2ccccc2)nc(N2CCCn3c(=O)cc(C[N@H+](C)C(C)C)nc3C2)n1 ZINC001164816106 720242513 /nfs/dbraw/zinc/24/25/13/720242513.db2.gz GROMEIOJZVHALY-UHFFFAOYSA-N 1 1 448.571 3.171 20 0 IGADMO CCOC(=O)c1c2ccccn2c2ncnc(N3CC[C@H]4[C@H]3CC[N@H+]4Cc3cccnc3)c12 ZINC001164721744 720331346 /nfs/dbraw/zinc/33/13/46/720331346.db2.gz DGRDENDXLMIEGJ-RBUKOAKNSA-N 1 1 442.523 3.307 20 0 IGADMO Cc1cc2nc(N3CC[C@H]4[C@H]3CC[N@H+]4Cc3cccnc3)nc(N3CCOCC3)c2s1 ZINC001164731005 720403008 /nfs/dbraw/zinc/40/30/08/720403008.db2.gz XWNIZTIDFGFTLJ-VQTJNVASSA-N 1 1 436.585 3.085 20 0 IGADMO c1ccc(N2CCN(c3cc(N4CC[C@@H]5[C@@H]4CC[N@@H+]5Cc4cccnc4)ncn3)CC2)cc1 ZINC001164730087 720460179 /nfs/dbraw/zinc/46/01/79/720460179.db2.gz HQQCJQFGVPEYCW-RPWUZVMVSA-N 1 1 441.583 3.051 20 0 IGADMO COc1ccc(-c2ccc(N3CC[C@H]4[C@@H]3CC[N@H+]4Cc3cccnc3)nn2)c(OC)c1OC ZINC001164728904 720466457 /nfs/dbraw/zinc/46/64/57/720466457.db2.gz PKDWRFZMYCYYMD-SFTDATJTSA-N 1 1 447.539 3.418 20 0 IGADMO CC(C)[N@@H+]1[C@@H]2CCN(c3cc(NC(=O)OC(C)(C)C)ncn3)C[C@H]2C[C@H]1Cn1cccn1 ZINC001164834586 720519074 /nfs/dbraw/zinc/51/90/74/720519074.db2.gz GPGVQAGBWXKNST-CEXWTWQISA-N 1 1 441.580 3.398 20 0 IGADMO CC(C)[N@@H+]1[C@@H]2CCN(c3ccnc(NC(=O)OC(C)(C)C)n3)C[C@@H]2C[C@H]1Cn1cccn1 ZINC001164838467 720527239 /nfs/dbraw/zinc/52/72/39/720527239.db2.gz RHZJSMIPJOCKGX-GBESFXJTSA-N 1 1 441.580 3.398 20 0 IGADMO CC(C)[N@@H+]1[C@@H]2CCN(c3ccnc(NC(=O)OC(C)(C)C)n3)C[C@H]2C[C@H]1Cn1cccn1 ZINC001164838463 720527437 /nfs/dbraw/zinc/52/74/37/720527437.db2.gz RHZJSMIPJOCKGX-CEXWTWQISA-N 1 1 441.580 3.398 20 0 IGADMO CCOC(=O)c1cc2ccnc(N3CC[C@@H]4[C@@H](C[C@H](Cn5cccn5)[N@H+]4C(C)C)C3)c2[nH]1 ZINC001164836788 720531700 /nfs/dbraw/zinc/53/17/00/720531700.db2.gz KXDUGLAXWZFBCM-QKNQBKEWSA-N 1 1 436.560 3.314 20 0 IGADMO COc1cc2ncnc(N3CC[C@@H]4[C@@H](C[C@H](Cn5cccn5)[N@H+]4C(C)C)C3)c2c(OC)c1 ZINC001164842930 720553958 /nfs/dbraw/zinc/55/39/58/720553958.db2.gz YZUFYLYXXABRMR-WAOWUJCRSA-N 1 1 436.560 3.221 20 0 IGADMO CCOC(=O)c1cc2ccc(N3CC[C@@H]4[C@@H](C[C@H](Cn5cccn5)[N@H+]4C(C)C)C3)[nH]c-2n1 ZINC001164840141 720572955 /nfs/dbraw/zinc/57/29/55/720572955.db2.gz RTSPFWZUXJTEIE-QKNQBKEWSA-N 1 1 436.560 3.314 20 0 IGADMO CCOC(=O)c1cc2ccc(N3CC[C@@H]4[C@@H](C[C@H](Cn5cccn5)[N@@H+]4C(C)C)C3)nc2[nH]1 ZINC001164840141 720572969 /nfs/dbraw/zinc/57/29/69/720572969.db2.gz RTSPFWZUXJTEIE-QKNQBKEWSA-N 1 1 436.560 3.314 20 0 IGADMO CCOC(=O)c1cc2ccc(N3CC[C@@H]4[C@@H](C[C@H](Cn5cccn5)[N@H+]4C(C)C)C3)nc2[nH]1 ZINC001164840141 720572976 /nfs/dbraw/zinc/57/29/76/720572976.db2.gz RTSPFWZUXJTEIE-QKNQBKEWSA-N 1 1 436.560 3.314 20 0 IGADMO CCOC(=O)c1cc2ccc(N3CC[C@@H]4[C@@H](C[C@@H](Cn5cccn5)[N@H+]4C(C)C)C3)[nH]c-2n1 ZINC001164840139 720573292 /nfs/dbraw/zinc/57/32/92/720573292.db2.gz RTSPFWZUXJTEIE-IRFCIJBXSA-N 1 1 436.560 3.314 20 0 IGADMO CCOC(=O)c1cc2ccc(N3CC[C@@H]4[C@@H](C[C@@H](Cn5cccn5)[N@@H+]4C(C)C)C3)nc2[nH]1 ZINC001164840139 720573306 /nfs/dbraw/zinc/57/33/06/720573306.db2.gz RTSPFWZUXJTEIE-IRFCIJBXSA-N 1 1 436.560 3.314 20 0 IGADMO CCOC(=O)c1cc2ccc(N3CC[C@@H]4[C@@H](C[C@@H](Cn5cccn5)[N@H+]4C(C)C)C3)nc2[nH]1 ZINC001164840139 720573320 /nfs/dbraw/zinc/57/33/20/720573320.db2.gz RTSPFWZUXJTEIE-IRFCIJBXSA-N 1 1 436.560 3.314 20 0 IGADMO COC(=O)c1c(Cl)cnc(N2CC[C@@H]3[C@H](C[C@@H](Cn4cccn4)[N@H+]3C(C)C)C2)c1OC ZINC001164843106 720587260 /nfs/dbraw/zinc/58/72/60/720587260.db2.gz WJAXPIIAZGRQGW-SOLBZPMBSA-N 1 1 447.967 3.105 20 0 IGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@H]2CN(C(F)(F)COc3cncc(Cl)n3)CC[C@@H]21 ZINC001164844166 720610832 /nfs/dbraw/zinc/61/08/32/720610832.db2.gz ZNSYKAIUXXPPHV-ULQDDVLXSA-N 1 1 440.926 3.172 20 0 IGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@H]2CN(c3ncc(C(=O)N(C)C)cc3Cl)CC[C@@H]21 ZINC001164839246 720611736 /nfs/dbraw/zinc/61/17/36/720611736.db2.gz MWFMJUANGCTMEV-BJLQDIEVSA-N 1 1 430.984 3.011 20 0 IGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@@H]2CN(c3nc(Cl)nc4c(Cl)ncnc43)CC[C@@H]21 ZINC001164844204 720629503 /nfs/dbraw/zinc/62/95/03/720629503.db2.gz ZYRUXIOPPLQQMH-ILXRZTDVSA-N 1 1 447.374 3.301 20 0 IGADMO CC(C)[N@@H+]1[C@@H]2CCN(C(F)(F)c3cc[n+]([O-])c(Cl)c3)C[C@@H]2C[C@H]1Cn1cccn1 ZINC001164837006 720648231 /nfs/dbraw/zinc/64/82/31/720648231.db2.gz AQTPAIXQZOERJO-RYQLBKOJSA-N 1 1 425.911 3.093 20 0 IGADMO COC(=O)c1cc(Cl)nc(N2CCC3(C[C@@H]([N@@H+](C)Cc4ccccc4)CO3)CC2)n1 ZINC001164838857 720662067 /nfs/dbraw/zinc/66/20/67/720662067.db2.gz IBPHISFFRHJUKA-QGZVFWFLSA-N 1 1 430.936 3.177 20 0 IGADMO COC(=O)c1nc2cnccc2c(N2CCC3(C[C@H]([N@@H+](C)Cc4ccccc4)CO3)CC2)n1 ZINC001164842676 720698288 /nfs/dbraw/zinc/69/82/88/720698288.db2.gz MMLQYQULHRXGSR-IBGZPJMESA-N 1 1 447.539 3.071 20 0 IGADMO C[N@@H+](Cc1ccccc1)[C@@H]1COC2(C1)CCN(c1nc(Cl)cc3c1CNC3=O)CC2 ZINC001164845374 720699440 /nfs/dbraw/zinc/69/94/40/720699440.db2.gz YYLXBBKOFQNXSH-KRWDZBQOSA-N 1 1 426.948 3.238 20 0 IGADMO Clc1cc(OCc2ccccc2)cnc1N1CC[N@H+]2C[C@@H](Oc3cncnc3)C[C@@H]2C1 ZINC001164745923 720744602 /nfs/dbraw/zinc/74/46/02/720744602.db2.gz WUXBJTIDIJOOIU-QUCCMNQESA-N 1 1 437.931 3.446 20 0 IGADMO Cc1cccc(Oc2nc(Cl)ncc2N2CC[N@H+]3C[C@H](Oc4cncnc4)C[C@@H]3C2)c1 ZINC001164741426 720802912 /nfs/dbraw/zinc/80/29/12/720802912.db2.gz BHMANDRMPBQRKJ-SJLPKXTDSA-N 1 1 438.919 3.363 20 0 IGADMO Fc1c(Cl)nccc1C(F)(F)N1CC[C@@H]2[C@@H](C[C@@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164752740 720812276 /nfs/dbraw/zinc/81/22/76/720812276.db2.gz ZQHSLASGCGLTPO-YQQAZPJKSA-N 1 1 440.901 3.390 20 0 IGADMO Fc1ccc(C(F)(F)N2CC[C@@H]3[C@@H](C[C@@H](Cn4cncn4)[N@H+]3CC3CC3)C2)nc1Cl ZINC001164742697 720815201 /nfs/dbraw/zinc/81/52/01/720815201.db2.gz DAUWGZMMKYXFON-YQQAZPJKSA-N 1 1 440.901 3.390 20 0 IGADMO c1ncn(C[C@H]2C[C@H]3CN(c4cncc(OCc5ccccc5)n4)CC[C@H]3[N@@H+]2CC2CC2)n1 ZINC001164737689 720817419 /nfs/dbraw/zinc/81/74/19/720817419.db2.gz BYPVYJHAGLBHBE-YTFSRNRJSA-N 1 1 445.571 3.027 20 0 IGADMO CSc1nc2c(c(N3CC[C@@H]4[C@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)n1)CCCC2 ZINC001164739238 720826166 /nfs/dbraw/zinc/82/61/66/720826166.db2.gz HWEFMBUKKYVZGF-DBXWQHBBSA-N 1 1 439.633 3.048 20 0 IGADMO c1ncn(C[C@H]2C[C@@H]3CN(c4ncnc5[nH]c6ccccc6c54)CC[C@H]3[N@H+]2CC2CC2)n1 ZINC001164741167 720833093 /nfs/dbraw/zinc/83/30/93/720833093.db2.gz DNHFOFIFPXMXHS-DBXWQHBBSA-N 1 1 428.544 3.082 20 0 IGADMO COCC[N@H+]1CCO[C@@H]2CN(C(F)(F)c3nc(Cl)c4ccccc4n3)CC[C@H]2C1 ZINC001164852576 720836261 /nfs/dbraw/zinc/83/62/61/720836261.db2.gz KYQPOBLAJXJNIY-WMLDXEAASA-N 1 1 426.895 3.002 20 0 IGADMO Fc1cccc(Oc2cncc(N3CC[C@@H]4[C@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)n2)c1 ZINC001164743692 720839979 /nfs/dbraw/zinc/83/99/79/720839979.db2.gz JUCHSEASFJEGSJ-KAGYGMCKSA-N 1 1 449.534 3.379 20 0 IGADMO COCC[N@H+]1CCO[C@H]2CN(C(F)(F)c3nc4ccsc4c(Cl)n3)CC[C@H]2C1 ZINC001164853343 720842934 /nfs/dbraw/zinc/84/29/34/720842934.db2.gz OJFOAWNWFFNEQT-JSGCOSHPSA-N 1 1 432.924 3.063 20 0 IGADMO COc1cccc(-c2ccc(N3CC[C@@H]4[C@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)nn2)c1 ZINC001164739955 720847927 /nfs/dbraw/zinc/84/79/27/720847927.db2.gz BDAOGOJTTQTVHH-PQNGQFLHSA-N 1 1 445.571 3.123 20 0 IGADMO Fc1cccc(-c2ccc(N3CC[C@@H]4[C@@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)nn2)c1 ZINC001164751970 720852364 /nfs/dbraw/zinc/85/23/64/720852364.db2.gz RYNQKGMIZNHPES-IEIRFRATSA-N 1 1 433.535 3.254 20 0 IGADMO Fc1cccc(-c2ccc(N3CC[C@@H]4[C@@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)nn2)c1 ZINC001164751977 720852451 /nfs/dbraw/zinc/85/24/51/720852451.db2.gz RYNQKGMIZNHPES-XKCSPQBFSA-N 1 1 433.535 3.254 20 0 IGADMO CC(C)c1noc(-c2ccnc(N3CC[C@@H]4[C@@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)c2)n1 ZINC001164751890 720853427 /nfs/dbraw/zinc/85/34/27/720853427.db2.gz RLOBLPGPLMYERA-PWRODBHTSA-N 1 1 448.575 3.226 20 0 IGADMO c1ncn(C[C@H]2C[C@@H]3CN(c4nccnc4Oc4ccccc4)CC[C@H]3[N@H+]2CC2CC2)n1 ZINC001164751168 720854050 /nfs/dbraw/zinc/85/40/50/720854050.db2.gz QMWQWBZPBRWIOY-KCZVDYSFSA-N 1 1 431.544 3.240 20 0 IGADMO CCN(C)c1ccnc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COCc2cccnc2)n1 ZINC001164747425 720868379 /nfs/dbraw/zinc/86/83/79/720868379.db2.gz BQKFUOIDCAFZGS-WIOPSUGQSA-N 1 1 436.604 3.083 20 0 IGADMO CSc1nccc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COCc2cccnc2)n1 ZINC001164749742 720870880 /nfs/dbraw/zinc/87/08/80/720870880.db2.gz HUZGHMBLHBNIIP-REWPJTCUSA-N 1 1 425.602 3.349 20 0 IGADMO Cc1nc(N(C)C)cc(N2CC[C@@]3(C2)C[N@H+](CC2CC2)C[C@H]3COCc2cccnc2)n1 ZINC001164755894 720874224 /nfs/dbraw/zinc/87/42/24/720874224.db2.gz ZSPCCOGSXQLGMT-DHLKQENFSA-N 1 1 436.604 3.001 20 0 IGADMO Cc1nc(N(C)C)cc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COCc2cccnc2)n1 ZINC001164755894 720874225 /nfs/dbraw/zinc/87/42/25/720874225.db2.gz ZSPCCOGSXQLGMT-DHLKQENFSA-N 1 1 436.604 3.001 20 0 IGADMO COCC[N@H+]1CCO[C@@H]2CN(c3nc4ccccc4nc3N3CCCC[C@@H]3C)CC[C@H]2C1 ZINC001164855356 720874918 /nfs/dbraw/zinc/87/49/18/720874918.db2.gz HASOPPJCEJJRGE-SXWKCWPCSA-N 1 1 439.604 3.182 20 0 IGADMO COCC[N@H+]1CCO[C@@H]2CN(c3ccc(C(=O)Nc4cccc(Cl)c4)cn3)CC[C@@H]2C1 ZINC001164859229 720876228 /nfs/dbraw/zinc/87/62/28/720876228.db2.gz MAZLXCQGHKRDFO-WIYYLYMNSA-N 1 1 444.963 3.161 20 0 IGADMO COCC[N@H+]1CCO[C@@H]2CN(c3nc(C)nc4sc5c(c43)CCCCC5)CC[C@H]2C1 ZINC001164862321 720877249 /nfs/dbraw/zinc/87/72/49/720877249.db2.gz ROTDFWSXAZBTLV-PKOBYXMFSA-N 1 1 430.618 3.442 20 0 IGADMO Cn1cnc2c1ccnc2N1CC[C@]2(C1)C[N@@H+](CC1CC1)C[C@H]2COCc1cccnc1 ZINC001164752442 720877417 /nfs/dbraw/zinc/87/74/17/720877417.db2.gz NAFZGNSUEITDMN-SQJMNOBHSA-N 1 1 432.572 3.118 20 0 IGADMO Cc1cc2ncnc(N3CC[C@]4(C3)C[N@@H+](CC3CC3)C[C@@H]4COCc3cccnc3)c2[nH]1 ZINC001164752526 720895378 /nfs/dbraw/zinc/89/53/78/720895378.db2.gz DWXMSMYUTQWUSC-PXDATVDWSA-N 1 1 432.572 3.416 20 0 IGADMO CC(C)Oc1nccnc1N1CC[C@@]2(C1)C[N@@H+](CC1CC1)C[C@@H]2COCc1cccnc1 ZINC001164752697 720926140 /nfs/dbraw/zinc/92/61/40/720926140.db2.gz OLPFGPOOJPBDON-RDGATRHJSA-N 1 1 437.588 3.414 20 0 IGADMO CC(C)CCNS(=O)(=O)c1ccc(N2CCn3c(C[N@@H+](C)C(C)C)cnc3[C@H]2C)nc1 ZINC001164856308 721006813 /nfs/dbraw/zinc/00/68/13/721006813.db2.gz BFKPRYHFRJODJX-GOSISDBHSA-N 1 1 448.637 3.024 20 0 IGADMO CCC[C@@H](C)NS(=O)(=O)c1ccc(N2CCn3c(C[N@@H+](C)C(C)C)cnc3[C@@H]2C)nc1 ZINC001164863541 721007613 /nfs/dbraw/zinc/00/76/13/721007613.db2.gz WBVXGOVNPCDAGV-MSOLQXFVSA-N 1 1 448.637 3.166 20 0 IGADMO Clc1ccc(CN2CCCC2)c(N2CC[N@H+]3C[C@H](OCc4cccnc4)C[C@H]3C2)n1 ZINC001164864576 721101648 /nfs/dbraw/zinc/10/16/48/721101648.db2.gz GMYPNAKCMGYSFW-LEWJYISDSA-N 1 1 427.980 3.206 20 0 IGADMO CCOc1ccc(-c2ccc(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@H]4C3)nn2)cc1 ZINC001164872799 721162032 /nfs/dbraw/zinc/16/20/32/721162032.db2.gz IJXLSFKCRPTUHK-JTHBVZDNSA-N 1 1 431.540 3.417 20 0 IGADMO COc1ccc(Oc2cc(N3C[C@H]4CC[N@@H+](Cc5cnn(C)c5)C[C@@H]4C3)nc(C)n2)cc1 ZINC001164760669 721230701 /nfs/dbraw/zinc/23/07/01/721230701.db2.gz FRPQYRCVYMCWJA-WOJBJXKFSA-N 1 1 434.544 3.278 20 0 IGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2C[C@@H]3COC[C@@H](C(=O)NCc4ccco4)[C@@H]3C2)nc1 ZINC001164763931 721256860 /nfs/dbraw/zinc/25/68/60/721256860.db2.gz OCNXPAXMQRKZLP-JMJGKCIBSA-N 1 1 438.572 3.237 20 0 IGADMO CN(C)C(=O)C[N@H+]1CCOCC2(CCN(c3nc(Cl)cc4cc(F)ccc43)CC2)C1 ZINC001164872699 721261174 /nfs/dbraw/zinc/26/11/74/721261174.db2.gz FENUQVKBDYTPHD-UHFFFAOYSA-N 1 1 434.943 3.034 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@]2(CCCN(c3ccc(N4CCCCC4)nn3)C2)C1 ZINC001164777997 721331553 /nfs/dbraw/zinc/33/15/53/721331553.db2.gz RYRUELXJRABTTJ-XMMPIXPASA-N 1 1 440.592 3.191 20 0 IGADMO COCc1cc(N2CCC[C@@]3(C2)COCC[N@H+](Cc2c(C)noc2C)C3)nc(SC)n1 ZINC001164777686 721349466 /nfs/dbraw/zinc/34/94/66/721349466.db2.gz HNYPGOSROXNHGU-JOCHJYFZSA-N 1 1 447.605 3.069 20 0 IGADMO COCc1cc(N2CCC[C@@]3(C2)COCC[N@@H+](Cc2c(C)noc2C)C3)nc(SC)n1 ZINC001164777686 721349467 /nfs/dbraw/zinc/34/94/67/721349467.db2.gz HNYPGOSROXNHGU-JOCHJYFZSA-N 1 1 447.605 3.069 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@]2(CCCN(c3ccc4ncc(F)cc4n3)C2)C1 ZINC001164784989 721362931 /nfs/dbraw/zinc/36/29/31/721362931.db2.gz RSPGQSHHJIDPQF-HSZRJFAPSA-N 1 1 425.508 3.493 20 0 IGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@@]2(CCCN(C(F)(F)c3nccnc3Cl)C2)C1 ZINC001164783985 721363155 /nfs/dbraw/zinc/36/31/55/721363155.db2.gz QCJAEPOUDXWTPF-IBGZPJMESA-N 1 1 441.910 3.399 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@@]2(CCCN(C(F)(F)c3nccnc3Cl)C2)C1 ZINC001164783985 721363157 /nfs/dbraw/zinc/36/31/57/721363157.db2.gz QCJAEPOUDXWTPF-IBGZPJMESA-N 1 1 441.910 3.399 20 0 IGADMO Cc1noc(C)c1CN1CCOC[C@@]2(CCCN(c3ccc(C[NH+]4CCCC4)cn3)C2)C1 ZINC001164784925 721365562 /nfs/dbraw/zinc/36/55/62/721365562.db2.gz RNUJGCGWLDJVFN-VWLOTQADSA-N 1 1 439.604 3.401 20 0 IGADMO Cc1noc(C)c1CN1CCOC[C@]2(CCCN(c3ccc(C[N@@H+](C)C4CC4)cn3)C2)C1 ZINC001164780760 721369028 /nfs/dbraw/zinc/36/90/28/721369028.db2.gz HELOBKDNAWLPMP-RUZDIDTESA-N 1 1 439.604 3.400 20 0 IGADMO Cc1noc(C)c1CN1CCOC[C@]2(CCCN(c3ccc(C[N@H+](C)C4CC4)cn3)C2)C1 ZINC001164780760 721369030 /nfs/dbraw/zinc/36/90/30/721369030.db2.gz HELOBKDNAWLPMP-RUZDIDTESA-N 1 1 439.604 3.400 20 0 IGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@@]2(CCCN(c3nccnc3OC3CCC3)C2)C1 ZINC001164783837 721372294 /nfs/dbraw/zinc/37/22/94/721372294.db2.gz PVBNWZQYMDGUIH-QHCPKHFHSA-N 1 1 427.549 3.132 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@@]2(CCCN(c3nccnc3OC3CCC3)C2)C1 ZINC001164783837 721372296 /nfs/dbraw/zinc/37/22/96/721372296.db2.gz PVBNWZQYMDGUIH-QHCPKHFHSA-N 1 1 427.549 3.132 20 0 IGADMO Cc1cc2c(nc(Cl)nc2N2CC[C@@]3(C2)CCC[C@H](CN2CC[NH+](C)CC2)O3)s1 ZINC001164886106 721400449 /nfs/dbraw/zinc/40/04/49/721400449.db2.gz HUPLYWYCJBNIDY-IIBYNOLFSA-N 1 1 436.025 3.419 20 0 IGADMO C[NH+]1CCN(C[C@@H]2CCC[C@]3(CCN(c4nc(Cl)nc5c(F)cccc54)C3)O2)CC1 ZINC001164883629 721406056 /nfs/dbraw/zinc/40/60/56/721406056.db2.gz BJNPHYNGQNLNSP-KSFYIVLOSA-N 1 1 433.959 3.188 20 0 IGADMO Cc1ccc2nc(N3CC[C@]4(C3)CCC[C@H](CN3CC[NH+](C)CC3)O4)c(Cl)nc2c1 ZINC001164888937 721407251 /nfs/dbraw/zinc/40/72/51/721407251.db2.gz PPXXNKVIJOYHOZ-JPYJTQIMSA-N 1 1 429.996 3.357 20 0 IGADMO COc1ccc(C(F)(F)N2CC[C@@]3(C2)CCC[C@H](CN2CC[NH+](C)CC2)O3)c(Cl)n1 ZINC001164885775 721408997 /nfs/dbraw/zinc/40/89/97/721408997.db2.gz HHWZJEGVLBSIPI-OXQOHEQNSA-N 1 1 444.954 3.054 20 0 IGADMO CC(C)(C)C(=O)OCn1ccc2c1ncnc2N1C[C@@H]2C[NH+](Cc3nccs3)C[C@H]2C1 ZINC001164789551 721410727 /nfs/dbraw/zinc/41/07/27/721410727.db2.gz VCCGLEPEZFWSHH-HOTGVXAUSA-N 1 1 440.573 3.003 20 0 IGADMO COc1cc2nc(Cl)c(N3C[C@H]4C[NH+](Cc5nccs5)C[C@@H]4C3)nc2cc1OC ZINC001164781205 721412006 /nfs/dbraw/zinc/41/20/06/721412006.db2.gz CYXFVUSBSVWVIS-CHWSQXEVSA-N 1 1 431.949 3.325 20 0 IGADMO Cc1nc2cc(Cl)ccc2c(N2CC[C@]3(C2)CCC[C@@H](CN2CC[NH+](C)CC2)O3)n1 ZINC001164890509 721412449 /nfs/dbraw/zinc/41/24/49/721412449.db2.gz SWLLTMZZFOVORN-CVDCTZTESA-N 1 1 429.996 3.357 20 0 IGADMO COc1ccc2nc(Cl)cc(N3CC[C@@]4(C3)CCC[C@@H](CN3CC[NH+](C)CC3)O4)c2n1 ZINC001164891469 721416225 /nfs/dbraw/zinc/41/62/25/721416225.db2.gz WIFIKPZAIAUXOM-GAJHUEQPSA-N 1 1 445.995 3.057 20 0 IGADMO COc1cccc2nc(Cl)nc(N3CC[C@]4(C3)CCC[C@H](CN3CC[NH+](C)CC3)O4)c21 ZINC001164891937 721417431 /nfs/dbraw/zinc/41/74/31/721417431.db2.gz WTHUHPRRRFSOQN-HXOBKFHXSA-N 1 1 445.995 3.057 20 0 IGADMO Cc1cccc2nc(Cl)nc(N3CC[C@]4(C3)CCC[C@@H](CN3CC[NH+](C)CC3)O4)c12 ZINC001164892352 721425558 /nfs/dbraw/zinc/42/55/58/721425558.db2.gz IFJVIJKFQZGPCE-MBSDFSHPSA-N 1 1 429.996 3.357 20 0 IGADMO C[NH+]1CCN(C[C@H]2CCC[C@]3(CCN(c4cccc(OCc5ccccc5)n4)C3)O2)CC1 ZINC001164896728 721426250 /nfs/dbraw/zinc/42/62/50/721426250.db2.gz RVTCWMCKPRXVDE-ZEQKJWHPSA-N 1 1 436.600 3.426 20 0 IGADMO O=C(Nc1ccc(Cl)nc1)OCC(F)(F)N1C[C@H]2C[NH+](Cc3nccs3)C[C@@H]2C1 ZINC001164790304 721437519 /nfs/dbraw/zinc/43/75/19/721437519.db2.gz XMSZZKUKRWAPIH-CHWSQXEVSA-N 1 1 443.907 3.397 20 0 IGADMO C[NH+]1CCN(C[C@@H]2CCC[C@@]3(CCN(c4nc(C(F)F)nc5ccccc54)C3)O2)CC1 ZINC001164893017 721439528 /nfs/dbraw/zinc/43/95/28/721439528.db2.gz IQSBURAHFNOYAS-SBUREZEXSA-N 1 1 431.531 3.333 20 0 IGADMO C[NH+]1CCN(C[C@@H]2CCC[C@]3(CCN(c4cc5nc(Cl)cnc5cc4F)C3)O2)CC1 ZINC001164891778 721439614 /nfs/dbraw/zinc/43/96/14/721439614.db2.gz HKMTWFFJKPGFEH-KSFYIVLOSA-N 1 1 433.959 3.188 20 0 IGADMO Cc1cc(N2CC[C@]3(C2)CCC[C@H](CN2CC[NH+](C)CC2)O3)nc(-c2ccsc2)n1 ZINC001164899496 721440196 /nfs/dbraw/zinc/44/01/96/721440196.db2.gz YRDRFQLUBSGTQM-OFNKIYASSA-N 1 1 427.618 3.279 20 0 IGADMO Cc1cc(N2CC[C@@]3(C2)CCC[C@@H](CN2CC[NH+](C)CC2)O3)nc(-c2ccsc2)n1 ZINC001164899494 721440855 /nfs/dbraw/zinc/44/08/55/721440855.db2.gz YRDRFQLUBSGTQM-NZQKXSOJSA-N 1 1 427.618 3.279 20 0 IGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(C(F)(F)c1cnc(Cl)nc1)CC2 ZINC001164785205 721453933 /nfs/dbraw/zinc/45/39/33/721453933.db2.gz HFDUJGNUFCQVOY-GOSISDBHSA-N 1 1 444.954 3.409 20 0 IGADMO CCOc1c(Cl)ncnc1N1CCC2(C[C@@H](COCC3CC3)[N@@H+](CCOC)C2)CC1 ZINC001164784635 721460992 /nfs/dbraw/zinc/46/09/92/721460992.db2.gz IXFIMSFIGLSHKP-SFHVURJKSA-N 1 1 439.000 3.263 20 0 IGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1nc3nc[nH]c3cc1Cl)CC2 ZINC001164788684 721461820 /nfs/dbraw/zinc/46/18/20/721461820.db2.gz VNEAILMDCVSPDY-QGZVFWFLSA-N 1 1 433.984 3.345 20 0 IGADMO COCC[N@@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1nc3[nH]cnc3cc1Cl)CC2 ZINC001164788684 721461821 /nfs/dbraw/zinc/46/18/21/721461821.db2.gz VNEAILMDCVSPDY-QGZVFWFLSA-N 1 1 433.984 3.345 20 0 IGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1nc3[nH]cnc3cc1Cl)CC2 ZINC001164788684 721461824 /nfs/dbraw/zinc/46/18/24/721461824.db2.gz VNEAILMDCVSPDY-QGZVFWFLSA-N 1 1 433.984 3.345 20 0 IGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1ncc(C)cc1C(OC)OC)CC2 ZINC001164782807 721463986 /nfs/dbraw/zinc/46/39/86/721463986.db2.gz CJYUPXZBTQCDJX-OAQYLSRUSA-N 1 1 447.620 3.415 20 0 IGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1nccnc1OC1CCC1)CC2 ZINC001164787401 721470743 /nfs/dbraw/zinc/47/07/43/721470743.db2.gz FNYXQMPQZBCWOB-FQEVSTJZSA-N 1 1 430.593 3.142 20 0 IGADMO O=C(NCc1ccccc1)c1cccnc1N1CC[N@H+]2C[C@@H](Oc3cccc(F)c3)C[C@H]2C1 ZINC001164899978 721514972 /nfs/dbraw/zinc/51/49/72/721514972.db2.gz MWROAUDICTVMCC-GMAHTHKFSA-N 1 1 446.526 3.493 20 0 IGADMO CCOC(=O)c1nc2ccccc2c(N2C[C@H]([N@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@H]32)n1 ZINC001164811177 721532437 /nfs/dbraw/zinc/53/24/37/721532437.db2.gz ZFOIWVLOUPMTAQ-BHIFYINESA-N 1 1 447.539 3.070 20 0 IGADMO CCOC(=O)c1nc2ccccc2c(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@H]32)n1 ZINC001164811177 721532440 /nfs/dbraw/zinc/53/24/40/721532440.db2.gz ZFOIWVLOUPMTAQ-BHIFYINESA-N 1 1 447.539 3.070 20 0 IGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2nc(Cl)nc3c2CSCC3)[C@H]2CCCO[C@@H]12 ZINC001164809410 721534480 /nfs/dbraw/zinc/53/44/80/721534480.db2.gz UMRVMIZKAYIKHJ-IPMKNSEASA-N 1 1 431.993 3.183 20 0 IGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2nc(Cl)nc3c2CSCC3)[C@H]2CCCO[C@@H]12 ZINC001164809410 721534481 /nfs/dbraw/zinc/53/44/81/721534481.db2.gz UMRVMIZKAYIKHJ-IPMKNSEASA-N 1 1 431.993 3.183 20 0 IGADMO COC(=O)c1ccc2ccnc(N3C[C@H]([N@@H+](C)Cc4cccnc4)[C@@H]4OCCC[C@H]43)c2c1 ZINC001164806616 721547232 /nfs/dbraw/zinc/54/72/32/721547232.db2.gz PGFIXVKIHXQOGR-XPWALMASSA-N 1 1 432.524 3.285 20 0 IGADMO CCOC(=O)c1cc2ccnc(N3C[C@H]([N@@H+](C)Cc4cccnc4)[C@@H]4OCCC[C@@H]43)c2[nH]1 ZINC001164803060 721547511 /nfs/dbraw/zinc/54/75/11/721547511.db2.gz HQFDKIOYRDHLNY-JAXLGGSGSA-N 1 1 435.528 3.003 20 0 IGADMO CCOC(=O)c1cc(Cl)nc(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@@H]32)c1C ZINC001164804561 721552842 /nfs/dbraw/zinc/55/28/42/721552842.db2.gz KHFAYSKFIAGRPE-IRFCIJBXSA-N 1 1 444.963 3.483 20 0 IGADMO CCOC(=O)c1cnc(N2C[C@H]([N@H+](C)Cc3cccnc3)[C@H]3OCCC[C@H]32)c(Cl)c1 ZINC001164800697 721557270 /nfs/dbraw/zinc/55/72/70/721557270.db2.gz FNNRGDBYMWCVKR-AABGKKOBSA-N 1 1 430.936 3.175 20 0 IGADMO CCOC(=O)c1cnc(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@H]3OCCC[C@H]32)c(Cl)c1 ZINC001164800697 721557272 /nfs/dbraw/zinc/55/72/72/721557272.db2.gz FNNRGDBYMWCVKR-AABGKKOBSA-N 1 1 430.936 3.175 20 0 IGADMO COc1cccc(-c2ccnc(N3C[C@H]([N@H+](C)Cc4cccnc4)[C@H]4OCCC[C@@H]43)n2)c1 ZINC001164807338 721567294 /nfs/dbraw/zinc/56/72/94/721567294.db2.gz SSKGZPFDNNJZMP-HJOGWXRNSA-N 1 1 431.540 3.415 20 0 IGADMO COc1cccc(-c2ccnc(N3C[C@H]([N@@H+](C)Cc4cccnc4)[C@H]4OCCC[C@@H]43)n2)c1 ZINC001164807338 721567299 /nfs/dbraw/zinc/56/72/99/721567299.db2.gz SSKGZPFDNNJZMP-HJOGWXRNSA-N 1 1 431.540 3.415 20 0 IGADMO CC1CCN(C(=O)c2cccnc2N2C[C@H]([N@H+](C)Cc3cccnc3)[C@H]3OCCC[C@@H]32)CC1 ZINC001164801755 721576872 /nfs/dbraw/zinc/57/68/72/721576872.db2.gz HESJDPYGXNTARI-HJOGWXRNSA-N 1 1 449.599 3.217 20 0 IGADMO CC1CCN(C(=O)c2cccnc2N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@H]3OCCC[C@@H]32)CC1 ZINC001164801755 721576875 /nfs/dbraw/zinc/57/68/75/721576875.db2.gz HESJDPYGXNTARI-HJOGWXRNSA-N 1 1 449.599 3.217 20 0 IGADMO C[C@@H]1CCCN(C(=O)c2ccc(N3C[C@H]([N@@H+](C)Cc4cccnc4)[C@H]4OCCC[C@@H]43)nc2)C1 ZINC001164798195 721577056 /nfs/dbraw/zinc/57/70/56/721577056.db2.gz APMKEBXPCYOECS-SXPAWZJZSA-N 1 1 449.599 3.217 20 0 IGADMO COC(=O)c1cc2ccccc2c(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@@H]32)n1 ZINC001164806983 721581417 /nfs/dbraw/zinc/58/14/17/721581417.db2.gz OHRKNZYOKKDKMB-RJGXRXQPSA-N 1 1 432.524 3.285 20 0 IGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(C(F)(F)c2nc3ccc(Cl)nc3[nH]2)[C@H]2CCCO[C@@H]12 ZINC001164808345 721582559 /nfs/dbraw/zinc/58/25/59/721582559.db2.gz QUKZNNMJIXEXST-LZLYRXPVSA-N 1 1 448.905 3.419 20 0 IGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(C(F)(F)c2nc3ccc(Cl)nc3[nH]2)[C@H]2CCCO[C@@H]12 ZINC001164808345 721582562 /nfs/dbraw/zinc/58/25/62/721582562.db2.gz QUKZNNMJIXEXST-LZLYRXPVSA-N 1 1 448.905 3.419 20 0 IGADMO COC(=O)c1cnc(Cl)nc1N1CCC(F)(F)[C@]2(CC[N@@H+](Cc3ccccn3)C2)C1 ZINC001164903764 721584809 /nfs/dbraw/zinc/58/48/09/721584809.db2.gz CEFIISSNTYJODP-IBGZPJMESA-N 1 1 437.878 3.049 20 0 IGADMO Cc1nc(C)c(-c2ccc(N3C[C@H]([N@H+](C)Cc4cccnc4)[C@@H]4OCCC[C@@H]43)nn2)s1 ZINC001164806233 721586799 /nfs/dbraw/zinc/58/67/99/721586799.db2.gz MOQSKMLTHRNYLR-JAXLGGSGSA-N 1 1 436.585 3.480 20 0 IGADMO Cc1nc(C)c(-c2ccc(N3C[C@H]([N@@H+](C)Cc4cccnc4)[C@@H]4OCCC[C@@H]43)nn2)s1 ZINC001164806233 721586801 /nfs/dbraw/zinc/58/68/01/721586801.db2.gz MOQSKMLTHRNYLR-JAXLGGSGSA-N 1 1 436.585 3.480 20 0 IGADMO CCOC(=O)c1cc(C)nc(N2CCC(F)(F)[C@@]3(CC[N@@H+](Cc4ccccn4)C3)C2)n1 ZINC001164903751 721695999 /nfs/dbraw/zinc/69/59/99/721695999.db2.gz BZYHBDPJOZKOMQ-OAQYLSRUSA-N 1 1 431.487 3.094 20 0 IGADMO C[C@@H]1CC(=O)Nc2ncnc(N3CCC(F)(F)[C@@]4(CC[N@@H+](Cc5ccccn5)C4)C3)c21 ZINC001164906647 721706515 /nfs/dbraw/zinc/70/65/15/721706515.db2.gz NMYILNXCQSAXDL-QVKFZJNVSA-N 1 1 428.487 3.055 20 0 IGADMO O=C(NC1CC1)c1ccc(N2CCC(F)(F)[C@]3(CC[N@@H+](Cc4ccccn4)C3)C2)nc1 ZINC001164904904 721707784 /nfs/dbraw/zinc/70/77/84/721707784.db2.gz FKLKBRYEQCNXLM-QFIPXVFZSA-N 1 1 427.499 3.107 20 0 IGADMO CCOc1ccc(C(=O)OC)c(N2CCC(F)(F)[C@@]3(CC[N@@H+](Cc4ccccn4)C3)C2)n1 ZINC001164904805 721711188 /nfs/dbraw/zinc/71/11/88/721711188.db2.gz DEYXKECBQJDBGK-JOCHJYFZSA-N 1 1 446.498 3.400 20 0 IGADMO O=C1NCc2c1cc(Cl)nc2N1CCC(F)(F)[C@@]2(CC[N@@H+](Cc3ccccn3)C2)C1 ZINC001164906087 721713058 /nfs/dbraw/zinc/71/30/58/721713058.db2.gz JSCUMFOCLKCQQW-HXUWFJFHSA-N 1 1 433.890 3.111 20 0 IGADMO FC1(F)CCN(c2ncc3ncnc(Cl)c3n2)C[C@@]12CC[N@@H+](Cc1ccccn1)C2 ZINC001164906634 721716548 /nfs/dbraw/zinc/71/65/48/721716548.db2.gz NJYYOPVKQJGLHJ-IBGZPJMESA-N 1 1 431.878 3.206 20 0 IGADMO COC(=O)Cc1c(Cl)ncnc1N1CCc2c(C[N@H+](C)Cc3ccco3)cncc2C1 ZINC001164909999 721750612 /nfs/dbraw/zinc/75/06/12/721750612.db2.gz XEBFBBDCWDULCK-UHFFFAOYSA-N 1 1 441.919 3.028 20 0 IGADMO COC(=O)Cc1c(Cl)ncnc1N1CCc2c(C[N@@H+](C)Cc3ccco3)cncc2C1 ZINC001164909999 721750622 /nfs/dbraw/zinc/75/06/22/721750622.db2.gz XEBFBBDCWDULCK-UHFFFAOYSA-N 1 1 441.919 3.028 20 0 IGADMO CCOC(=O)c1ncnc(Cl)c1N1C[C@@H]2CCC[C@H]([N@@H+](C)Cc3ccccn3)[C@@H]2C1 ZINC001165023106 721821494 /nfs/dbraw/zinc/82/14/94/721821494.db2.gz HLFOAGASRMPSBW-JQHSSLGASA-N 1 1 429.952 3.439 20 0 IGADMO C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@@H]2CN(c3nc(Cl)cc(O[C@H]4CCOC4)n3)C[C@H]21 ZINC001165025207 721831363 /nfs/dbraw/zinc/83/13/63/721831363.db2.gz MFPKKAZHAASVBV-GSEOLPGOSA-N 1 1 443.979 3.430 20 0 IGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2CC[C@]3(C[C@H](OCC(=O)N4CCCC4)CO3)C2)nc1 ZINC001164937297 721919354 /nfs/dbraw/zinc/91/93/54/721919354.db2.gz BEPKSTIBEXEZSW-FBLLAGFSSA-N 1 1 442.604 3.005 20 0 IGADMO COC(=O)c1nc(Cl)cc(N2CCC3(CC2)C[N@@H+](Cc2ccc(C)cc2)CCO3)n1 ZINC001164940147 721932473 /nfs/dbraw/zinc/93/24/73/721932473.db2.gz QRJNKDVVTPTDAL-UHFFFAOYSA-N 1 1 430.936 3.096 20 0 IGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2CCN(C(=O)[C@H]3COc4ccccc4O3)CC2)nc1 ZINC001165049874 721981725 /nfs/dbraw/zinc/98/17/25/721981725.db2.gz NEKBDVYFPMXMPS-NFBKMPQASA-N 1 1 436.556 3.117 20 0 IGADMO CC[C@H](C)c1nc2[nH]ccc2c(N2CCC3(CC2)C(=O)NCC[N@H+]3Cc2ccccc2)n1 ZINC001164951155 721981953 /nfs/dbraw/zinc/98/19/53/721981953.db2.gz YDYCGSKKGMIPEA-SFHVURJKSA-N 1 1 432.572 3.442 20 0 IGADMO CC[C@H](C)c1nc2[nH]ccc2c(N2CCC3(CC2)C(=O)NCC[N@@H+]3Cc2ccccc2)n1 ZINC001164951155 721981955 /nfs/dbraw/zinc/98/19/55/721981955.db2.gz YDYCGSKKGMIPEA-SFHVURJKSA-N 1 1 432.572 3.442 20 0 IGADMO CC1(C)OCc2c1nc(Cl)nc2N1CCC2(CC1)COCC[N@@H+](Cc1ccncc1)C2 ZINC001164963782 722054438 /nfs/dbraw/zinc/05/44/38/722054438.db2.gz KRWRINBTTFTIIF-UHFFFAOYSA-N 1 1 443.979 3.409 20 0 IGADMO CSc1nc2ncnc(N3CCC4(CC3)COCC[N@@H+](Cc3ccncc3)C4)c2s1 ZINC001164959964 722058253 /nfs/dbraw/zinc/05/82/53/722058253.db2.gz ASZIVZGZLWEXNY-UHFFFAOYSA-N 1 1 442.614 3.322 20 0 IGADMO C[C@@H]1CCCN(c2cc(N3CCC4(CC3)COCC[N@@H+](Cc3ccncc3)C4)ncn2)C1 ZINC001164963399 722060841 /nfs/dbraw/zinc/06/08/41/722060841.db2.gz YJTZSRIAFGKRDW-OAQYLSRUSA-N 1 1 436.604 3.227 20 0 IGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2CC[C@@H]3[C@H](C[C@@H](Cn4cccn4)N3C(C)=O)C2)nc1 ZINC001164968975 722081117 /nfs/dbraw/zinc/08/11/17/722081117.db2.gz GVKJPSOITKGCJC-UEQSERJNSA-N 1 1 436.604 3.341 20 0 IGADMO O=C(NC1CCCCC1)c1cccnc1N1CC[C@@H]2C[N@@H+](Cc3cccnc3)CCO[C@@H]2C1 ZINC001164986105 722103184 /nfs/dbraw/zinc/10/31/84/722103184.db2.gz YANBDNBJAFLNGK-ZJSXRUAMSA-N 1 1 449.599 3.266 20 0 IGADMO Clc1cc(-c2ccncc2)c(N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)nn1 ZINC001164986047 722104387 /nfs/dbraw/zinc/10/43/87/722104387.db2.gz XVBHFCVJPBNTNM-FPOVZHCZSA-N 1 1 436.947 3.314 20 0 IGADMO Clc1nc(-c2ccccc2)nc(N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)n1 ZINC001164971398 722109771 /nfs/dbraw/zinc/10/97/71/722109771.db2.gz BXXCITBALYPLQX-PMACEKPBSA-N 1 1 436.947 3.314 20 0 IGADMO CCOC(=O)c1cc(Cl)nc(N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)c1C ZINC001164971882 722116890 /nfs/dbraw/zinc/11/68/90/722116890.db2.gz CZGPKQCMLJTERK-AZUAARDMSA-N 1 1 444.963 3.342 20 0 IGADMO COc1cc2nc(C)nc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)c2cc1OC ZINC001164982475 722119468 /nfs/dbraw/zinc/11/94/68/722119468.db2.gz WQADPYMMFBUGRH-DVECYGJZSA-N 1 1 449.555 3.078 20 0 IGADMO O=C(Nc1ccccc1)c1ccnc(N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)c1 ZINC001164979782 722120438 /nfs/dbraw/zinc/12/04/38/722120438.db2.gz PYAGGKIQONQCRN-UPVQGACJSA-N 1 1 443.551 3.456 20 0 IGADMO CCOC(=O)c1cnc(N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)c(Cl)c1 ZINC001164973067 722120868 /nfs/dbraw/zinc/12/08/68/722120868.db2.gz GHEQXCDNIQWTSE-FXAWDEMLSA-N 1 1 430.936 3.034 20 0 IGADMO COc1ccc2nc(Cl)cc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)c2n1 ZINC001164983765 722122078 /nfs/dbraw/zinc/12/20/78/722122078.db2.gz ZZGUVYIYLKXMRF-XLIONFOSSA-N 1 1 439.947 3.414 20 0 IGADMO COc1ccc(C(F)(F)N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)nc1Cl ZINC001164975588 722125133 /nfs/dbraw/zinc/12/51/33/722125133.db2.gz JXCZLSNJWSIGIU-WMZOPIPTSA-N 1 1 438.906 3.411 20 0 IGADMO COc1cccc(Oc2cncc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)n2)c1 ZINC001164977103 722131614 /nfs/dbraw/zinc/13/16/14/722131614.db2.gz ITAUVXURQIRPFN-OFNKIYASSA-N 1 1 447.539 3.400 20 0 IGADMO C[C@@H]1CCCN(C(=O)c2ccc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)nc2)C1 ZINC001164972723 722139495 /nfs/dbraw/zinc/13/94/95/722139495.db2.gz AKTAITRQUUCABO-AGILITTLSA-N 1 1 449.599 3.076 20 0 IGADMO FC(F)(c1c2c(nnc1Cl)CCC2)N1CC[C@H]2C[N@@H+](Cc3cccnc3)CCO[C@@H]2C1 ZINC001164982714 722143064 /nfs/dbraw/zinc/14/30/64/722143064.db2.gz SETMZUXMSALMOM-QFBILLFUSA-N 1 1 449.933 3.286 20 0 IGADMO Cc1nc(-c2ccncc2)nc(N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)c1C ZINC001164975047 722149060 /nfs/dbraw/zinc/14/90/60/722149060.db2.gz DTSWLCUBFNIKTM-GOTSBHOMSA-N 1 1 430.556 3.278 20 0 IGADMO Cc1nc(C)c(-c2ccc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)nn2)s1 ZINC001164979727 722150824 /nfs/dbraw/zinc/15/08/24/722150824.db2.gz LVBNLTFZMDWOTH-TZIWHRDSSA-N 1 1 436.585 3.339 20 0 IGADMO Fc1cnc(N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)nc1-c1ccsc1 ZINC001164977207 722154940 /nfs/dbraw/zinc/15/49/40/722154940.db2.gz YGACMOUUOZXGBT-XLIONFOSSA-N 1 1 425.533 3.467 20 0 IGADMO Cc1nc(CN2CCO[C@H]3CCN(c4nc(N5CCCCC5)cc[nH+]4)CC[C@@H]32)cs1 ZINC001164987156 722183989 /nfs/dbraw/zinc/18/39/89/722183989.db2.gz GWLHHMBEZOUECV-PMACEKPBSA-N 1 1 428.606 3.102 20 0 IGADMO C[NH+]1CCN(c2ncnc3c2CCN(c2nc(Cl)nc4ccc(Cl)cc42)CC3)CC1 ZINC001164998091 722228978 /nfs/dbraw/zinc/22/89/78/722228978.db2.gz XCFXFNOAZIMQPF-UHFFFAOYSA-N 1 1 444.370 3.084 20 0 IGADMO C[NH+]1CCN(c2ncnc3c2CCN(C(F)(F)Sc2ccc(Cl)nc2)CC3)CC1 ZINC001165002321 722240162 /nfs/dbraw/zinc/24/01/62/722240162.db2.gz UIBOIQZCQPIFJN-UHFFFAOYSA-N 1 1 440.951 3.020 20 0 IGADMO COC(=O)c1c[nH]c2nc(Cl)nc(N3CCC[C@@H]4C[N@@H+](Cc5ccccc5)C[C@H]43)c12 ZINC001164631426 719094883 /nfs/dbraw/zinc/09/48/83/719094883.db2.gz YBPGWEWYMUXGOE-NVXWUHKLSA-N 1 1 425.920 3.499 20 0 IGADMO c1ccc(C[N@H+]2C[C@@H]3CCCN(c4nc(N5CCCC5)nc(N5CCCC5)n4)[C@@H]3C2)cc1 ZINC001164621858 719096497 /nfs/dbraw/zinc/09/64/97/719096497.db2.gz BIWYZKFHAUSSSX-FCHUYYIVSA-N 1 1 433.604 3.173 20 0 IGADMO CNC(=O)C[N@H+]1CCCC12CCN(c1cnc(Cl)nc1Oc1ccc(F)cc1)CC2 ZINC001164689896 719741635 /nfs/dbraw/zinc/74/16/35/719741635.db2.gz NZHVEQSFUDRKFQ-UHFFFAOYSA-N 1 1 433.915 3.242 20 0 IGADMO COC(OC)c1c(CO)ccnc1N1CCC2(CCC[N@H+]2Cc2csc(C)n2)CC1 ZINC001164692782 719811716 /nfs/dbraw/zinc/81/17/16/719811716.db2.gz RVKIWOUBDCXAQO-UHFFFAOYSA-N 1 1 432.590 3.265 20 0 IGADMO COC[C@H]1CN(c2nc(C[NH+]3CCCC3)nc3sc(C)c(C)c32)Cc2cn(C)nc21 ZINC001164695832 719832179 /nfs/dbraw/zinc/83/21/79/719832179.db2.gz PGPRCLMRQGVOMK-QGZVFWFLSA-N 1 1 426.590 3.388 20 0 IGADMO COC[C@@H]1CC2(C[N@@H+]1Cc1ccccn1)CCN(c1nc(C)cc(N3CCCC3)n1)CC2 ZINC001164712720 720092379 /nfs/dbraw/zinc/09/23/79/720092379.db2.gz YMXYFSJTJVLDKN-QFIPXVFZSA-N 1 1 436.604 3.288 20 0 IGADMO COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1nc(C)cc(N3CCCC3)n1)CC2 ZINC001164712720 720092385 /nfs/dbraw/zinc/09/23/85/720092385.db2.gz YMXYFSJTJVLDKN-QFIPXVFZSA-N 1 1 436.604 3.288 20 0 IGADMO COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1ncccc1C(=O)N1CCCC1)CC2 ZINC001164712107 720093867 /nfs/dbraw/zinc/09/38/67/720093867.db2.gz VOGWCTMDHRUCDT-JOCHJYFZSA-N 1 1 449.599 3.220 20 0 IGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1ncnc3c1CCN(Cc1ccccc1)C3)C2 ZINC001164814398 720105643 /nfs/dbraw/zinc/10/56/43/720105643.db2.gz SFPNURSMNKHEPW-KCWPFWIISA-N 1 1 447.627 3.220 20 0 IGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1ncnc3c1CCN(Cc1ccccc1)C3)C2 ZINC001164814402 720106350 /nfs/dbraw/zinc/10/63/50/720106350.db2.gz SFPNURSMNKHEPW-YIXXDRMTSA-N 1 1 447.627 3.220 20 0 IGADMO COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1cncc(N3CCCCC3)n1)CC2 ZINC001164714569 720130773 /nfs/dbraw/zinc/13/07/73/720130773.db2.gz XHSOGFNGEDEDAJ-QFIPXVFZSA-N 1 1 436.604 3.369 20 0 IGADMO COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1cncc(OCC(C)C)n1)CC2 ZINC001164712264 720144893 /nfs/dbraw/zinc/14/48/93/720144893.db2.gz MDJAVWRKVXCWPC-NRFANRHFSA-N 1 1 425.577 3.414 20 0 IGADMO COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN([C@H](F)Oc1ccc(Cl)nn1)CC2 ZINC001164711899 720158194 /nfs/dbraw/zinc/15/81/94/720158194.db2.gz DJGIXCNKAMQLAE-XLIONFOSSA-N 1 1 435.931 3.160 20 0 IGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1ccc(C(=O)N3CCC[C@H](C)C3)cn1)C2 ZINC001164816376 720165432 /nfs/dbraw/zinc/16/54/32/720165432.db2.gz LDMPYAJUYVHOND-JTJYXVOQSA-N 1 1 426.605 3.138 20 0 IGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN([C@@](F)(COc1cncc(Cl)n1)C(F)F)C2 ZINC001164816353 720179345 /nfs/dbraw/zinc/17/93/45/720179345.db2.gz KZSCQAZOUMLCGS-YSSFQJQWSA-N 1 1 448.917 3.120 20 0 IGADMO CC(C)[N@@H+](C)Cc1cc(=O)n2c(n1)CN(C(F)(F)c1cc(Cl)nc(Cl)n1)CCC2 ZINC001164811939 720211038 /nfs/dbraw/zinc/21/10/38/720211038.db2.gz KLYMSXSJBGTZKS-UHFFFAOYSA-N 1 1 447.317 3.136 20 0 IGADMO CC(C)[N@@H+](C)Cc1cc(=O)n2c(n1)CN(c1nc(Cl)ccc1CN1CCCC1)CCC2 ZINC001164814731 720227300 /nfs/dbraw/zinc/22/73/00/720227300.db2.gz XEKGJLDJKAZOSQ-UHFFFAOYSA-N 1 1 445.011 3.138 20 0 IGADMO CC(C)[N@@H+](C)Cc1cc(=O)n2c(n1)CN(c1cc(F)cc3ncnc(Cl)c31)CCC2 ZINC001164813867 720232680 /nfs/dbraw/zinc/23/26/80/720232680.db2.gz QOTZEIZNCHOTAO-UHFFFAOYSA-N 1 1 430.915 3.230 20 0 IGADMO CC(C)[N@@H+](C)Cc1cc(=O)n2c(n1)CN(c1ccc(NC(=O)OC(C)(C)C)cn1)CCC2 ZINC001164813399 720234937 /nfs/dbraw/zinc/23/49/37/720234937.db2.gz NWOZQNFMCPIORY-UHFFFAOYSA-N 1 1 442.564 3.236 20 0 IGADMO CNC(=O)C[N@@H+]1CCOC[C@@]2(CCCN(c3cc(Cl)nc4cc(Cl)ccc43)C2)C1 ZINC001164719354 720237470 /nfs/dbraw/zinc/23/74/70/720237470.db2.gz LEHSMMODDNYMHA-NRFANRHFSA-N 1 1 437.371 3.206 20 0 IGADMO CNC(=O)C[N@H+]1CCOC[C@@]2(CCCN(c3cc(Cl)nc4cc(Cl)ccc43)C2)C1 ZINC001164719354 720237490 /nfs/dbraw/zinc/23/74/90/720237490.db2.gz LEHSMMODDNYMHA-NRFANRHFSA-N 1 1 437.371 3.206 20 0 IGADMO CCc1nc(Cl)nc(Cl)c1N1CCCn2c(=O)cc(C[N@@H+](C)C(C)C)nc2C1 ZINC001164816095 720245426 /nfs/dbraw/zinc/24/54/26/720245426.db2.gz GPWURAFHIMQZON-UHFFFAOYSA-N 1 1 425.364 3.153 20 0 IGADMO CCOC(=O)c1cnc(Cl)nc1C(F)(F)N1CC[C@H]2[C@H]1CC[N@@H+]2Cc1cccnc1 ZINC001164725593 720334180 /nfs/dbraw/zinc/33/41/80/720334180.db2.gz NZDMSSRUYKVSEQ-JKSUJKDBSA-N 1 1 437.878 3.100 20 0 IGADMO CCOC(=O)c1cnc(Cl)nc1C(F)(F)N1CC[C@H]2[C@H]1CC[N@H+]2Cc1cccnc1 ZINC001164725593 720334186 /nfs/dbraw/zinc/33/41/86/720334186.db2.gz NZDMSSRUYKVSEQ-JKSUJKDBSA-N 1 1 437.878 3.100 20 0 IGADMO CCOC(=O)c1cnc(Cl)nc1C(F)(F)N1CC[C@@H]2[C@H]1CC[N@@H+]2Cc1cccnc1 ZINC001164725592 720334635 /nfs/dbraw/zinc/33/46/35/720334635.db2.gz NZDMSSRUYKVSEQ-HZPDHXFCSA-N 1 1 437.878 3.100 20 0 IGADMO CCOC(=O)c1cnc(Cl)nc1C(F)(F)N1CC[C@@H]2[C@H]1CC[N@H+]2Cc1cccnc1 ZINC001164725592 720334641 /nfs/dbraw/zinc/33/46/41/720334641.db2.gz NZDMSSRUYKVSEQ-HZPDHXFCSA-N 1 1 437.878 3.100 20 0 IGADMO c1cncc(C[N@H+]2CC[C@H]3[C@H]2CCN3c2nccc(-c3cnc(N4CCCCC4)nc3)n2)c1 ZINC001164725956 720401616 /nfs/dbraw/zinc/40/16/16/720401616.db2.gz OGZAAJYXDOZUOK-PKTZIBPZSA-N 1 1 442.571 3.172 20 0 IGADMO c1cncc(C[N@H+]2CC[C@H]3[C@@H]2CCN3c2nccc(-c3cnc(N4CCCCC4)nc3)n2)c1 ZINC001164725952 720402095 /nfs/dbraw/zinc/40/20/95/720402095.db2.gz OGZAAJYXDOZUOK-GOTSBHOMSA-N 1 1 442.571 3.172 20 0 IGADMO COc1cc2ncnc(N3CC[C@@H]4[C@@H](C[C@@H](Cn5cccn5)[N@H+]4C(C)C)C3)c2cc1OC ZINC001164834879 720519557 /nfs/dbraw/zinc/51/95/57/720519557.db2.gz HUFMULYFRVXVLH-BBTUJRGHSA-N 1 1 436.560 3.221 20 0 IGADMO CC(C)[N@@H+]1[C@@H]2CCN(c3nccc(C(=O)OC(C)(C)C)n3)C[C@@H]2C[C@H]1Cn1cccn1 ZINC001164840120 720558509 /nfs/dbraw/zinc/55/85/09/720558509.db2.gz RLRQHEGOQWLMDI-CMKODMSKSA-N 1 1 426.565 3.006 20 0 IGADMO COc1nc(-c2ccccc2)nc(N2CC[C@@H]3[C@@H](C[C@@H](Cn4cccn4)[N@H+]3C(C)C)C2)n1 ZINC001164838605 720561795 /nfs/dbraw/zinc/56/17/95/720561795.db2.gz OSXLIQNHOISZCZ-PCCBWWKXSA-N 1 1 433.560 3.122 20 0 IGADMO CCOC(=O)c1nc(N2CC[C@@H]3[C@H](C[C@H](Cn4cccn4)[N@H+]3C(C)C)C2)ccc1Cl ZINC001164837749 720583148 /nfs/dbraw/zinc/58/31/48/720583148.db2.gz JCQSMUAWKFWPAO-ZHALLVOQSA-N 1 1 431.968 3.486 20 0 IGADMO Cc1cc(NC(=O)c2cccnc2N2CC[C@@H]3[C@@H](C[C@H](Cn4cccn4)[N@@H+]3C(C)C)C2)no1 ZINC001164842735 720598787 /nfs/dbraw/zinc/59/87/87/720598787.db2.gz VIGRQBIJBIOLOP-QKNQBKEWSA-N 1 1 449.559 3.205 20 0 IGADMO COc1nnc(Cl)cc1C(F)(F)N1CC[C@@H]2[C@@H](C[C@@H](Cn3cccn3)[N@H+]2C(C)C)C1 ZINC001164843181 720644709 /nfs/dbraw/zinc/64/47/09/720644709.db2.gz UORUFZSPNYGZPE-YQQAZPJKSA-N 1 1 440.926 3.258 20 0 IGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@H]2CN(C(F)(F)c3cc[n+]([O-])c(Cl)c3)CC[C@@H]21 ZINC001164837007 720647516 /nfs/dbraw/zinc/64/75/16/720647516.db2.gz AQTPAIXQZOERJO-SZMVWBNQSA-N 1 1 425.911 3.093 20 0 IGADMO CCOC(=O)c1c[n-]c2nc[nH+]c(N3CCC4(C[C@H]([N@@H+](C)Cc5ccccc5)CO4)CC3)c12 ZINC001164841109 720674885 /nfs/dbraw/zinc/67/48/85/720674885.db2.gz PFOFIRMYTOGJLN-IBGZPJMESA-N 1 1 449.555 3.395 20 0 IGADMO CCOC(=O)c1c[nH]c2ncnc(N3CCC4(C[C@H]([N@H+](C)Cc5ccccc5)CO4)CC3)c12 ZINC001164841109 720674891 /nfs/dbraw/zinc/67/48/91/720674891.db2.gz PFOFIRMYTOGJLN-IBGZPJMESA-N 1 1 449.555 3.395 20 0 IGADMO CCOC(=O)c1c[nH]c2ncnc(N3CCC4(C[C@H]([N@@H+](C)Cc5ccccc5)CO4)CC3)c12 ZINC001164841109 720674893 /nfs/dbraw/zinc/67/48/93/720674893.db2.gz PFOFIRMYTOGJLN-IBGZPJMESA-N 1 1 449.555 3.395 20 0 IGADMO COC(=O)c1c[n-]c2nc[nH+]c(N3CCC4(C[C@H]([N@@H+](C)Cc5ccccc5)CO4)CC3)c12 ZINC001164844933 720697722 /nfs/dbraw/zinc/69/77/22/720697722.db2.gz WPPKVXKXKWRKFK-SFHVURJKSA-N 1 1 435.528 3.004 20 0 IGADMO COC(=O)c1c[nH]c2ncnc(N3CCC4(C[C@H]([N@H+](C)Cc5ccccc5)CO4)CC3)c12 ZINC001164844933 720697739 /nfs/dbraw/zinc/69/77/39/720697739.db2.gz WPPKVXKXKWRKFK-SFHVURJKSA-N 1 1 435.528 3.004 20 0 IGADMO COC(=O)c1c[nH]c2ncnc(N3CCC4(C[C@H]([N@@H+](C)Cc5ccccc5)CO4)CC3)c12 ZINC001164844933 720697744 /nfs/dbraw/zinc/69/77/44/720697744.db2.gz WPPKVXKXKWRKFK-SFHVURJKSA-N 1 1 435.528 3.004 20 0 IGADMO c1cc(-c2nc3ccccc3c(N3CC[N@@H+]4C[C@H](Oc5cncnc5)C[C@@H]4C3)n2)cs1 ZINC001164745385 720767085 /nfs/dbraw/zinc/76/70/85/720767085.db2.gz VNUDMFMOJPSLMW-QZTJIDSGSA-N 1 1 430.537 3.490 20 0 IGADMO CSc1nc2sccc2c(N2CC[C@@H]3[C@@H](C[C@@H](Cn4cncn4)[N@H+]3CC3CC3)C2)n1 ZINC001164751220 720814140 /nfs/dbraw/zinc/81/41/40/720814140.db2.gz XMAHVPVUDLCXFH-XYJFISCASA-N 1 1 441.630 3.384 20 0 IGADMO CC(C)(C)OC(=O)c1ccnc(N2CC[C@@H]3[C@@H](C[C@H](Cn4cncn4)[N@H+]3CC3CC3)C2)c1 ZINC001164742056 720815622 /nfs/dbraw/zinc/81/56/22/720815622.db2.gz PGIIPIJCLJLPTE-PWRODBHTSA-N 1 1 438.576 3.008 20 0 IGADMO c1ncn(C[C@@H]2C[C@H]3CN(c4cc(Oc5ccccc5)ncn4)CC[C@H]3[N@H+]2CC2CC2)n1 ZINC001164741303 720816919 /nfs/dbraw/zinc/81/69/19/720816919.db2.gz NJZKLTPKYAVKNJ-JAXLGGSGSA-N 1 1 431.544 3.240 20 0 IGADMO Fc1ccc(Cl)nc1C(F)(F)N1CC[C@@H]2[C@@H](C[C@@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164737388 720827199 /nfs/dbraw/zinc/82/71/99/720827199.db2.gz ASACVSKRXLHMBE-YQQAZPJKSA-N 1 1 440.901 3.390 20 0 IGADMO CSc1nc2ccccc2c(N2CC[C@@H]3[C@H](C[C@H](Cn4cncn4)[N@H+]3CC3CC3)C2)n1 ZINC001164750222 720833070 /nfs/dbraw/zinc/83/30/70/720833070.db2.gz WSDUWUOFCFJQOY-DBXWQHBBSA-N 1 1 435.601 3.323 20 0 IGADMO Fc1cccc(Oc2cncc(N3CC[C@@H]4[C@@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)n2)c1 ZINC001164743689 720839418 /nfs/dbraw/zinc/83/94/18/720839418.db2.gz JUCHSEASFJEGSJ-CZTZKLFOSA-N 1 1 449.534 3.379 20 0 IGADMO Cc1ccc(-c2ccc(N3CC[C@@H]4[C@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)nn2)cc1 ZINC001164742483 720844955 /nfs/dbraw/zinc/84/49/55/720844955.db2.gz GSDYXLHRKXZCMS-CQOQZXRMSA-N 1 1 429.572 3.423 20 0 IGADMO COc1ccccc1-c1ccnc(N2CC[C@@H]3[C@H](C[C@H](Cn4cncn4)[N@H+]3CC3CC3)C2)n1 ZINC001164749716 720849434 /nfs/dbraw/zinc/84/94/34/720849434.db2.gz WPWLLXBHILOBLQ-TXTKFYIRSA-N 1 1 445.571 3.123 20 0 IGADMO Fc1cc2ncc(Cl)nc2cc1N1CC[C@@H]2[C@@H](C[C@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164744643 720850802 /nfs/dbraw/zinc/85/08/02/720850802.db2.gz LABSMUIOUUJJRN-RZQQEMMASA-N 1 1 441.942 3.393 20 0 IGADMO Fc1cccc(-c2ccc(N3CC[C@@H]4[C@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)nn2)c1 ZINC001164751974 720852356 /nfs/dbraw/zinc/85/23/56/720852356.db2.gz RYNQKGMIZNHPES-UNWVZKJWSA-N 1 1 433.535 3.254 20 0 IGADMO COCC[N@H+]1CCO[C@H]2CN(c3cc(Oc4ccc(SC)cc4)ncn3)CC[C@@H]2C1 ZINC001164862130 720869040 /nfs/dbraw/zinc/86/90/40/720869040.db2.gz ZCVUTNMAZBQOOS-XLIONFOSSA-N 1 1 430.574 3.164 20 0 IGADMO COc1nc(Cl)cc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COCc2cccnc2)n1 ZINC001164749081 720871863 /nfs/dbraw/zinc/87/18/63/720871863.db2.gz GRSDCPGACKHXTO-WMZHIEFXSA-N 1 1 443.979 3.289 20 0 IGADMO CSc1cc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COCc2cccnc2)ncn1 ZINC001164749045 720877313 /nfs/dbraw/zinc/87/73/13/720877313.db2.gz GLHUYNOLROZRGD-NZQKXSOJSA-N 1 1 425.602 3.349 20 0 IGADMO Cn1ccc2c1ncnc2N1CC[C@@]2(C1)C[N@@H+](CC1CC1)C[C@H]2COCc1cccnc1 ZINC001164754847 720877446 /nfs/dbraw/zinc/87/74/46/720877446.db2.gz TXUDFVWJEAHZJK-OFVILXPXSA-N 1 1 432.572 3.118 20 0 IGADMO COCOc1ccc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COCc2cccnc2)nc1 ZINC001164753872 720891643 /nfs/dbraw/zinc/89/16/43/720891643.db2.gz HJWNDWZHPUIRDZ-RDGATRHJSA-N 1 1 438.572 3.214 20 0 IGADMO CCC[N@H+]1CCCC[C@@H]1c1ccc(N2CCCn3c(=O)cc(Cn4ccnc4)nc3C2)nc1 ZINC001164858605 720896569 /nfs/dbraw/zinc/89/65/69/720896569.db2.gz MLTFKRKRLSSBBM-JOCHJYFZSA-N 1 1 447.587 3.230 20 0 IGADMO CSc1ccc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COCc2cccnc2)nn1 ZINC001164747249 720909800 /nfs/dbraw/zinc/90/98/00/720909800.db2.gz CJAAAACJEXWTPI-NZQKXSOJSA-N 1 1 425.602 3.349 20 0 IGADMO COC(=O)c1nc(Cl)c(N2CCn3c(C[N@@H+](C)C(C)C)cnc3[C@H]2C)c(Cl)n1 ZINC001164857320 721019932 /nfs/dbraw/zinc/01/99/32/721019932.db2.gz CUVKGUUBLSDWHN-LLVKDONJSA-N 1 1 427.336 3.188 20 0 IGADMO CC(C)(c1ccnc(Cl)c1)[N@H+]1CC[C@@H]2OCC[C@@H](C(=O)NCc3ccccn3)[C@@H]2C1 ZINC001164760079 721023461 /nfs/dbraw/zinc/02/34/61/721023461.db2.gz NUGJHBREKKCZRS-AABGKKOBSA-N 1 1 428.964 3.409 20 0 IGADMO C[NH+]1CCC(Oc2ccnc(N3CCC[C@]4(C[C@@H](OCc5ccccn5)CO4)C3)c2)CC1 ZINC001164761469 721031904 /nfs/dbraw/zinc/03/19/04/721031904.db2.gz GFHXQBYCYKVQON-NOZRDPDXSA-N 1 1 438.572 3.294 20 0 IGADMO CSc1nc(Cl)cc(C(F)(F)N2C[C@H]3CC[N@@H+](Cc4cnn(C)c4)C[C@@H]3C2)n1 ZINC001164767391 721081824 /nfs/dbraw/zinc/08/18/24/721081824.db2.gz LPJXHAYWZWVAHU-ZIAGYGMSSA-N 1 1 428.940 3.089 20 0 IGADMO COc1cccc2nc(Cl)nc(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@H]4C3)c21 ZINC001164866190 721097725 /nfs/dbraw/zinc/09/77/25/721097725.db2.gz RUEYRKTWXARRMP-DLBZAZTESA-N 1 1 425.920 3.167 20 0 IGADMO Clc1ccc(CN2CCCC2)c(N2CC[N@H+]3C[C@@H](OCc4cccnc4)C[C@H]3C2)n1 ZINC001164864582 721101290 /nfs/dbraw/zinc/10/12/90/721101290.db2.gz GMYPNAKCMGYSFW-SFTDATJTSA-N 1 1 427.980 3.206 20 0 IGADMO CCOC(=O)c1cc2c(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@H]4C3)[nH]c(C)c(C)c-2n1 ZINC001164866350 721107730 /nfs/dbraw/zinc/10/77/30/721107730.db2.gz SOGMCKSRYSZVFC-PMACEKPBSA-N 1 1 449.555 3.231 20 0 IGADMO CCOC(=O)c1cc2ccccc2nc1N1CC[N@H+]2C[C@@H](OCc3cccnc3)C[C@@H]2C1 ZINC001164864395 721111748 /nfs/dbraw/zinc/11/17/48/721111748.db2.gz FSXRFSCVOKHTKO-RTWAWAEBSA-N 1 1 432.524 3.286 20 0 IGADMO FC(F)(c1cc(C2CC2)nnc1Cl)N1CC[N@H+]2C[C@H](OCc3cccnc3)C[C@@H]2C1 ZINC001164879834 721148922 /nfs/dbraw/zinc/14/89/22/721148922.db2.gz UJQRTYJWQQQVGS-IAGOWNOFSA-N 1 1 435.906 3.427 20 0 IGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4cc(Cl)ncc4C(=O)OC(C)(C)C)C[C@@H]3C2)cn1 ZINC001164768345 721155417 /nfs/dbraw/zinc/15/54/17/721155417.db2.gz OHUVAKNEAJHPHV-IRXDYDNUSA-N 1 1 431.968 3.382 20 0 IGADMO COc1ccc(-c2ccc(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@@H]4C3)nn2)c(OC)c1 ZINC001164879112 721163650 /nfs/dbraw/zinc/16/36/50/721163650.db2.gz RTSRKVBWWNGCIH-TZIWHRDSSA-N 1 1 447.539 3.036 20 0 IGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4nc(-c5ccccn5)nc5ccccc54)C[C@H]3C2)cn1 ZINC001164771848 721197562 /nfs/dbraw/zinc/19/75/62/721197562.db2.gz RGZRSQIOSGVLDC-VQTJNVASSA-N 1 1 425.540 3.384 20 0 IGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4ncc(C(=O)NC5CCCC5)cc4Cl)C[C@@H]3C2)cn1 ZINC001164773388 721205222 /nfs/dbraw/zinc/20/52/22/721205222.db2.gz WWTXXQBCDJCXOP-MJGOQNOKSA-N 1 1 442.995 3.099 20 0 IGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4ncc(C(=O)NC5CCCC5)cc4Cl)C[C@H]3C2)cn1 ZINC001164773389 721205611 /nfs/dbraw/zinc/20/56/11/721205611.db2.gz WWTXXQBCDJCXOP-PKOBYXMFSA-N 1 1 442.995 3.099 20 0 IGADMO CN(C)C(=O)C[N@H+]1CCOCC2(CCN(c3c(Cl)ncc(Cl)c3Cl)CC2)C1 ZINC001164875348 721275816 /nfs/dbraw/zinc/27/58/16/721275816.db2.gz VPZKLVNVVOHRDU-UHFFFAOYSA-N 1 1 435.783 3.049 20 0 IGADMO Cc1ccc2c(c1)nc(Cl)cc2N1CCC2(CC1)COCC[N@H+](CC(=O)N(C)C)C2 ZINC001164874407 721277343 /nfs/dbraw/zinc/27/73/43/721277343.db2.gz QNMQMBYQGGLIKI-UHFFFAOYSA-N 1 1 430.980 3.204 20 0 IGADMO CN(C)C(=O)C[N@H+]1CCOCC2(CCN(c3nccc4cc(F)c(Cl)cc43)CC2)C1 ZINC001164879153 721292086 /nfs/dbraw/zinc/29/20/86/721292086.db2.gz VRUAAUWEHOENCX-UHFFFAOYSA-N 1 1 434.943 3.034 20 0 IGADMO C[N@@H+](Cc1ccc(N2CC[C@@H]3CN(C(=O)c4ccsc4)CCO[C@@H]3C2)nc1)C1CC1 ZINC001164876606 721299311 /nfs/dbraw/zinc/29/93/11/721299311.db2.gz JJAWOZJPZWEULU-WIYYLYMNSA-N 1 1 426.586 3.105 20 0 IGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2C[C@@H]3OCC[C@@H]3[C@@H](C(=O)NCc3cccnc3)C2)nc1 ZINC001164873368 721305127 /nfs/dbraw/zinc/30/51/27/721305127.db2.gz BEQDIDBHBXVLSE-QPXUXIHVSA-N 1 1 449.599 3.181 20 0 IGADMO C[NH+]1CCC(Oc2ccnc(N3CCC4(C[C@H](Oc5ncccc5F)CO4)CC3)c2)CC1 ZINC001164775935 721327362 /nfs/dbraw/zinc/32/73/62/721327362.db2.gz AVCLXWVIIQZPMU-FQEVSTJZSA-N 1 1 442.535 3.296 20 0 IGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@@]2(CCCN(C(F)(F)c3ccnc(Cl)n3)C2)C1 ZINC001164776116 721331027 /nfs/dbraw/zinc/33/10/27/721331027.db2.gz CPMJPTFCNHOLTI-IBGZPJMESA-N 1 1 441.910 3.399 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@@]2(CCCN(C(F)(F)c3ccnc(Cl)n3)C2)C1 ZINC001164776116 721331029 /nfs/dbraw/zinc/33/10/29/721331029.db2.gz CPMJPTFCNHOLTI-IBGZPJMESA-N 1 1 441.910 3.399 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@@]2(CCCN(c3ncnc4ccc(F)cc43)C2)C1 ZINC001164778789 721336809 /nfs/dbraw/zinc/33/68/09/721336809.db2.gz YJRQAVXZXBZGBF-QHCPKHFHSA-N 1 1 425.508 3.493 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@@]2(CCCN(c3nnc(Cl)c4ccncc43)C2)C1 ZINC001164776532 721338458 /nfs/dbraw/zinc/33/84/58/721338458.db2.gz GCSHLIHEIZRYJX-QFIPXVFZSA-N 1 1 442.951 3.402 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@]2(CCCN(c3ncnc4nc(Cl)ccc43)C2)C1 ZINC001164778618 721338837 /nfs/dbraw/zinc/33/88/37/721338837.db2.gz XTRHINLBRGZJDM-JOCHJYFZSA-N 1 1 442.951 3.402 20 0 IGADMO CCOC(=O)c1cc(C)cc(N2CCC[C@]3(C2)COCC[N@@H+](Cc2c(C)noc2C)C3)n1 ZINC001164778206 721339891 /nfs/dbraw/zinc/33/98/91/721339891.db2.gz KZCYNPRIHCIDRC-DEOSSOPVSA-N 1 1 442.560 3.291 20 0 IGADMO COc1ccc2ncc(N3CCC[C@]4(C3)COCC[N@H+](Cc3c(C)noc3C)C4)nc2c1 ZINC001164777180 721351411 /nfs/dbraw/zinc/35/14/11/721351411.db2.gz DYKCMSZMEDPDDB-DEOSSOPVSA-N 1 1 437.544 3.362 20 0 IGADMO COc1ccc2ncc(N3CCC[C@]4(C3)COCC[N@@H+](Cc3c(C)noc3C)C4)nc2c1 ZINC001164777180 721351413 /nfs/dbraw/zinc/35/14/13/721351413.db2.gz DYKCMSZMEDPDDB-DEOSSOPVSA-N 1 1 437.544 3.362 20 0 IGADMO COC(=O)c1ccc(Cl)c(N2CCC[C@@]3(C2)COCC[N@H+](Cc2c(C)noc2C)C3)n1 ZINC001164777799 721353447 /nfs/dbraw/zinc/35/34/47/721353447.db2.gz ICDLTVLDHSNFIV-JOCHJYFZSA-N 1 1 448.951 3.245 20 0 IGADMO COC(=O)c1ccc(Cl)c(N2CCC[C@@]3(C2)COCC[N@@H+](Cc2c(C)noc2C)C3)n1 ZINC001164777799 721353452 /nfs/dbraw/zinc/35/34/52/721353452.db2.gz ICDLTVLDHSNFIV-JOCHJYFZSA-N 1 1 448.951 3.245 20 0 IGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@]2(CCCN(C(F)(F)c3nccnc3Cl)C2)C1 ZINC001164783993 721362920 /nfs/dbraw/zinc/36/29/20/721362920.db2.gz QCJAEPOUDXWTPF-LJQANCHMSA-N 1 1 441.910 3.399 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@]2(CCCN(C(F)(F)c3nccnc3Cl)C2)C1 ZINC001164783993 721362923 /nfs/dbraw/zinc/36/29/23/721362923.db2.gz QCJAEPOUDXWTPF-LJQANCHMSA-N 1 1 441.910 3.399 20 0 IGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@]2(CCCN(c3cc(-c4ccccn4)ncn3)C2)C1 ZINC001164786038 721367359 /nfs/dbraw/zinc/36/73/59/721367359.db2.gz UXZKDMDXRPAUSJ-XMMPIXPASA-N 1 1 434.544 3.262 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@]2(CCCN(c3cc(-c4ccccn4)ncn3)C2)C1 ZINC001164786038 721367364 /nfs/dbraw/zinc/36/73/64/721367364.db2.gz UXZKDMDXRPAUSJ-XMMPIXPASA-N 1 1 434.544 3.262 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@@]2(CCCN(c3nc(C(N)=O)cc4ccccc43)C2)C1 ZINC001164782948 721368550 /nfs/dbraw/zinc/36/85/50/721368550.db2.gz NZHPDFSTHZPSJL-VWLOTQADSA-N 1 1 449.555 3.058 20 0 IGADMO Cc1cc(C(F)(F)N2CC[C@@]3(C2)CCC[C@@H](CN2CC[NH+](C)CC2)O3)cc(Cl)n1 ZINC001164894058 721383848 /nfs/dbraw/zinc/38/38/48/721383848.db2.gz XBBOZBIIUKMSAS-AZUAARDMSA-N 1 1 428.955 3.354 20 0 IGADMO CSc1nc2sccc2c(N2CC[C@@]3(C2)CCC[C@H](CN2CC[NH+](C)CC2)O3)n1 ZINC001164888069 721387594 /nfs/dbraw/zinc/38/75/94/721387594.db2.gz JFFCYHSGOZOQPC-IIBYNOLFSA-N 1 1 433.647 3.179 20 0 IGADMO C[NH+]1CCN(C[C@H]2CCC[C@]3(CCN(c4nc(Cl)nc5cccc(F)c54)C3)O2)CC1 ZINC001164883501 721401115 /nfs/dbraw/zinc/40/11/15/721401115.db2.gz AFBOMUTXSUDCMI-OPAMFIHVSA-N 1 1 433.959 3.188 20 0 IGADMO C[NH+]1CCN(C[C@H]2CCC[C@]3(CCN(C(F)(F)c4cnc(Cl)c(F)c4)C3)O2)CC1 ZINC001164885635 721406739 /nfs/dbraw/zinc/40/67/39/721406739.db2.gz GWGBKCSWFWIPPO-VQIMIIECSA-N 1 1 432.918 3.184 20 0 IGADMO COc1cccc2c1nc(Cl)nc2N1CC[C@]2(C1)CCC[C@H](CN1CC[NH+](C)CC1)O2 ZINC001164889990 721410176 /nfs/dbraw/zinc/41/01/76/721410176.db2.gz RYXVHKRHQRQUPG-HXOBKFHXSA-N 1 1 445.995 3.057 20 0 IGADMO C[NH+]1CCN(C[C@H]2CCC[C@@]3(CCN(C(F)(F)c4cc(Cl)ncc4F)C3)O2)CC1 ZINC001164886669 721410189 /nfs/dbraw/zinc/41/01/89/721410189.db2.gz KSMBAAUTEZJEGP-BEFAXECRSA-N 1 1 432.918 3.184 20 0 IGADMO Cc1ccc(C(F)(F)N2CC[C@@]3(C2)CCC[C@H](CN2CC[NH+](C)CC2)O3)nc1Cl ZINC001164892866 721415855 /nfs/dbraw/zinc/41/58/55/721415855.db2.gz YZAQPNCUFHDTFE-YLJYHZDGSA-N 1 1 428.955 3.354 20 0 IGADMO COc1ccc2nc(Cl)cc(N3CC[C@]4(C3)CCC[C@@H](CN3CC[NH+](C)CC3)O4)c2n1 ZINC001164891471 721416596 /nfs/dbraw/zinc/41/65/96/721416596.db2.gz WIFIKPZAIAUXOM-SBUREZEXSA-N 1 1 445.995 3.057 20 0 IGADMO CC(C)(C)OC(=O)Nc1cnc(N2C[C@@H]3C[N@@H+](Cc4nccs4)C[C@@H]3C2)c2[nH]cnc21 ZINC001164784816 721423410 /nfs/dbraw/zinc/42/34/10/721423410.db2.gz MNFOJEHOQVGIFE-OKILXGFUSA-N 1 1 441.561 3.330 20 0 IGADMO CC(C)(C)OC(=O)Nc1cnc(N2C[C@@H]3C[N@H+](Cc4nccs4)C[C@@H]3C2)c2[nH]cnc21 ZINC001164784816 721423413 /nfs/dbraw/zinc/42/34/13/721423413.db2.gz MNFOJEHOQVGIFE-OKILXGFUSA-N 1 1 441.561 3.330 20 0 IGADMO FC(F)(Cc1nc2c(ncnc2Cl)s1)N1C[C@@H]2C[NH+](Cc3nccs3)C[C@H]2C1 ZINC001164784862 721440005 /nfs/dbraw/zinc/44/00/05/721440005.db2.gz QYQADHSFZMQORC-QWRGUYRKSA-N 1 1 442.948 3.395 20 0 IGADMO CCc1ccc(-c2ccc(N3CC[C@@]4(C3)CCC[C@H](CN3CC[NH+](C)CC3)O4)nn2)cc1 ZINC001164894431 721440211 /nfs/dbraw/zinc/44/02/11/721440211.db2.gz MOLMXXAQOFTUHX-ZEQKJWHPSA-N 1 1 435.616 3.471 20 0 IGADMO C[NH+]1CCN(C[C@H]2CCC[C@@]3(CCN(c4ncnc5[nH]c6cc(F)ccc6c54)C3)O2)CC1 ZINC001164887128 721452790 /nfs/dbraw/zinc/45/27/90/721452790.db2.gz IVOFKRXSAXCCJV-KOSHJBKYSA-N 1 1 438.551 3.016 20 0 IGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1nc(Cl)nc3ncccc31)CC2 ZINC001164785949 721453274 /nfs/dbraw/zinc/45/32/74/721453274.db2.gz JXRYRPLTZBPZKD-SFHVURJKSA-N 1 1 445.995 3.412 20 0 IGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1nc(Cl)nc3nc(C)[nH]c31)CC2 ZINC001164788709 721455636 /nfs/dbraw/zinc/45/56/36/721455636.db2.gz SVFPJUZPHDBXGD-KRWDZBQOSA-N 1 1 448.999 3.049 20 0 IGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1ncnc3[nH]c(C)c(C)c31)CC2 ZINC001164785003 721460495 /nfs/dbraw/zinc/46/04/95/721460495.db2.gz LFIMBUPTCIHGPK-FQEVSTJZSA-N 1 1 427.593 3.309 20 0 IGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1nccc(N3CCCCC3)n1)CC2 ZINC001164783583 721462779 /nfs/dbraw/zinc/46/27/79/721462779.db2.gz DNLVAWJWVZSFKB-JOCHJYFZSA-N 1 1 443.636 3.201 20 0 IGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(C(F)(F)c1nccnc1Cl)CC2 ZINC001164784861 721464717 /nfs/dbraw/zinc/46/47/17/721464717.db2.gz KNIMGWGSFQVPNJ-KRWDZBQOSA-N 1 1 444.954 3.409 20 0 IGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1c(F)nc(F)nc1Cl)CC2 ZINC001164787182 721465122 /nfs/dbraw/zinc/46/51/22/721465122.db2.gz DCOHGMAAEGQECB-HNNXBMFYSA-N 1 1 430.927 3.142 20 0 IGADMO C[NH+]1CCC(Oc2ccnc(N3CCC4(CCC(=O)N4Cc4ccncc4)CC3)c2)CC1 ZINC001164900184 721507181 /nfs/dbraw/zinc/50/71/81/721507181.db2.gz PALXFXAROJYQKD-UHFFFAOYSA-N 1 1 435.572 3.111 20 0 IGADMO CCOC(=O)c1cnc(C2CC2)nc1N1CC[N@H+]2C[C@H](Oc3cccc(F)c3)C[C@H]2C1 ZINC001164908271 721533797 /nfs/dbraw/zinc/53/37/97/721533797.db2.gz PPABFFFXUPWEFZ-PKOBYXMFSA-N 1 1 426.492 3.012 20 0 IGADMO COC(=O)c1ccc2ccnc(N3C[C@H]([N@@H+](C)Cc4cccnc4)[C@@H]4OCCC[C@@H]43)c2c1 ZINC001164806613 721547807 /nfs/dbraw/zinc/54/78/07/721547807.db2.gz PGFIXVKIHXQOGR-RJGXRXQPSA-N 1 1 432.524 3.285 20 0 IGADMO COC(=O)c1ccc2c(ccnc2N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@@H]32)c1 ZINC001164806645 721547890 /nfs/dbraw/zinc/54/78/90/721547890.db2.gz PPKMAKVOXOOVRH-RJGXRXQPSA-N 1 1 432.524 3.285 20 0 IGADMO Fc1cccc(O[C@@H]2C[C@H]3CN(C(F)(F)c4cc(Cl)nc(=S)[nH]4)CC[N@H+]3C2)c1 ZINC001164904738 721548814 /nfs/dbraw/zinc/54/88/14/721548814.db2.gz GGJHHNVMVFHGRB-GXTWGEPZSA-N 1 1 430.883 3.445 20 0 IGADMO COC(=O)c1c(Cl)cnc(N2CC[N@H+]3C[C@H](Oc4cccc(F)c4)C[C@@H]3C2)c1OC ZINC001164909353 721549142 /nfs/dbraw/zinc/54/91/42/721549142.db2.gz RQWZRFPKQKMYAX-GDBMZVCRSA-N 1 1 435.883 3.011 20 0 IGADMO Cc1cc(NC(=O)c2cccnc2N2CC[N@H+]3C[C@H](Oc4cccc(F)c4)C[C@H]3C2)no1 ZINC001164903539 721551921 /nfs/dbraw/zinc/55/19/21/721551921.db2.gz CCMCEVFYFKYXPB-PKOBYXMFSA-N 1 1 437.475 3.111 20 0 IGADMO CC1CCN(C(=O)c2cccnc2N2CC[N@H+]3C[C@H](Oc4cccc(F)c4)C[C@@H]3C2)CC1 ZINC001164907251 721553746 /nfs/dbraw/zinc/55/37/46/721553746.db2.gz NLFZXEDTHDBYEZ-IFMALSPDSA-N 1 1 438.547 3.435 20 0 IGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2nc(-c3cccnc3)nc3c2CCC3)[C@@H]2CCCO[C@@H]12 ZINC001164807535 721585638 /nfs/dbraw/zinc/58/56/38/721585638.db2.gz OIZMJHGXGTWZLW-WXFUMESZSA-N 1 1 442.567 3.291 20 0 IGADMO COC(=O)c1cc(Cl)c(N2C[C@H]([N@H+](C)Cc3cccnc3)[C@H]3OCCC[C@H]32)nc1C ZINC001164805784 721588608 /nfs/dbraw/zinc/58/86/08/721588608.db2.gz LXHPHVDXHRUEMS-AABGKKOBSA-N 1 1 430.936 3.093 20 0 IGADMO COC(=O)c1cc(Cl)c(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@H]3OCCC[C@H]32)nc1C ZINC001164805784 721588610 /nfs/dbraw/zinc/58/86/10/721588610.db2.gz LXHPHVDXHRUEMS-AABGKKOBSA-N 1 1 430.936 3.093 20 0 IGADMO CCOC(=O)c1cc(C)nc(N2CCC(F)(F)[C@]3(CC[N@@H+](Cc4ccccn4)C3)C2)n1 ZINC001164903748 721696098 /nfs/dbraw/zinc/69/60/98/721696098.db2.gz BZYHBDPJOZKOMQ-NRFANRHFSA-N 1 1 431.487 3.094 20 0 IGADMO F[C@H](Oc1cncc(Cl)n1)N1CCC(F)(F)[C@@]2(CC[N@@H+](Cc3ccccn3)C2)C1 ZINC001164911242 721732666 /nfs/dbraw/zinc/73/26/66/721732666.db2.gz JFONKRGRPRILSH-ZWKOTPCHSA-N 1 1 427.858 3.390 20 0 IGADMO CCOC(=O)Cc1ccnc(N2CCC(F)(F)[C@]3(CC[N@@H+](Cc4ccccn4)C3)C2)c1 ZINC001164909105 721736770 /nfs/dbraw/zinc/73/67/70/721736770.db2.gz BICGYBMEUXYNKF-QFIPXVFZSA-N 1 1 430.499 3.320 20 0 IGADMO CN(C)C(=O)C[NH+]1CCC2(CCCN2C(F)(F)C2(c3ccc(Cl)nc3)CC2)CC1 ZINC001165012878 721750347 /nfs/dbraw/zinc/75/03/47/721750347.db2.gz QJTPQYJZUQMVJG-UHFFFAOYSA-N 1 1 426.939 3.378 20 0 IGADMO CC(C)(c1ccnc(Cl)c1)[N@H+]1CC[C@@H]2OCC[C@@H](C(=O)NCCc3ccncc3)[C@@H]2C1 ZINC001165012580 721754154 /nfs/dbraw/zinc/75/41/54/721754154.db2.gz FDORHSNZGJZMCD-HKBOAZHASA-N 1 1 442.991 3.451 20 0 IGADMO CC(C)(c1ccnc(Cl)c1)[N@H+]1CC[C@@H]2OCC[C@H](C(=O)NCCc3ccncc3)[C@H]2C1 ZINC001165012578 721754560 /nfs/dbraw/zinc/75/45/60/721754560.db2.gz FDORHSNZGJZMCD-HBMCJLEFSA-N 1 1 442.991 3.451 20 0 IGADMO CN1CCc2nc(Cl)nc(N3CCc4c(C[N@H+](C)Cc5ccco5)cncc4C3)c2C1 ZINC001164912193 721764972 /nfs/dbraw/zinc/76/49/72/721764972.db2.gz VDHLAGUJUVBXAV-UHFFFAOYSA-N 1 1 438.963 3.301 20 0 IGADMO CN1CCc2nc(Cl)nc(N3CCc4c(C[N@@H+](C)Cc5ccco5)cncc4C3)c2C1 ZINC001164912193 721764974 /nfs/dbraw/zinc/76/49/74/721764974.db2.gz VDHLAGUJUVBXAV-UHFFFAOYSA-N 1 1 438.963 3.301 20 0 IGADMO Cc1cccc2c(Cl)nnc(N3CCO[C@@]4(C3)COCC[N@H+](Cc3cccnc3)C4)c12 ZINC001164914417 721781887 /nfs/dbraw/zinc/78/18/87/721781887.db2.gz CYSHRVMSUCVTLE-QHCPKHFHSA-N 1 1 439.947 3.094 20 0 IGADMO Cc1cccc2c(Cl)nnc(N3CCO[C@@]4(C3)COCC[N@@H+](Cc3cccnc3)C4)c12 ZINC001164914417 721781888 /nfs/dbraw/zinc/78/18/88/721781888.db2.gz CYSHRVMSUCVTLE-QHCPKHFHSA-N 1 1 439.947 3.094 20 0 IGADMO c1cn(C2CCCC2)c2nc[nH+]c(N3CCO[C@]4(C3)COCCN(Cc3cccnc3)C4)c12 ZINC001164915599 721785007 /nfs/dbraw/zinc/78/50/07/721785007.db2.gz LVJYWGHUEBKSAK-RUZDIDTESA-N 1 1 448.571 3.049 20 0 IGADMO CCOC(=O)c1c[n-]c2nc[nH+]c(N3C[C@@H]4CCC[C@H]([N@@H+](C)Cc5ccccn5)[C@@H]4C3)c12 ZINC001165024601 721805406 /nfs/dbraw/zinc/80/54/06/721805406.db2.gz MJOUEQHRNBVCJP-DBVUQKKJSA-N 1 1 434.544 3.267 20 0 IGADMO CCOC(=O)c1c[nH]c2ncnc(N3C[C@@H]4CCC[C@H]([N@H+](C)Cc5ccccn5)[C@@H]4C3)c12 ZINC001165024601 721805410 /nfs/dbraw/zinc/80/54/10/721805410.db2.gz MJOUEQHRNBVCJP-DBVUQKKJSA-N 1 1 434.544 3.267 20 0 IGADMO CCOC(=O)c1c[nH]c2ncnc(N3C[C@@H]4CCC[C@H]([N@@H+](C)Cc5ccccn5)[C@@H]4C3)c12 ZINC001165024601 721805411 /nfs/dbraw/zinc/80/54/11/721805411.db2.gz MJOUEQHRNBVCJP-DBVUQKKJSA-N 1 1 434.544 3.267 20 0 IGADMO c1ccc(C[N@@H+]2CCc3c(ncnc3N3CC[C@@]4(C[C@@H](Oc5cccnc5)CO4)C3)C2)cc1 ZINC001164916512 721805627 /nfs/dbraw/zinc/80/56/27/721805627.db2.gz PSGRHXHPMJBBOA-ATIYNZHBSA-N 1 1 443.551 3.247 20 0 IGADMO c1ccc(C[N@H+]2CCc3c(ncnc3N3CC[C@@]4(C[C@@H](Oc5cccnc5)CO4)C3)C2)cc1 ZINC001164916512 721805629 /nfs/dbraw/zinc/80/56/29/721805629.db2.gz PSGRHXHPMJBBOA-ATIYNZHBSA-N 1 1 443.551 3.247 20 0 IGADMO CCOC(=O)c1cc(Cl)nnc1N1C[C@@H]2CCC[C@@H]([N@@H+](C)Cc3ccccn3)[C@H]2C1 ZINC001165027335 721806051 /nfs/dbraw/zinc/80/60/51/721806051.db2.gz VNJMPTJNILSLKR-ZYSHUDEJSA-N 1 1 429.952 3.439 20 0 IGADMO C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@H]2CN(c3nc(Cl)ncc3N3CCOCC3)C[C@H]21 ZINC001165028956 721813192 /nfs/dbraw/zinc/81/31/92/721813192.db2.gz YFDDFYAWPKLCGK-DFQSSKMNSA-N 1 1 442.995 3.099 20 0 IGADMO C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@@H]2CN(c3ccc(C(=O)NC4CCCC4)nn3)C[C@H]21 ZINC001165023124 721827321 /nfs/dbraw/zinc/82/73/21/721827321.db2.gz HSJDWKKMXIHFMT-JMUQELJHSA-N 1 1 434.588 3.281 20 0 IGADMO COC(=O)c1cc(F)c(C)nc1N1CCC2(CC1)C[N@@H+](Cc1ccc(C)cc1)CCO2 ZINC001164939332 721925674 /nfs/dbraw/zinc/92/56/74/721925674.db2.gz IXVICKNVFYDPQK-UHFFFAOYSA-N 1 1 427.520 3.496 20 0 IGADMO CCOC(=O)c1cnc(CC)nc1N1CCC2(CC1)C[N@@H+](Cc1ccc(C)cc1)CCO2 ZINC001164938619 721932804 /nfs/dbraw/zinc/93/28/04/721932804.db2.gz BCTGGWKAHWOPFT-UHFFFAOYSA-N 1 1 438.572 3.396 20 0 IGADMO CC(C)(C)c1nc2[nH]ccc2c(N2CCC3(CC2)C(=O)NCC[N@H+]3Cc2ccccc2)n1 ZINC001164946976 721977362 /nfs/dbraw/zinc/97/73/62/721977362.db2.gz MUSHVXCHEYFHCP-UHFFFAOYSA-N 1 1 432.572 3.226 20 0 IGADMO CC(C)(C)c1nc2[nH]ccc2c(N2CCC3(CC2)C(=O)NCC[N@@H+]3Cc2ccccc2)n1 ZINC001164946976 721977363 /nfs/dbraw/zinc/97/73/63/721977363.db2.gz MUSHVXCHEYFHCP-UHFFFAOYSA-N 1 1 432.572 3.226 20 0 IGADMO CN(C)C(=O)N[C@H]1CCO[C@]2(CCN(c3ccc4c(n3)CC[N@H+](Cc3ccccc3)C4)C2)C1 ZINC001164954356 722008339 /nfs/dbraw/zinc/00/83/39/722008339.db2.gz LTDIALUJQJWGOP-BKMJKUGQSA-N 1 1 449.599 3.039 20 0 IGADMO FC(F)(c1nc(Cl)nc2[nH]cnc21)N1CCC2(CC[N@@H+](Cc3cccnc3)C2)CC1 ZINC001164955915 722022456 /nfs/dbraw/zinc/02/24/56/722022456.db2.gz SLOVDGYJXMGFGG-UHFFFAOYSA-N 1 1 433.894 3.390 20 0 IGADMO Clc1nc2c(c(N3CCC4(CC3)COCC[N@@H+](Cc3ccncc3)C4)n1)CSCC2 ZINC001164961937 722053725 /nfs/dbraw/zinc/05/37/25/722053725.db2.gz ZHQPXVJRYQRILU-UHFFFAOYSA-N 1 1 446.020 3.433 20 0 IGADMO Cc1nc(Cl)cc(C(F)(F)N2CCC3(CC2)COCC[N@@H+](Cc2ccncc2)C3)n1 ZINC001164958052 722054190 /nfs/dbraw/zinc/05/41/90/722054190.db2.gz BDIMTZZZKRYMBY-UHFFFAOYSA-N 1 1 437.922 3.497 20 0 IGADMO CCOC(=O)c1cc2ccnc(N3CCC4(CC3)COCC[N@@H+](Cc3ccncc3)C4)c2[nH]1 ZINC001164963183 722054872 /nfs/dbraw/zinc/05/48/72/722054872.db2.gz HZBWMSYMDASUPG-UHFFFAOYSA-N 1 1 449.555 3.254 20 0 IGADMO COc1cc2ncnc(N3CCC4(CC3)COCC[N@@H+](Cc3ccncc3)C4)c2c(OC)c1 ZINC001164962967 722056783 /nfs/dbraw/zinc/05/67/83/722056783.db2.gz GHBUQDYSWBOYPD-UHFFFAOYSA-N 1 1 449.555 3.161 20 0 IGADMO CC(=O)N1[C@H](Cn2cccn2)C[C@H]2CN(c3nc(Cl)ccc3C[NH+]3CCCC3)CC[C@@H]21 ZINC001164969524 722080567 /nfs/dbraw/zinc/08/05/67/722080567.db2.gz LERXATSQCUYIQO-ACRUOGEOSA-N 1 1 442.995 3.043 20 0 IGADMO Clc1c[nH]c2nc(Cl)nc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)c12 ZINC001164986298 722100181 /nfs/dbraw/zinc/10/01/81/722100181.db2.gz YQBHIBLIDZPMEH-HOCLYGCPSA-N 1 1 433.343 3.387 20 0 IGADMO COc1cccc2nc(Cl)nc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)c21 ZINC001164972441 722123880 /nfs/dbraw/zinc/12/38/80/722123880.db2.gz FJQPCRMFCWBHHD-XLIONFOSSA-N 1 1 439.947 3.414 20 0 IGADMO Clc1ccc(CN2CCCC2)c(N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)n1 ZINC001164983729 722125290 /nfs/dbraw/zinc/12/52/90/722125290.db2.gz ZIJYEQICOVAYQT-RBBKRZOGSA-N 1 1 442.007 3.453 20 0 IGADMO CCc1cc2c(nc(Cl)nc2N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)[nH]1 ZINC001164979648 722136474 /nfs/dbraw/zinc/13/64/74/722136474.db2.gz LQDMBZWZIOPKIR-QFBILLFUSA-N 1 1 426.952 3.296 20 0 IGADMO COC(=O)c1ccc2cc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)ncc2c1 ZINC001164984602 722137149 /nfs/dbraw/zinc/13/71/49/722137149.db2.gz XNLBGVYARAMAHL-JTHBVZDNSA-N 1 1 432.524 3.144 20 0 IGADMO c1ccc2nc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)c(N3CCCC3)nc2c1 ZINC001164980880 722138280 /nfs/dbraw/zinc/13/82/80/722138280.db2.gz NHJLCAGAAIOKED-URXFXBBRSA-N 1 1 444.583 3.352 20 0 IGADMO Cc1nc(C)c(-c2ccc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)nn2)s1 ZINC001164979721 722151209 /nfs/dbraw/zinc/15/12/09/722151209.db2.gz LVBNLTFZMDWOTH-PZJWPPBQSA-N 1 1 436.585 3.339 20 0 IGADMO Cc1nc(CN2CCO[C@H]3CCN(c4nc(NCC5CC5)c(C)c[nH+]4)CC[C@H]32)cs1 ZINC001164988419 722173303 /nfs/dbraw/zinc/17/33/03/722173303.db2.gz QVUGMDHECNEGSN-UXHICEINSA-N 1 1 428.606 3.242 20 0 IGADMO Cc1nc(CN2CCO[C@@H]3CCN(c4cc[nH+]c(N5CCCCC5)n4)CC[C@H]32)cs1 ZINC001164987015 722184927 /nfs/dbraw/zinc/18/49/27/722184927.db2.gz IESCFFHUIXTAIG-WOJBJXKFSA-N 1 1 428.606 3.102 20 0 IGADMO CC(C)NS(=O)(=O)c1ccc(N2CCC[C@@]3(CC[N@H+]3Cc3cccc(F)c3)C2)nc1 ZINC001164994848 722207720 /nfs/dbraw/zinc/20/77/20/722207720.db2.gz ISFGHMUMYFYBSU-JOCHJYFZSA-N 1 1 432.565 3.152 20 0 IGADMO CC1(C)NC(=O)N(Cc2ccc(N3CCC[C@@H]4C[N@@H+](Cc5ccccc5)C[C@@H]43)nc2)C1=O ZINC001164630415 719101271 /nfs/dbraw/zinc/10/12/71/719101271.db2.gz WEWLGCQUXFVYED-RTWAWAEBSA-N 1 1 433.556 3.013 20 0 IGADMO CC(C)CNC(=O)c1ccc2c(c1)ncnc2N1CCc2c(C[NH+](C)C)nn(C(C)C)c2C1 ZINC001164652776 719313704 /nfs/dbraw/zinc/31/37/04/719313704.db2.gz POZLSAHWUVQCED-UHFFFAOYSA-N 1 1 449.603 3.417 20 0 IGADMO CC(C)n1nc(C[NH+](C)C)c2c1CN(c1ccc(-c3ccc4c(c3)OCCO4)nn1)CC2 ZINC001164652904 719315394 /nfs/dbraw/zinc/31/53/94/719315394.db2.gz SZVJEPVWDFFSNY-UHFFFAOYSA-N 1 1 434.544 3.317 20 0 IGADMO O=C(CC1CC1)N[C@@H]1CN(c2nc(Cl)ccc2C[NH+]2CCCC2)C[C@H]2CCCO[C@@H]21 ZINC001164656615 719325130 /nfs/dbraw/zinc/32/51/30/719325130.db2.gz YRBVJLFPPVNLHD-JUXOCIIHSA-N 1 1 432.996 3.231 20 0 IGADMO C[N@H+]1CCO[C@H]2CN(c3nc(CN4CCCCC4)nc4sc5c(c43)CCCC5)C[C@@H]21 ZINC001164675188 719440590 /nfs/dbraw/zinc/44/05/90/719440590.db2.gz ZMXNDFCLNPVMDT-ROUUACIJSA-N 1 1 427.618 3.075 20 0 IGADMO O=C1C[C@H]2[C@H](CCN2c2ccc3c(n2)CC[N@H+](Cc2ccccc2)C3)N1Cc1cccnc1 ZINC001164691057 719764685 /nfs/dbraw/zinc/76/46/85/719764685.db2.gz KQOGXBLAKPNRRY-DQEYMECFSA-N 1 1 439.563 3.415 20 0 IGADMO CCOC(=O)c1cnc(N2CCC3(CC2)C[N@@H+](Cc2cccs2)CCO3)c(OC)c1 ZINC001164697572 719894308 /nfs/dbraw/zinc/89/43/08/719894308.db2.gz LESYGHILSMCRJG-UHFFFAOYSA-N 1 1 431.558 3.200 20 0 IGADMO CCOc1ccc(C(=O)OC)c(N2CCC3(CC2)C[N@@H+](Cc2cccs2)CCO3)n1 ZINC001164696192 719894737 /nfs/dbraw/zinc/89/47/37/719894737.db2.gz BEVGBRPZBSBOID-UHFFFAOYSA-N 1 1 431.558 3.200 20 0 IGADMO CCOC(=O)c1sc2ncnc(N3CC[C@]4(C3)C[N@@H+](CC3CC3)C[C@@H]4COC)c2c1C ZINC001164806436 720069654 /nfs/dbraw/zinc/06/96/54/720069654.db2.gz CSUPREQOMKIWHF-UZUQRXQVSA-N 1 1 444.601 3.361 20 0 IGADMO CCOC(=O)c1ccc(N2CCC3(C[C@@H](COC)[N@@H+](Cc4ccccn4)C3)CC2)nc1C ZINC001164710210 720093971 /nfs/dbraw/zinc/09/39/71/720093971.db2.gz HGGGOTJOOAMLIG-NRFANRHFSA-N 1 1 438.572 3.469 20 0 IGADMO COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1cc(Cl)ncc1C(=O)OC)CC2 ZINC001164710371 720095395 /nfs/dbraw/zinc/09/53/95/720095395.db2.gz JHRGBVLIVFCMNO-SFHVURJKSA-N 1 1 444.963 3.424 20 0 IGADMO COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1cc(OC)nc(SC)n1)CC2 ZINC001164716944 720118215 /nfs/dbraw/zinc/11/82/15/720118215.db2.gz LZZJFPNSJIDVCJ-GOSISDBHSA-N 1 1 429.590 3.110 20 0 IGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1cc(C(=O)NC(C)(C)C)cc(Cl)n1)C2 ZINC001164807304 720127424 /nfs/dbraw/zinc/12/74/24/720127424.db2.gz BUKVIKPJHBRAQX-WZONZLPQSA-N 1 1 435.012 3.448 20 0 IGADMO CCOC(=O)c1nc(Cl)nc(Cl)c1N1CC[C@@]2(C1)C[N@@H+](CC1CC1)C[C@@H]2COC ZINC001164808686 720128166 /nfs/dbraw/zinc/12/81/66/720128166.db2.gz GBLRPQWGWKEDNE-VLIAUNLRSA-N 1 1 443.375 3.145 20 0 IGADMO COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN([C@@H](F)Oc1cncc(Cl)n1)CC2 ZINC001164713091 720153354 /nfs/dbraw/zinc/15/33/54/720153354.db2.gz QOUSCMRQVQUXDI-FXAWDEMLSA-N 1 1 435.931 3.160 20 0 IGADMO COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN([C@@H](F)Oc1ccc(Cl)nn1)CC2 ZINC001164711896 720157338 /nfs/dbraw/zinc/15/73/38/720157338.db2.gz DJGIXCNKAMQLAE-FXAWDEMLSA-N 1 1 435.931 3.160 20 0 IGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(C(F)(F)c1cc(Cl)ncc1C(=O)OC)C2 ZINC001164812420 720163956 /nfs/dbraw/zinc/16/39/56/720163956.db2.gz AMSKCXBCXLMONE-YWZLYKJASA-N 1 1 443.922 3.251 20 0 IGADMO CNC(=O)C[N@@H+]1CCOC[C@]2(CCCN(c3cc(Cl)nc4cc(Cl)ccc43)C2)C1 ZINC001164719355 720238001 /nfs/dbraw/zinc/23/80/01/720238001.db2.gz LEHSMMODDNYMHA-OAQYLSRUSA-N 1 1 437.371 3.206 20 0 IGADMO CNC(=O)C[N@H+]1CCOC[C@]2(CCCN(c3cc(Cl)nc4cc(Cl)ccc43)C2)C1 ZINC001164719355 720238007 /nfs/dbraw/zinc/23/80/07/720238007.db2.gz LEHSMMODDNYMHA-OAQYLSRUSA-N 1 1 437.371 3.206 20 0 IGADMO CC(C)[N@@H+](C)Cc1cc(=O)n2c(n1)CN(c1c(Cl)nc(Cl)nc1C1CC1)CCC2 ZINC001164818567 720246445 /nfs/dbraw/zinc/24/64/45/720246445.db2.gz ZLWOMADZIGHJFP-UHFFFAOYSA-N 1 1 437.375 3.468 20 0 IGADMO Cc1cc2nc(N3CC[C@@H]4[C@@H]3CC[N@H+]4Cc3cccnc3)nc(N3CCOCC3)c2s1 ZINC001164731004 720404328 /nfs/dbraw/zinc/40/43/28/720404328.db2.gz XWNIZTIDFGFTLJ-UXHICEINSA-N 1 1 436.585 3.085 20 0 IGADMO COC(=O)c1ccc(NC(=O)C(C)(C)C)c(N2CC[C@@H]3[C@@H]2CC[N@H+]3Cc2cccnc2)n1 ZINC001164730968 720414744 /nfs/dbraw/zinc/41/47/44/720414744.db2.gz KNOFKPFZGGMFPS-UXHICEINSA-N 1 1 437.544 3.101 20 0 IGADMO CC(C)CNC(=O)c1ccc2c(c1)ncnc2N1CC[C@H]2[C@@H]1CC[N@H+]2Cc1cccnc1 ZINC001164730936 720414787 /nfs/dbraw/zinc/41/47/87/720414787.db2.gz JWFICHANGJYQHD-GOTSBHOMSA-N 1 1 430.556 3.264 20 0 IGADMO COc1ccc(-c2ccc(N3CC[C@H]4[C@H]3CC[N@H+]4Cc3cccnc3)nn2)c(OC)c1OC ZINC001164728898 720466300 /nfs/dbraw/zinc/46/63/00/720466300.db2.gz PKDWRFZMYCYYMD-LEWJYISDSA-N 1 1 447.539 3.418 20 0 IGADMO CCOC(=O)c1ccc2ncnc(N3CC[C@@H]4[C@@H](C[C@@H](Cn5cccn5)[N@H+]4C(C)C)C3)c2c1 ZINC001164834968 720544633 /nfs/dbraw/zinc/54/46/33/720544633.db2.gz GCYVRHCGWVUZEQ-SXWKCWPCSA-N 1 1 448.571 3.381 20 0 IGADMO CCOC(=O)c1c(C)cc(N2CC[C@@H]3[C@H](C[C@H](Cn4cccn4)[N@H+]3C(C)C)C2)nc1C ZINC001164841402 720559662 /nfs/dbraw/zinc/55/96/62/720559662.db2.gz UYFGIQPXUSSKHK-NJDAHSKKSA-N 1 1 425.577 3.449 20 0 IGADMO Cc1cc(Cl)nc(N2CCC3(C[C@@H]([N@@H+](C)Cc4ccccc4)CO3)CC2)c1C(N)=O ZINC001164837511 720664785 /nfs/dbraw/zinc/66/47/85/720664785.db2.gz BXCNGKWHMAOKEH-GOSISDBHSA-N 1 1 428.964 3.402 20 0 IGADMO Clc1c[nH]c2nc(Cl)nc(N3CC[C@@H]4[C@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)c12 ZINC001164747689 720810481 /nfs/dbraw/zinc/81/04/81/720810481.db2.gz PCPKBCLHNCVMMF-IIAWOOMASA-N 1 1 447.374 3.236 20 0 IGADMO Fc1cc(C(F)(F)N2CC[C@@H]3[C@@H](C[C@H](Cn4cncn4)[N@H+]3CC3CC3)C2)cnc1Cl ZINC001164741564 720825532 /nfs/dbraw/zinc/82/55/32/720825532.db2.gz NXGQRVOKWLMURO-YXJHDRRASA-N 1 1 440.901 3.390 20 0 IGADMO Fc1cnc(Cl)cc1C(F)(F)N1CC[C@@H]2[C@H](C[C@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164741204 720827760 /nfs/dbraw/zinc/82/77/60/720827760.db2.gz MHNHFJVQLXMZNU-IIDMSEBBSA-N 1 1 440.901 3.390 20 0 IGADMO CCCN(CCC)c1cncc(N2CC[C@@H]3[C@H](C[C@H](Cn4cncn4)[N@H+]3CC3CC3)C2)n1 ZINC001164751029 720839643 /nfs/dbraw/zinc/83/96/43/720839643.db2.gz XWMSDNJNFGFAMP-YPAWHYETSA-N 1 1 438.624 3.074 20 0 IGADMO Cc1c[nH]c2nc(Cl)cc(N3CC[C@@H]4[C@@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)c12 ZINC001164740012 720844350 /nfs/dbraw/zinc/84/43/50/720844350.db2.gz BMWQZTRJGFOWKP-OKZBNKHCSA-N 1 1 425.968 3.496 20 0 IGADMO COCC[N@H+]1CCO[C@H]2CN(C(F)(F)c3ccc4ncnc(Cl)c4c3)CC[C@@H]2C1 ZINC001164853714 720848675 /nfs/dbraw/zinc/84/86/75/720848675.db2.gz OROWGZXWSANHIO-KDOFPFPSSA-N 1 1 426.895 3.002 20 0 IGADMO FC(F)(Oc1ccnc(Cl)c1)N1CC[C@@H]2[C@H](C[C@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164753895 720857448 /nfs/dbraw/zinc/85/74/48/720857448.db2.gz ZBDHCXBBKMZHEK-JFIYKMOQSA-N 1 1 438.910 3.131 20 0 IGADMO c1cncc(COC[C@H]2C[N@@H+](CC3CC3)C[C@]23CCN(c2nccc(N4CCCC4)n2)C3)c1 ZINC001164747170 720867217 /nfs/dbraw/zinc/86/72/17/720867217.db2.gz AIBYVNLISMTSTQ-BVAGGSTKSA-N 1 1 448.615 3.227 20 0 IGADMO COc1nc(Cl)cc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COCc2cccnc2)n1 ZINC001164749077 720871586 /nfs/dbraw/zinc/87/15/86/720871586.db2.gz GRSDCPGACKHXTO-AUSIDOKSSA-N 1 1 443.979 3.289 20 0 IGADMO COCC[N@H+]1CCO[C@@H]2CN(c3ccc(-c4ccc(C(=O)OC)cc4)c(C)n3)CC[C@H]2C1 ZINC001164855179 720871641 /nfs/dbraw/zinc/87/16/41/720871641.db2.gz GKIJYKAOPJARAD-JTHBVZDNSA-N 1 1 439.556 3.017 20 0 IGADMO CSc1cc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COCc2cccnc2)ncn1 ZINC001164749049 720877035 /nfs/dbraw/zinc/87/70/35/720877035.db2.gz GLHUYNOLROZRGD-REWPJTCUSA-N 1 1 425.602 3.349 20 0 IGADMO CSc1cnc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COCc2cccnc2)nc1 ZINC001164754539 720895061 /nfs/dbraw/zinc/89/50/61/720895061.db2.gz JHIIJWLLJASIOK-NFBKMPQASA-N 1 1 425.602 3.349 20 0 IGADMO c1nc2cnc(N3CC[C@]4(C3)C[N@H+](CC3CC3)C[C@H]4COCc3cccnc3)nc2s1 ZINC001164755630 720896443 /nfs/dbraw/zinc/89/64/43/720896443.db2.gz MFKNDAIGNZVKCY-WMZHIEFXSA-N 1 1 436.585 3.236 20 0 IGADMO Nc1cc(Cl)cnc1N1CC[C@@]2(C1)C[N@@H+](CC1CC1)C[C@H]2COCc1cccnc1 ZINC001164754200 720905902 /nfs/dbraw/zinc/90/59/02/720905902.db2.gz UGVZJLKPBHIVTA-CVDCTZTESA-N 1 1 427.980 3.467 20 0 IGADMO Cc1cnc2c(ccnc2N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COCc2cccnc2)n1 ZINC001164755035 720925334 /nfs/dbraw/zinc/92/53/34/720925334.db2.gz XWCCTLRSZLZNBC-GJZUVCINSA-N 1 1 444.583 3.483 20 0 IGADMO CC(C)(c1ccnc(Cl)c1)[N@H+]1CC[C@@H]2OCC[C@H](C(=O)NCc3ccccn3)[C@@H]2C1 ZINC001164760082 721023753 /nfs/dbraw/zinc/02/37/53/721023753.db2.gz NUGJHBREKKCZRS-UFYCRDLUSA-N 1 1 428.964 3.409 20 0 IGADMO Cc1ccc(C[NH+]2CCC3(CCN(c4ccc(N5CCN(C)CC5)nn4)CC3)CC2)cc1 ZINC001164763721 721042162 /nfs/dbraw/zinc/04/21/62/721042162.db2.gz KMOHALBMLAFYMF-UHFFFAOYSA-N 1 1 434.632 3.419 20 0 IGADMO Cc1cccc(CN2C(=O)C[C@@H]3[C@H]2CCN3c2nc(Cl)ccc2C[NH+]2CCCC2)n1 ZINC001164774185 721053072 /nfs/dbraw/zinc/05/30/72/721053072.db2.gz VINBKLAYYMFNKD-WOJBJXKFSA-N 1 1 425.964 3.414 20 0 IGADMO Cc1cccc(CN2C(=O)C[C@H]3[C@H]2CCN3c2nc(Cl)ccc2C[NH+]2CCCC2)n1 ZINC001164774178 721053098 /nfs/dbraw/zinc/05/30/98/721053098.db2.gz VINBKLAYYMFNKD-UXHICEINSA-N 1 1 425.964 3.414 20 0 IGADMO Cc1cccc(CN2C(=O)C[C@@H]3[C@@H]2CCN3c2nc(Cl)ccc2C[NH+]2CCCC2)n1 ZINC001164774181 721053268 /nfs/dbraw/zinc/05/32/68/721053268.db2.gz VINBKLAYYMFNKD-VQTJNVASSA-N 1 1 425.964 3.414 20 0 IGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2C[C@H](NC(=O)c3cccn3C)[C@H]3OCCC[C@H]32)nc1 ZINC001164761030 721067505 /nfs/dbraw/zinc/06/75/05/721067505.db2.gz AKSJABBMDVVUAJ-FBHSLPMESA-N 1 1 437.588 3.133 20 0 IGADMO c1[nH]c2ccccc2c1-c1ccnc(N2CC[N@H+]3C[C@H](OCc4cccnc4)C[C@H]3C2)n1 ZINC001164866916 721084814 /nfs/dbraw/zinc/08/48/14/721084814.db2.gz UZZDQJOTUCTPKS-VQTJNVASSA-N 1 1 426.524 3.500 20 0 IGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4cc(C(=O)N5CCCCC5)cc(Cl)n4)C[C@@H]3C2)cn1 ZINC001164774182 721092492 /nfs/dbraw/zinc/09/24/92/721092492.db2.gz YZHZJOSSHHHONI-ICSRJNTNSA-N 1 1 442.995 3.053 20 0 IGADMO Clc1ccc(CN2CCCC2)c(N2CC[N@H+]3C[C@@H](OCc4cccnc4)C[C@@H]3C2)n1 ZINC001164864580 721100240 /nfs/dbraw/zinc/10/02/40/721100240.db2.gz GMYPNAKCMGYSFW-RTWAWAEBSA-N 1 1 427.980 3.206 20 0 IGADMO FC(F)(Cc1nc(Cl)cc(Cl)n1)N1CC[N@H+]2C[C@H](OCc3cccnc3)C[C@H]2C1 ZINC001164870225 721127742 /nfs/dbraw/zinc/12/77/42/721127742.db2.gz BWYIIKZKRIECAO-LSDHHAIUSA-N 1 1 444.313 3.289 20 0 IGADMO FC(F)(Cc1nc(Cl)cc(Cl)n1)N1CC[N@H+]2C[C@@H](OCc3cccnc3)C[C@@H]2C1 ZINC001164870222 721128050 /nfs/dbraw/zinc/12/80/50/721128050.db2.gz BWYIIKZKRIECAO-CABCVRRESA-N 1 1 444.313 3.289 20 0 IGADMO c1ccc2nc(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@H]4C3)c(N3CCCC3)nc2c1 ZINC001164878335 721136987 /nfs/dbraw/zinc/13/69/87/721136987.db2.gz PXKQGPQQSFBERQ-LEWJYISDSA-N 1 1 430.556 3.105 20 0 IGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4ncnc5c4ccn5Cc4ccccc4)C[C@H]3C2)cn1 ZINC001164764994 721145681 /nfs/dbraw/zinc/14/56/81/721145681.db2.gz IRDOFSJKPGTMOC-FGZHOGPDSA-N 1 1 427.556 3.171 20 0 IGADMO COc1ccc(Oc2cc(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@H]4C3)nc(C)n2)cc1 ZINC001164873574 721176391 /nfs/dbraw/zinc/17/63/91/721176391.db2.gz IQXCCFYJYOWXGA-NZQKXSOJSA-N 1 1 447.539 3.461 20 0 IGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4ncc(C(=O)OC(C)(C)C)cc4Cl)C[C@@H]3C2)cn1 ZINC001164769732 721232567 /nfs/dbraw/zinc/23/25/67/721232567.db2.gz ZLJYLFKDZIJWNC-AEFFLSMTSA-N 1 1 431.968 3.382 20 0 IGADMO CN(C)C(=O)C[N@H+]1CCOCC2(CCN(c3cc(Cl)nc4c(F)cccc34)CC2)C1 ZINC001164879154 721293378 /nfs/dbraw/zinc/29/33/78/721293378.db2.gz VRZVOTGEKRELCR-UHFFFAOYSA-N 1 1 434.943 3.034 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@]2(CCCN(c3c[nH]c4ncnc(Cl)c34)C2)C1 ZINC001164776258 721338214 /nfs/dbraw/zinc/33/82/14/721338214.db2.gz DIIDEQRSMJYQAA-OAQYLSRUSA-N 1 1 430.940 3.287 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@@]2(CCCN(c3nc(Cl)nc4cnccc43)C2)C1 ZINC001164779732 721344466 /nfs/dbraw/zinc/34/44/66/721344466.db2.gz VBLFPVLKSLDDSA-QFIPXVFZSA-N 1 1 442.951 3.402 20 0 IGADMO COC(=O)c1c(C)cc(C)nc1N1CCC[C@]2(C1)COCC[N@H+](Cc1c(C)noc1C)C2 ZINC001164777860 721349481 /nfs/dbraw/zinc/34/94/81/721349481.db2.gz JJZMBPMFSSRQIO-DEOSSOPVSA-N 1 1 442.560 3.209 20 0 IGADMO COC(=O)c1c(C)cc(C)nc1N1CCC[C@]2(C1)COCC[N@@H+](Cc1c(C)noc1C)C2 ZINC001164777860 721349483 /nfs/dbraw/zinc/34/94/83/721349483.db2.gz JJZMBPMFSSRQIO-DEOSSOPVSA-N 1 1 442.560 3.209 20 0 IGADMO COC(=O)c1nc(N2CCC[C@@]3(C2)COCC[N@H+](Cc2c(C)noc2C)C3)ccc1Cl ZINC001164779050 721349498 /nfs/dbraw/zinc/34/94/98/721349498.db2.gz PORXUMOBUUJLNG-JOCHJYFZSA-N 1 1 448.951 3.245 20 0 IGADMO COC(=O)c1nc(N2CCC[C@@]3(C2)COCC[N@@H+](Cc2c(C)noc2C)C3)ccc1Cl ZINC001164779050 721349499 /nfs/dbraw/zinc/34/94/99/721349499.db2.gz PORXUMOBUUJLNG-JOCHJYFZSA-N 1 1 448.951 3.245 20 0 IGADMO Cc1noc(-c2ccnc(N3CCC[C@@]4(C3)COCC[N@H+](Cc3c(C)noc3C)C4)c2)n1 ZINC001164782937 721367804 /nfs/dbraw/zinc/36/78/04/721367804.db2.gz NVCWODYWBHQADE-HSZRJFAPSA-N 1 1 438.532 3.164 20 0 IGADMO Cc1noc(-c2ccnc(N3CCC[C@@]4(C3)COCC[N@@H+](Cc3c(C)noc3C)C4)c2)n1 ZINC001164782937 721367810 /nfs/dbraw/zinc/36/78/10/721367810.db2.gz NVCWODYWBHQADE-HSZRJFAPSA-N 1 1 438.532 3.164 20 0 IGADMO c1csc(C[N@@H+]2C[C@H]3CN(c4ncnc5c4CN(Cc4ccccc4)CC5)C[C@H]3C2)n1 ZINC001164782821 721395903 /nfs/dbraw/zinc/39/59/03/721395903.db2.gz FVWPHYAOHARLPG-BGYRXZFFSA-N 1 1 432.597 3.060 20 0 IGADMO c1csc(C[N@H+]2C[C@H]3CN(c4ncnc5c4CN(Cc4ccccc4)CC5)C[C@H]3C2)n1 ZINC001164782821 721395906 /nfs/dbraw/zinc/39/59/06/721395906.db2.gz FVWPHYAOHARLPG-BGYRXZFFSA-N 1 1 432.597 3.060 20 0 IGADMO C[NH+]1CCN(C[C@H]2CCC[C@]3(CCN(c4nccnc4C4SCCCS4)C3)O2)CC1 ZINC001164889368 721399678 /nfs/dbraw/zinc/39/96/78/721399678.db2.gz LUIOJXRFPGPVSK-XMSQKQJNSA-N 1 1 449.690 3.111 20 0 IGADMO CCOC(=O)c1cnc2ccc(Cl)nc2c1N1C[C@@H]2C[NH+](Cc3nccs3)C[C@H]2C1 ZINC001164782425 721407614 /nfs/dbraw/zinc/40/76/14/721407614.db2.gz GKMIMADKSKZOTA-KBPBESRZSA-N 1 1 443.960 3.485 20 0 IGADMO C[NH+]1CCN(C[C@H]2CCC[C@]3(CCN(c4nc(Cl)nc5c4CCCCC5)C3)O2)CC1 ZINC001164887749 721407710 /nfs/dbraw/zinc/40/77/10/721407710.db2.gz NEVMGADYTPBGCA-WZONZLPQSA-N 1 1 434.028 3.164 20 0 IGADMO C[NH+]1CCN(C[C@@H]2CCC[C@]3(CCN(c4nccc(Oc5cccc(F)c5)n4)C3)O2)CC1 ZINC001164890246 721427491 /nfs/dbraw/zinc/42/74/91/721427491.db2.gz CQVGCZNONBOMQD-XUZZJYLKSA-N 1 1 441.551 3.173 20 0 IGADMO C[NH+]1CCN(C[C@@H]2CCC[C@]3(CCN(c4cc(-c5ccc(F)cc5)ncn4)C3)O2)CC1 ZINC001164888710 721438203 /nfs/dbraw/zinc/43/82/03/721438203.db2.gz ANOSFJSWVZTQGR-XUZZJYLKSA-N 1 1 425.552 3.048 20 0 IGADMO CCc1nc(Cl)c(N2CC[C@]3(C2)CCC[C@@H](CN2CC[NH+](C)CC2)O3)c(Cl)n1 ZINC001164895843 721439715 /nfs/dbraw/zinc/43/97/15/721439715.db2.gz QGWUWAWCVLDCFH-YWZLYKJASA-N 1 1 428.408 3.111 20 0 IGADMO C[NH+]1CCN(C[C@H]2CCC[C@]3(CCN(c4ccc(-c5c(F)cccc5F)nn4)C3)O2)CC1 ZINC001164893655 721441315 /nfs/dbraw/zinc/44/13/15/721441315.db2.gz JVPKPPYTZNVGRD-HOYKHHGWSA-N 1 1 443.542 3.187 20 0 IGADMO C[NH+]1CCN(C[C@@H]2CCC[C@@]3(CCN(c4nc(C(F)F)nc5ccc(F)cc54)C3)O2)CC1 ZINC001164894334 721445703 /nfs/dbraw/zinc/44/57/03/721445703.db2.gz LSUKNKVQLYYNDO-SBUREZEXSA-N 1 1 449.521 3.472 20 0 IGADMO COCC[N@@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1nc(C)cc(N3CCCC3)n1)CC2 ZINC001164790338 721447948 /nfs/dbraw/zinc/44/79/48/721447948.db2.gz YJWFMXVYFMOEGQ-QFIPXVFZSA-N 1 1 443.636 3.119 20 0 IGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1nc(C)cc(N3CCCC3)n1)CC2 ZINC001164790338 721447950 /nfs/dbraw/zinc/44/79/50/721447950.db2.gz YJWFMXVYFMOEGQ-QFIPXVFZSA-N 1 1 443.636 3.119 20 0 IGADMO CCOC(=O)c1ccc(C)c(N2CCC3(C[C@H](COCC4CC4)[N@@H+](CCOC)C3)CC2)n1 ZINC001164786710 721448432 /nfs/dbraw/zinc/44/84/32/721448432.db2.gz NIJWYPWATOMUDF-OAQYLSRUSA-N 1 1 445.604 3.301 20 0 IGADMO CC[C@H](C)c1nc2[nH]ccc2c(N2CC[C@]3(C2)CCC[C@@H](CN2CC[NH+](C)CC2)O3)n1 ZINC001164889708 721453167 /nfs/dbraw/zinc/45/31/67/721453167.db2.gz PLVGBYRCHBEEGS-JXQFQVJHSA-N 1 1 426.609 3.237 20 0 IGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1ncc3ccc(OC)cc3n1)CC2 ZINC001164787626 721455810 /nfs/dbraw/zinc/45/58/10/721455810.db2.gz OWKKUHUFSRILSO-OAQYLSRUSA-N 1 1 440.588 3.372 20 0 IGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1nnc(Cl)c3cccnc31)CC2 ZINC001164784630 721460034 /nfs/dbraw/zinc/46/00/34/721460034.db2.gz IUHFFPKTFWQGKJ-GOSISDBHSA-N 1 1 445.995 3.412 20 0 IGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1ncc3cccc(OC)c3n1)CC2 ZINC001164789375 721460734 /nfs/dbraw/zinc/46/07/34/721460734.db2.gz XNIDWCUUYYQASH-OAQYLSRUSA-N 1 1 440.588 3.372 20 0 IGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1nccnc1OCC(C)C)CC2 ZINC001164791785 721469980 /nfs/dbraw/zinc/46/99/80/721469980.db2.gz ZEZMRUBWVJMTEA-NRFANRHFSA-N 1 1 432.609 3.245 20 0 IGADMO CCOC(=O)c1c(Cl)cc(C)nc1N1C[C@H]([N@H+](C)Cc2cccnc2)[C@H]2OCCC[C@@H]21 ZINC001164806083 721529336 /nfs/dbraw/zinc/52/93/36/721529336.db2.gz NROGUKUPWFDMBW-ZJOUEHCJSA-N 1 1 444.963 3.483 20 0 IGADMO CCOC(=O)c1c(Cl)cc(C)nc1N1C[C@H]([N@@H+](C)Cc2cccnc2)[C@H]2OCCC[C@@H]21 ZINC001164806083 721529339 /nfs/dbraw/zinc/52/93/39/721529339.db2.gz NROGUKUPWFDMBW-ZJOUEHCJSA-N 1 1 444.963 3.483 20 0 IGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2cc(NC(=O)OC(C)(C)C)ncn2)[C@H]2CCCO[C@@H]12 ZINC001164808952 721536729 /nfs/dbraw/zinc/53/67/29/721536729.db2.gz SNKKBCNVORCYRC-WAOWUJCRSA-N 1 1 440.548 3.087 20 0 IGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2cc(NC(=O)OC(C)(C)C)ncn2)[C@H]2CCCO[C@@H]12 ZINC001164808952 721536732 /nfs/dbraw/zinc/53/67/32/721536732.db2.gz SNKKBCNVORCYRC-WAOWUJCRSA-N 1 1 440.548 3.087 20 0 IGADMO CCOC(=O)c1c(C)cc(Cl)nc1N1C[C@H]([N@H+](C)Cc2cccnc2)[C@@H]2OCCC[C@@H]21 ZINC001164801526 721544048 /nfs/dbraw/zinc/54/40/48/721544048.db2.gz FOIWUCUBPQKYHG-BBTUJRGHSA-N 1 1 444.963 3.483 20 0 IGADMO CCOC(=O)c1c(C)cc(Cl)nc1N1C[C@H]([N@@H+](C)Cc2cccnc2)[C@@H]2OCCC[C@@H]21 ZINC001164801526 721544049 /nfs/dbraw/zinc/54/40/49/721544049.db2.gz FOIWUCUBPQKYHG-BBTUJRGHSA-N 1 1 444.963 3.483 20 0 IGADMO C[C@@H]1CCCN(C(=O)c2ccc(N3CC[N@H+]4C[C@@H](Oc5cccc(F)c5)C[C@@H]4C3)nc2)C1 ZINC001164910300 721552441 /nfs/dbraw/zinc/55/24/41/721552441.db2.gz WGAUQBGVDGXOCR-AAIMPIBUSA-N 1 1 438.547 3.435 20 0 IGADMO Fc1cccc(O[C@H]2C[C@H]3CN(c4ccc(-c5ccc6c(c5)OCCO6)nn4)CC[N@H+]3C2)c1 ZINC001164910895 721554080 /nfs/dbraw/zinc/55/40/80/721554080.db2.gz XNFHWVRXTPIAKM-FPOVZHCZSA-N 1 1 448.498 3.396 20 0 IGADMO COC(=O)c1ccc2cc(N3C[C@H]([N@@H+](C)Cc4cccnc4)[C@@H]4OCCC[C@@H]43)ncc2c1 ZINC001164804703 721574793 /nfs/dbraw/zinc/57/47/93/721574793.db2.gz MHJDAKUIJICOQX-WPFOTENUSA-N 1 1 432.524 3.285 20 0 IGADMO C[C@@H]1CCCN(C(=O)c2ccc(N3C[C@H]([N@@H+](C)Cc4cccnc4)[C@@H]4OCCC[C@@H]43)nc2)C1 ZINC001164798194 721576574 /nfs/dbraw/zinc/57/65/74/721576574.db2.gz APMKEBXPCYOECS-HXNUEKDGSA-N 1 1 449.599 3.217 20 0 IGADMO COc1ccccc1-c1ccnc(N2C[C@H]([N@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@@H]32)n1 ZINC001164800146 721581490 /nfs/dbraw/zinc/58/14/90/721581490.db2.gz CEKMLFYERPUZET-WPFOTENUSA-N 1 1 431.540 3.415 20 0 IGADMO COc1ccccc1-c1ccnc(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@@H]32)n1 ZINC001164800146 721581492 /nfs/dbraw/zinc/58/14/92/721581492.db2.gz CEKMLFYERPUZET-WPFOTENUSA-N 1 1 431.540 3.415 20 0 IGADMO COc1ccccc1-c1cc(N2C[C@H]([N@H+](C)Cc3cccnc3)[C@H]3OCCC[C@@H]32)ncn1 ZINC001164809440 721581788 /nfs/dbraw/zinc/58/17/88/721581788.db2.gz SAOWCSXFKNTATL-HWBMXIPRSA-N 1 1 431.540 3.415 20 0 IGADMO COc1ccccc1-c1cc(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@H]3OCCC[C@@H]32)ncn1 ZINC001164809440 721581790 /nfs/dbraw/zinc/58/17/90/721581790.db2.gz SAOWCSXFKNTATL-HWBMXIPRSA-N 1 1 431.540 3.415 20 0 IGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2nc(-c3ccncc3)nc3c2CCC3)[C@H]2CCCO[C@@H]12 ZINC001164807557 721585323 /nfs/dbraw/zinc/58/53/23/721585323.db2.gz OMMANKKTDPHFHW-RBZQAINGSA-N 1 1 442.567 3.291 20 0 IGADMO Cc1nc(-c2ccccn2)nc(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@H]3OCCC[C@H]32)c1C ZINC001164802572 721585345 /nfs/dbraw/zinc/58/53/45/721585345.db2.gz GMKVJAPKSYFLDR-VJBWXMMDSA-N 1 1 430.556 3.419 20 0 IGADMO COC(=O)c1ccc(N2CCC(F)(F)[C@]3(CC[N@@H+](Cc4ccccn4)C3)C2)nc1OC ZINC001164904955 721586991 /nfs/dbraw/zinc/58/69/91/721586991.db2.gz IJOFATFWIMZZHU-NRFANRHFSA-N 1 1 432.471 3.010 20 0 IGADMO C[C@@H]1CN(c2ccc(C[N@@H+](C)C3CC3)cn2)CC[C@]12CC[C@@H](C(=O)Nc1cccnc1)O2 ZINC001165010742 721691606 /nfs/dbraw/zinc/69/16/06/721691606.db2.gz WUMZIWRITIXZCK-WSUBETFTSA-N 1 1 435.572 3.474 20 0 IGADMO CCOC(=O)c1cnc(C)nc1N1CCC(F)(F)[C@]2(CC[N@@H+](Cc3ccccn3)C2)C1 ZINC001164905569 721696598 /nfs/dbraw/zinc/69/65/98/721696598.db2.gz KAUUXKKIJZQGSF-NRFANRHFSA-N 1 1 431.487 3.094 20 0 IGADMO COC(=O)CSc1cccc(N2CCC(F)(F)[C@]3(CC[N@@H+](Cc4ccccn4)C3)C2)n1 ZINC001164905614 721719103 /nfs/dbraw/zinc/71/91/03/721719103.db2.gz IBOJYQWTCBNTIS-NRFANRHFSA-N 1 1 448.539 3.479 20 0 IGADMO CN(C)C(=O)C[NH+]1CCC2(CCCN2C(F)(F)C2(c3ccnc(Cl)c3)CC2)CC1 ZINC001165012726 721750406 /nfs/dbraw/zinc/75/04/06/721750406.db2.gz MSXXNHGGAOCRAV-UHFFFAOYSA-N 1 1 426.939 3.378 20 0 IGADMO CCOC(=O)c1nnc(Cl)cc1N1CCc2c(C[N@H+](C)Cc3ccco3)cncc2C1 ZINC001164910017 721751962 /nfs/dbraw/zinc/75/19/62/721751962.db2.gz YDIVOHVNFMXWLJ-UHFFFAOYSA-N 1 1 441.919 3.489 20 0 IGADMO CCOC(=O)c1nnc(Cl)cc1N1CCc2c(C[N@@H+](C)Cc3ccco3)cncc2C1 ZINC001164910017 721751964 /nfs/dbraw/zinc/75/19/64/721751964.db2.gz YDIVOHVNFMXWLJ-UHFFFAOYSA-N 1 1 441.919 3.489 20 0 IGADMO O=C1N(c2cncnc2)CC[C@@]12CCCN(c1nc(Cl)ccc1C[NH+]1CCCC1)C2 ZINC001165016958 721784480 /nfs/dbraw/zinc/78/44/80/721784480.db2.gz FSMMPMOUEDHICD-JOCHJYFZSA-N 1 1 426.952 3.144 20 0 IGADMO Cc1sc2nc(C[NH+]3CCCC3)nc(N3C[C@@H]4CN(c5cccnc5)C(=O)[C@@H]4C3)c2c1C ZINC001165022744 721792118 /nfs/dbraw/zinc/79/21/18/721792118.db2.gz OBVSJRMQBLCTBW-IEBWSBKVSA-N 1 1 448.596 3.398 20 0 IGADMO CCOC(=O)c1cnc(Cl)nc1N1C[C@@H]2CCC[C@@H]([N@@H+](C)Cc3ccccn3)[C@@H]2C1 ZINC001165025413 721800208 /nfs/dbraw/zinc/80/02/08/721800208.db2.gz NZPKHJXKUOMJBO-KFKAGJAMSA-N 1 1 429.952 3.439 20 0 IGADMO CCOC(=O)c1nnc(Cl)cc1N1C[C@@H]2CCC[C@@H]([N@@H+](C)Cc3ccccn3)[C@H]2C1 ZINC001165025950 721810006 /nfs/dbraw/zinc/81/00/06/721810006.db2.gz OLEGZMDCSFFREG-RYQLBKOJSA-N 1 1 429.952 3.439 20 0 IGADMO CN1CCc2nc(Cl)nc(N3C[C@@H]4CCC[C@@H]([N@@H+](C)Cc5ccccn5)[C@H]4C3)c2C1 ZINC001165021326 721830234 /nfs/dbraw/zinc/83/02/34/721830234.db2.gz DYQUQKHAYPVNRV-DJPFJPOOSA-N 1 1 426.996 3.250 20 0 IGADMO CCOC(=O)[C@@H]1CCc2nnc(N3C[C@@H]4CCC[C@@H]([N@@H+](C)Cc5ccccn5)[C@@H]4C3)cc2C1 ZINC001165026358 721831910 /nfs/dbraw/zinc/83/19/10/721831910.db2.gz PCRYBFLJMVTCFP-OMXLDXBASA-N 1 1 449.599 3.277 20 0 IGADMO O=C(C[C@@H]1OC[C@@H]2CN(c3nc(Cl)ccc3C[NH+]3CCCC3)CC[C@H]12)NC1CCC1 ZINC001164932765 721896295 /nfs/dbraw/zinc/89/62/95/721896295.db2.gz IEGVWZGCZYXVJG-IHPCNDPISA-N 1 1 432.996 3.231 20 0 IGADMO O=C(C[C@@H]1OC[C@@H]2CN(c3nc(Cl)ccc3C[NH+]3CCCC3)CC[C@@H]12)NC1CCC1 ZINC001164932767 721896484 /nfs/dbraw/zinc/89/64/84/721896484.db2.gz IEGVWZGCZYXVJG-SXLOBPIMSA-N 1 1 432.996 3.231 20 0 IGADMO COc1cnc(N2CCC3(CC2)C[N@@H+](Cc2ccc(C)cc2)CCO3)nc1NC(C)C ZINC001164939279 721919814 /nfs/dbraw/zinc/91/98/14/721919814.db2.gz UECNZGMOHCJOBA-UHFFFAOYSA-N 1 1 425.577 3.485 20 0 IGADMO CCC[N@H+]1CCCC[C@@H]1c1ccc(N2CC[C@]3(C2)C[C@H](NC(=O)N(C)C)CCO3)nc1 ZINC001164952740 722010934 /nfs/dbraw/zinc/01/09/34/722010934.db2.gz AYVOMEQFLLYTOT-PQNGQFLHSA-N 1 1 429.609 3.418 20 0 IGADMO c1cnn(Cc2noc3c2CN(c2ccc4c(n2)CC[N@H+](Cc2ccccc2)C4)CC3)c1 ZINC001164957176 722050366 /nfs/dbraw/zinc/05/03/66/722050366.db2.gz IADLEKRLVWNLMO-UHFFFAOYSA-N 1 1 426.524 3.435 20 0 IGADMO COC(=O)/C=C\c1cc(C)cnc1N1CCC2(CC1)COCC[N@@H+](Cc1ccncc1)C2 ZINC001164963304 722058177 /nfs/dbraw/zinc/05/81/77/722058177.db2.gz WGHOUHYLOGZEIJ-ARJAWSKDSA-N 1 1 436.556 3.090 20 0 IGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2CC[C@@H]3[C@@H](C[C@H](Cn4cccn4)N3C(C)=O)C2)nc1 ZINC001164968974 722081242 /nfs/dbraw/zinc/08/12/42/722081242.db2.gz GVKJPSOITKGCJC-OLKYXYMISA-N 1 1 436.604 3.341 20 0 IGADMO C[NH+]1CCC(Oc2ccnc(N3CCC4(CC[C@H](C(=O)NCC5CC5)C4)CC3)c2)CC1 ZINC001164975234 722091876 /nfs/dbraw/zinc/09/18/76/722091876.db2.gz DZFSNSZUQMXGIQ-FQEVSTJZSA-N 1 1 426.605 3.468 20 0 IGADMO CCOC(=O)c1cnc(Cl)cc1N1CC[C@H]2C[N@@H+](Cc3cccnc3)CCO[C@@H]2C1 ZINC001164974649 722099923 /nfs/dbraw/zinc/09/99/23/722099923.db2.gz BFJGDAKKSSMEGS-FXAWDEMLSA-N 1 1 430.936 3.034 20 0 IGADMO COc1cc(C(F)(F)N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)cc(Cl)n1 ZINC001164984682 722103342 /nfs/dbraw/zinc/10/33/42/722103342.db2.gz TYWSDEIRVPTOJG-AEFFLSMTSA-N 1 1 438.906 3.411 20 0 IGADMO Clc1nc2c(c(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)n1)CSCC2 ZINC001164979992 722104166 /nfs/dbraw/zinc/10/41/66/722104166.db2.gz IQNNPOPKMBPNFO-LPHOPBHVSA-N 1 1 431.993 3.042 20 0 IGADMO COc1ccc2nc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)c(Cl)nc2c1 ZINC001164975702 722110995 /nfs/dbraw/zinc/11/09/95/722110995.db2.gz KKJBLZMXLCKAOP-LAUBAEHRSA-N 1 1 439.947 3.414 20 0 IGADMO CCOC(=O)c1cc(Cl)nc(N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)c1C ZINC001164971885 722116868 /nfs/dbraw/zinc/11/68/68/722116868.db2.gz CZGPKQCMLJTERK-UYAOXDASSA-N 1 1 444.963 3.342 20 0 IGADMO CCOC(=O)c1nc(N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)ccc1Cl ZINC001164974179 722134821 /nfs/dbraw/zinc/13/48/21/722134821.db2.gz CLLAGKREDGPCNQ-MJGOQNOKSA-N 1 1 430.936 3.034 20 0 IGADMO COC(=O)c1ccc2cc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)ncc2c1 ZINC001164984599 722137267 /nfs/dbraw/zinc/13/72/67/722137267.db2.gz XNLBGVYARAMAHL-FYYLOGMGSA-N 1 1 432.524 3.144 20 0 IGADMO C[C@@H]1CCCN(C(=O)c2ccc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)nc2)C1 ZINC001164972725 722139945 /nfs/dbraw/zinc/13/99/45/722139945.db2.gz AKTAITRQUUCABO-FGCOXFRFSA-N 1 1 449.599 3.076 20 0 IGADMO CC1CCN(C(=O)c2ccc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)nc2)CC1 ZINC001164972630 722140553 /nfs/dbraw/zinc/14/05/53/722140553.db2.gz AFUJHLQGHDJWOY-BJKOFHAPSA-N 1 1 449.599 3.076 20 0 IGADMO CC1CCN(C(=O)c2ccc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)nc2)CC1 ZINC001164972638 722140900 /nfs/dbraw/zinc/14/09/00/722140900.db2.gz AFUJHLQGHDJWOY-ZEQRLZLVSA-N 1 1 449.599 3.076 20 0 IGADMO c1cncc(C[N@H+]2CCO[C@H]3CN(c4nc(-c5ccncc5)nc5c4CCC5)CC[C@H]3C2)c1 ZINC001164984576 722149739 /nfs/dbraw/zinc/14/97/39/722149739.db2.gz XEFNXLPIMXQQDI-URXFXBBRSA-N 1 1 442.567 3.150 20 0 IGADMO c1cncc(C[N@H+]2CCO[C@H]3CN(c4nc(-c5ccncc5)nc5c4CCC5)CC[C@@H]3C2)c1 ZINC001164984575 722149832 /nfs/dbraw/zinc/14/98/32/722149832.db2.gz XEFNXLPIMXQQDI-QPPBQGQZSA-N 1 1 442.567 3.150 20 0 IGADMO Clc1cc(-c2ccncc2)nc(N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)n1 ZINC001164971610 722153775 /nfs/dbraw/zinc/15/37/75/722153775.db2.gz CFKWRGUNISGHFO-FPOVZHCZSA-N 1 1 436.947 3.314 20 0 IGADMO Clc1cc(-c2ccncc2)nc(N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)n1 ZINC001164971614 722153925 /nfs/dbraw/zinc/15/39/25/722153925.db2.gz CFKWRGUNISGHFO-TZIWHRDSSA-N 1 1 436.947 3.314 20 0 IGADMO CCCSc1ncnc(N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)c1OC ZINC001164971688 722156350 /nfs/dbraw/zinc/15/63/50/722156350.db2.gz CYQNMYVLXWQYHN-RTBURBONSA-N 1 1 429.590 3.110 20 0 IGADMO O=S(=O)(c1ccc(N2CCC[C@]3(CC[N@@H+]3Cc3cccc(F)c3)C2)nc1)N1CCCC1 ZINC001164994042 722208391 /nfs/dbraw/zinc/20/83/91/722208391.db2.gz DRWXRYLRPOBXKJ-QHCPKHFHSA-N 1 1 444.576 3.250 20 0 IGADMO Fc1cccc(CN2CC[C@]23CCCN(c2ccc(OCC4CC[NH2+]CC4)nn2)C3)c1 ZINC001164998801 722211562 /nfs/dbraw/zinc/21/15/62/722211562.db2.gz XZSLSOJEYIHXIP-DEOSSOPVSA-N 1 1 425.552 3.239 20 0 IGADMO C[NH+]1CCN(c2ncnc3c2CCN(c2nc(Cl)cc4ccc(F)cc42)CC3)CC1 ZINC001164997688 722231292 /nfs/dbraw/zinc/23/12/92/722231292.db2.gz SNAPXCXSPOPICU-UHFFFAOYSA-N 1 1 426.927 3.174 20 0 IGADMO CCOC(=O)C1CC[NH+](C2CCN(c3nccc4cc(OC)c(OC)cc43)CC2)CC1 ZINC001164616351 719027424 /nfs/dbraw/zinc/02/74/24/719027424.db2.gz BLICVPNBVLJBDY-UHFFFAOYSA-N 1 1 427.545 3.496 20 0 IGADMO CNC(=O)C[N@H+]1CCCC12CCN(c1cc(-c3nc(-c4cccs4)no3)ccn1)CC2 ZINC001164690311 719747111 /nfs/dbraw/zinc/74/71/11/719747111.db2.gz ZISAHAUFWDGAFA-UHFFFAOYSA-N 1 1 438.557 3.041 20 0 IGADMO CNC(=O)C[N@H+]1CCCC12CCN(c1ncnc3cc(OCc4ccccc4)ccc31)CC2 ZINC001164689858 719752779 /nfs/dbraw/zinc/75/27/79/719752779.db2.gz MHTWZBYIUOBADD-UHFFFAOYSA-N 1 1 445.567 3.390 20 0 IGADMO CCOC(=O)c1cnc(OC)nc1N1CCC2(CCC[N@H+]2Cc2csc(C)n2)CC1 ZINC001164693003 719807834 /nfs/dbraw/zinc/80/78/34/719807834.db2.gz OSSGBJUYDRDIBX-UHFFFAOYSA-N 1 1 431.562 3.062 20 0 IGADMO COC(=O)[C@]1(C)C[C@@H]([NH+]2CCOCC2)CCN1c1ncnc2cc(C(C)(C)C)sc21 ZINC001164700829 719846694 /nfs/dbraw/zinc/84/66/94/719846694.db2.gz KYGONJJZFSVCRO-NYHFZMIOSA-N 1 1 432.590 3.222 20 0 IGADMO COC(=O)[C@@]1(C)C[C@H]([NH+]2CCOCC2)CCN1c1nc(Cl)nc2cccc(Cl)c21 ZINC001164703007 719854219 /nfs/dbraw/zinc/85/42/19/719854219.db2.gz OKYISXKXKABXEF-ZUOKHONESA-N 1 1 439.343 3.169 20 0 IGADMO COC(=O)[C@@]1(C)C[C@@H]([NH+]2CCOCC2)CCN1c1nc(C)nc2sc3c(c21)CCCC3 ZINC001164701673 719867054 /nfs/dbraw/zinc/86/70/54/719867054.db2.gz GPBINTHBCRFQDD-QMHKHESXSA-N 1 1 444.601 3.111 20 0 IGADMO COC(=O)[C@@]1(C)C[C@H]([NH+]2CCOCC2)CCN1c1c(Cl)ccc2c(Cl)ncnc21 ZINC001164700821 719879726 /nfs/dbraw/zinc/87/97/26/719879726.db2.gz MFEUXGUWWVQQSX-ZUOKHONESA-N 1 1 439.343 3.169 20 0 IGADMO CC[NH+](CC)Cc1nc2sc(C)c(C)c2c(N2C[C@H]3COC[C@@]3(c3nc(C)no3)C2)n1 ZINC001164801011 720060282 /nfs/dbraw/zinc/06/02/82/720060282.db2.gz FMBZGGBERPEHDS-AOMKIAJQSA-N 1 1 442.589 3.246 20 0 IGADMO COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1cc(Cl)nc(N(C)C)n1)CC2 ZINC001164712702 720094059 /nfs/dbraw/zinc/09/40/59/720094059.db2.gz YGHOWUMMGOZHDW-SFHVURJKSA-N 1 1 430.984 3.099 20 0 IGADMO COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1nccc(Cl)c1C(=O)OC)CC2 ZINC001164711562 720097979 /nfs/dbraw/zinc/09/79/79/720097979.db2.gz QVXOUVSOGWELFL-GOSISDBHSA-N 1 1 444.963 3.424 20 0 IGADMO COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1cc(OC)nc(SC)n1)CC2 ZINC001164716945 720117619 /nfs/dbraw/zinc/11/76/19/720117619.db2.gz LZZJFPNSJIDVCJ-SFHVURJKSA-N 1 1 429.590 3.110 20 0 IGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1nc(Cl)nc3cc(C(=O)OC)ccc31)C2 ZINC001164813829 720118768 /nfs/dbraw/zinc/11/87/68/720118768.db2.gz RBNWMQOZFWSADZ-SBUREZEXSA-N 1 1 444.963 3.255 20 0 IGADMO COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1ccc(-c3nc(C)no3)cn1)CC2 ZINC001164710517 720145254 /nfs/dbraw/zinc/14/52/54/720145254.db2.gz CAYIHCYUGPYTMH-OAQYLSRUSA-N 1 1 434.544 3.343 20 0 IGADMO COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1ncnc3c1ncn3C1CC1)CC2 ZINC001164711311 720145328 /nfs/dbraw/zinc/14/53/28/720145328.db2.gz HEAAOKVRRZKTDZ-FQEVSTJZSA-N 1 1 433.560 3.064 20 0 IGADMO CCOC(=O)c1c(Cl)cc(C)nc1N1CCCn2c(=O)cc(C[N@@H+](C)C(C)C)nc2C1 ZINC001164811935 720210146 /nfs/dbraw/zinc/21/01/46/720210146.db2.gz KGZKIGIMDLSKBT-UHFFFAOYSA-N 1 1 447.967 3.027 20 0 IGADMO Cc1ccc(C(F)(F)N2CCCn3c(=O)cc(C[N@H+](C)C(C)C)nc3C2)nc1Cl ZINC001164813492 720225144 /nfs/dbraw/zinc/22/51/44/720225144.db2.gz MWGOLDGKTXVTSS-UHFFFAOYSA-N 1 1 425.911 3.396 20 0 IGADMO O=C1N(CC2CC2)CC[C@]12CCCN(c1ncnc3c1CC[N@H+](Cc1ccccc1)C3)C2 ZINC001164818807 720278412 /nfs/dbraw/zinc/27/84/12/720278412.db2.gz NEQXAWLIMPXCCU-SANMLTNESA-N 1 1 431.584 3.264 20 0 IGADMO O=C1N(CC2CC2)CC[C@]12CCCN(c1ncnc3c1CC[N@@H+](Cc1ccccc1)C3)C2 ZINC001164818807 720278420 /nfs/dbraw/zinc/27/84/20/720278420.db2.gz NEQXAWLIMPXCCU-SANMLTNESA-N 1 1 431.584 3.264 20 0 IGADMO CCOC(=O)c1cnc(Cl)nc1C(F)(F)N1CC[C@@H]2[C@@H]1CC[N@@H+]2Cc1cccnc1 ZINC001164725590 720334416 /nfs/dbraw/zinc/33/44/16/720334416.db2.gz NZDMSSRUYKVSEQ-CVEARBPZSA-N 1 1 437.878 3.100 20 0 IGADMO CCOC(=O)c1cnc(Cl)nc1C(F)(F)N1CC[C@@H]2[C@@H]1CC[N@H+]2Cc1cccnc1 ZINC001164725590 720334419 /nfs/dbraw/zinc/33/44/19/720334419.db2.gz NZDMSSRUYKVSEQ-CVEARBPZSA-N 1 1 437.878 3.100 20 0 IGADMO CCOC(Cc1c(Cl)ncnc1N1CC[C@@H]2[C@@H]1CC[N@H+]2Cc1cccnc1)OCC ZINC001164723029 720385065 /nfs/dbraw/zinc/38/50/65/720385065.db2.gz FPFLMEIMZFZZSE-MOPGFXCFSA-N 1 1 431.968 3.320 20 0 IGADMO CCOC(Cc1c(Cl)ncnc1N1CC[C@@H]2[C@H]1CC[N@H+]2Cc1cccnc1)OCC ZINC001164723038 720385245 /nfs/dbraw/zinc/38/52/45/720385245.db2.gz FPFLMEIMZFZZSE-RTBURBONSA-N 1 1 431.968 3.320 20 0 IGADMO c1cncc(C[N@H+]2CC[C@@H]3[C@H]2CCN3c2nccc(-c3cnc(N4CCCCC4)nc3)n2)c1 ZINC001164725947 720401290 /nfs/dbraw/zinc/40/12/90/720401290.db2.gz OGZAAJYXDOZUOK-DHIUTWEWSA-N 1 1 442.571 3.172 20 0 IGADMO c1cncc(C[N@H+]2CC[C@@H]3[C@@H]2CCN3c2nccc(-c3cnc(N4CCCCC4)nc3)n2)c1 ZINC001164725960 720402209 /nfs/dbraw/zinc/40/22/09/720402209.db2.gz OGZAAJYXDOZUOK-XZOQPEGZSA-N 1 1 442.571 3.172 20 0 IGADMO CC(C)CNC(=O)c1ccc2c(c1)ncnc2N1CC[C@@H]2[C@@H]1CC[N@H+]2Cc1cccnc1 ZINC001164730937 720414204 /nfs/dbraw/zinc/41/42/04/720414204.db2.gz JWFICHANGJYQHD-PKTZIBPZSA-N 1 1 430.556 3.264 20 0 IGADMO c1ccc(N2CCN(c3ccc(N4CC[C@H]5[C@H]4CC[N@@H+]5Cc4cccnc4)nn3)CC2)cc1 ZINC001164729300 720442790 /nfs/dbraw/zinc/44/27/90/720442790.db2.gz GVDHVYHXWRZGIG-BJKOFHAPSA-N 1 1 441.583 3.051 20 0 IGADMO COc1cc2ncnc(N3CC[C@@H]4[C@H](C[C@H](Cn5cccn5)[N@H+]4C(C)C)C3)c2c(OC)c1 ZINC001164842926 720554387 /nfs/dbraw/zinc/55/43/87/720554387.db2.gz YZUFYLYXXABRMR-DBXWQHBBSA-N 1 1 436.560 3.221 20 0 IGADMO CC(C)[N@@H+]1[C@@H]2CCN(c3nccc(C(=O)OC(C)(C)C)n3)C[C@H]2C[C@H]1Cn1cccn1 ZINC001164840124 720559625 /nfs/dbraw/zinc/55/96/25/720559625.db2.gz RLRQHEGOQWLMDI-WSTZPKSXSA-N 1 1 426.565 3.006 20 0 IGADMO CCOC(=O)c1cnc2cc(N3CC[C@@H]4[C@H](C[C@@H](Cn5cccn5)[N@@H+]4C(C)C)C3)[nH]cc1-2 ZINC001164840828 720592976 /nfs/dbraw/zinc/59/29/76/720592976.db2.gz QYECULDINBRLIV-KGVIQGDOSA-N 1 1 436.560 3.314 20 0 IGADMO CCOC(=O)c1cnc2cc(N3CC[C@@H]4[C@H](C[C@@H](Cn5cccn5)[N@H+]4C(C)C)C3)[nH]cc1-2 ZINC001164840828 720592994 /nfs/dbraw/zinc/59/29/94/720592994.db2.gz QYECULDINBRLIV-KGVIQGDOSA-N 1 1 436.560 3.314 20 0 IGADMO C[N@H+](Cc1ccccc1)[C@@H]1COC2(C1)CCN(c1nc(Cl)nc3c1CNCC3)CC2 ZINC001164839957 720660615 /nfs/dbraw/zinc/66/06/15/720660615.db2.gz LHVZKGGEAYXBNF-SFHVURJKSA-N 1 1 427.980 3.036 20 0 IGADMO C[N@@H+](Cc1ccccc1)[C@@H]1COC2(C1)CCN(c1nc(Cl)nc3c1CNCC3)CC2 ZINC001164839957 720660621 /nfs/dbraw/zinc/66/06/21/720660621.db2.gz LHVZKGGEAYXBNF-SFHVURJKSA-N 1 1 427.980 3.036 20 0 IGADMO C[N@@H+](Cc1ccccc1)[C@H]1COC2(C1)CCN(c1nc(Cl)c(F)c3c1C(=O)NC3)CC2 ZINC001164839908 720696327 /nfs/dbraw/zinc/69/63/27/720696327.db2.gz CTWPIXPUVBMBSQ-MRXNPFEDSA-N 1 1 444.938 3.377 20 0 IGADMO COC(OC)c1c(CO)ccnc1N1CCC2(C[C@@H]([N@@H+](C)Cc3ccccc3)CO2)CC1 ZINC001164839337 720705353 /nfs/dbraw/zinc/70/53/53/720705353.db2.gz LCRXCPGABVBLLZ-OAQYLSRUSA-N 1 1 441.572 3.125 20 0 IGADMO CN1CCOc2c(Cl)nnc(N3CCC4(C[C@@H]([N@@H+](C)Cc5ccccc5)CO4)CC3)c21 ZINC001164842280 720708742 /nfs/dbraw/zinc/70/87/42/720708742.db2.gz XMMCEBLDYZTQFI-GOSISDBHSA-N 1 1 443.979 3.219 20 0 IGADMO Fc1ccc(Oc2nc(Cl)ncc2N2CC[N@H+]3C[C@@H](Oc4cncnc4)C[C@@H]3C2)cc1 ZINC001164739929 720766579 /nfs/dbraw/zinc/76/65/79/720766579.db2.gz JUYRRRQUQSVPDB-WBVHZDCISA-N 1 1 442.882 3.193 20 0 IGADMO Fc1ccc(-c2ccc(Cl)nn2)cc1N1CC[N@H+]2C[C@H](Oc3cncnc3)C[C@H]2C1 ZINC001164737525 720779679 /nfs/dbraw/zinc/77/96/79/720779679.db2.gz CDLADTVAJNBBFO-JKSUJKDBSA-N 1 1 426.883 3.068 20 0 IGADMO FC(F)c1nc2ccc(Cl)cc2c(N2CC[N@H+]3C[C@H](Oc4cncnc4)C[C@@H]3C2)n1 ZINC001164747686 720800087 /nfs/dbraw/zinc/80/00/87/720800087.db2.gz PAXMLSNWABZTBJ-ZIAGYGMSSA-N 1 1 432.862 3.353 20 0 IGADMO Fc1ccccc1Oc1nc(Cl)ncc1N1CC[N@H+]2C[C@@H](Oc3cncnc3)C[C@H]2C1 ZINC001164741559 720803087 /nfs/dbraw/zinc/80/30/87/720803087.db2.gz BKIQDPCCVLCVKQ-GJZGRUSLSA-N 1 1 442.882 3.193 20 0 IGADMO Fc1ccccc1Oc1nc(Cl)ncc1N1CC[N@H+]2C[C@H](Oc3cncnc3)C[C@@H]2C1 ZINC001164741602 720803151 /nfs/dbraw/zinc/80/31/51/720803151.db2.gz BKIQDPCCVLCVKQ-HUUCEWRRSA-N 1 1 442.882 3.193 20 0 IGADMO c1ncn(C[C@@H]2C[C@@H]3CN(c4ncnc5[nH]c6ccccc6c54)CC[C@H]3[N@H+]2CC2CC2)n1 ZINC001164741168 720832613 /nfs/dbraw/zinc/83/26/13/720832613.db2.gz DNHFOFIFPXMXHS-LVCYWYKZSA-N 1 1 428.544 3.082 20 0 IGADMO COc1cc2ccc(N3CC[C@@H]4[C@@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)nc2cc1OC ZINC001164751117 720835437 /nfs/dbraw/zinc/83/54/37/720835437.db2.gz YNKDVOKXZQXUPQ-JAXLGGSGSA-N 1 1 448.571 3.223 20 0 IGADMO Fc1cccc(Oc2ccnc(N3CC[C@@H]4[C@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)n2)c1 ZINC001164747475 720841619 /nfs/dbraw/zinc/84/16/19/720841619.db2.gz QQWVTJPNIUJRTN-KAGYGMCKSA-N 1 1 449.534 3.379 20 0 IGADMO Cc1cccc(-c2ccc(N3CC[C@@H]4[C@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)nn2)c1 ZINC001164740459 720847819 /nfs/dbraw/zinc/84/78/19/720847819.db2.gz BSZADPQNGOHZIE-CQOQZXRMSA-N 1 1 429.572 3.423 20 0 IGADMO COc1cccc(-c2ccc(N3CC[C@@H]4[C@@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)nn2)c1 ZINC001164739956 720848012 /nfs/dbraw/zinc/84/80/12/720848012.db2.gz BDAOGOJTTQTVHH-YZUZCNPQSA-N 1 1 445.571 3.123 20 0 IGADMO COc1cc2cnc(N3CC[C@@H]4[C@@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)cc2cc1OC ZINC001164745846 720850142 /nfs/dbraw/zinc/85/01/42/720850142.db2.gz NRNAEIZNCDGWHK-FDFHNCONSA-N 1 1 448.571 3.223 20 0 IGADMO Cc1cc(N2CC[C@@H]3[C@@H](C[C@H](Cn4cncn4)[N@H+]3CC3CC3)C2)nc(-c2ccsc2)n1 ZINC001164743927 720851610 /nfs/dbraw/zinc/85/16/10/720851610.db2.gz BAGAISFFCFJHJV-PWRODBHTSA-N 1 1 435.601 3.484 20 0 IGADMO CC(C)c1noc(-c2ccnc(N3CC[C@@H]4[C@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)c2)n1 ZINC001164751892 720853611 /nfs/dbraw/zinc/85/36/11/720853611.db2.gz RLOBLPGPLMYERA-QHAWAJNXSA-N 1 1 448.575 3.226 20 0 IGADMO Fc1ccc2c(Cl)nnc(N3CC[C@@H]4[C@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)c2c1 ZINC001164747606 720854366 /nfs/dbraw/zinc/85/43/66/720854366.db2.gz IGENLSRETUPOKP-OXFYSEKESA-N 1 1 441.942 3.393 20 0 IGADMO COc1cc2ccnc(N3CC[C@@H]4[C@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)c2cc1F ZINC001164744700 720858118 /nfs/dbraw/zinc/85/81/18/720858118.db2.gz CFGHZSZCAPEJGJ-XQBPLPMBSA-N 1 1 436.535 3.353 20 0 IGADMO CCc1nc(Cl)nc(Cl)c1N1CC[C@@H]2[C@@H](C[C@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164745478 720858383 /nfs/dbraw/zinc/85/83/83/720858383.db2.gz DSUBWGSGUUOZPV-ZMSDIMECSA-N 1 1 436.391 3.317 20 0 IGADMO CC[C@H](C)c1nc2[nH]ccc2c(N2CC[C@@H]3[C@@H](C[C@H](Cn4cncn4)[N@H+]3CC3CC3)C2)n1 ZINC001164754083 720861783 /nfs/dbraw/zinc/86/17/83/720861783.db2.gz ZYCUOJGJLWIPCI-XFIJJGBISA-N 1 1 434.592 3.442 20 0 IGADMO COCC[N@H+]1CCO[C@H]2CN(C(F)(F)c3ccc4cnc(Cl)nc4c3)CC[C@H]2C1 ZINC001164852375 720862847 /nfs/dbraw/zinc/86/28/47/720862847.db2.gz CNDIORRNWHWLEG-YJBOKZPZSA-N 1 1 426.895 3.002 20 0 IGADMO COCC[N@H+]1CCO[C@H]2CN(c3ccc(-c4ccc(C(=O)OC)cc4)c(C)n3)CC[C@H]2C1 ZINC001164855175 720871955 /nfs/dbraw/zinc/87/19/55/720871955.db2.gz GKIJYKAOPJARAD-GMAHTHKFSA-N 1 1 439.556 3.017 20 0 IGADMO COCC[N@H+]1CCO[C@@H]2CN(C(F)(F)c3cccc4c(Cl)ncnc43)CC[C@H]2C1 ZINC001164864278 720879160 /nfs/dbraw/zinc/87/91/60/720879160.db2.gz VHNXSEUZWCCCIK-WMLDXEAASA-N 1 1 426.895 3.002 20 0 IGADMO Clc1nc(Cl)nc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COCc2cccnc2)n1 ZINC001164752892 720881473 /nfs/dbraw/zinc/88/14/73/720881473.db2.gz NIPYBWPAYOZTRO-DYESRHJHSA-N 1 1 449.386 3.329 20 0 IGADMO Clc1nc(Cl)nc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COCc2cccnc2)n1 ZINC001164752894 720881687 /nfs/dbraw/zinc/88/16/87/720881687.db2.gz NIPYBWPAYOZTRO-LAUBAEHRSA-N 1 1 449.386 3.329 20 0 IGADMO COCC[N@H+]1CCO[C@@H]2CN(c3ncnc4cc(OCc5ccccc5)ccc43)CC[C@H]2C1 ZINC001164863805 720888137 /nfs/dbraw/zinc/88/81/37/720888137.db2.gz UICRVPMMCTZADK-SQJMNOBHSA-N 1 1 448.567 3.382 20 0 IGADMO COCOc1ccc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COCc2cccnc2)nc1 ZINC001164753875 720891659 /nfs/dbraw/zinc/89/16/59/720891659.db2.gz HJWNDWZHPUIRDZ-WIOPSUGQSA-N 1 1 438.572 3.214 20 0 IGADMO Nc1cc(Cl)ncc1N1CC[C@@]2(C1)C[N@@H+](CC1CC1)C[C@H]2COCc1cccnc1 ZINC001164754686 720905989 /nfs/dbraw/zinc/90/59/89/720905989.db2.gz XIVAYKBSJFSSNQ-CVDCTZTESA-N 1 1 427.980 3.467 20 0 IGADMO c1ccc2nc(N3CC[C@]4(C3)C[N@H+](CC3CC3)C[C@@H]4COCc3cccnc3)nnc2c1 ZINC001164754627 720919672 /nfs/dbraw/zinc/91/96/72/720919672.db2.gz WKUFAHHTFRQKRI-PXDATVDWSA-N 1 1 430.556 3.175 20 0 IGADMO Nc1nc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COCc2cccnc2)ccc1Cl ZINC001164754674 720936420 /nfs/dbraw/zinc/93/64/20/720936420.db2.gz XFNJGHIXNXFNCL-CVDCTZTESA-N 1 1 427.980 3.467 20 0 IGADMO CCOC(=O)c1c(Cl)cc(C)nc1N1CC[N@H+]2C[C@H](OCc3cccnc3)C[C@@H]2C1 ZINC001164869568 721050514 /nfs/dbraw/zinc/05/05/14/721050514.db2.gz UICNZFCOLOSGFS-QZTJIDSGSA-N 1 1 430.936 3.095 20 0 IGADMO FC(F)(c1nc(Cl)cc(Cl)n1)N1CC[N@H+]2C[C@H](OCc3cccnc3)C[C@H]2C1 ZINC001164868019 721054296 /nfs/dbraw/zinc/05/42/96/721054296.db2.gz MBXXXJZPRYAICV-UONOGXRCSA-N 1 1 430.286 3.203 20 0 IGADMO Fc1cc2nc(Cl)c(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@H]4C3)nc2cc1F ZINC001164863788 721077627 /nfs/dbraw/zinc/07/76/27/721077627.db2.gz DEOVVUWGGFVFNR-LSDHHAIUSA-N 1 1 431.874 3.436 20 0 IGADMO COc1cc2c(cc1Cl)ncnc2N1CC[N@H+]2C[C@@H](OCc3cccnc3)C[C@H]2C1 ZINC001164865916 721091657 /nfs/dbraw/zinc/09/16/57/721091657.db2.gz PRSZMDVZSPOPSN-IRXDYDNUSA-N 1 1 425.920 3.167 20 0 IGADMO CC(C)(C)NC(=O)c1ccc(Cl)nc1N1CC[N@H+]2C[C@@H](OCc3cccnc3)C[C@H]2C1 ZINC001164865210 721101086 /nfs/dbraw/zinc/10/10/86/721101086.db2.gz JMUAJKDVTSKVLA-ROUUACIJSA-N 1 1 443.979 3.138 20 0 IGADMO c1ccc2nc(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@@H]4C3)c(N3CCCCC3)nc2c1 ZINC001164874432 721136910 /nfs/dbraw/zinc/13/69/10/721136910.db2.gz JXOOMVYDEKKPLS-YADHBBJMSA-N 1 1 444.583 3.495 20 0 IGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4nc(Cl)ncc4OCc4ccccc4)C[C@H]3C2)cn1 ZINC001164765606 721140579 /nfs/dbraw/zinc/14/05/79/721140579.db2.gz JNNUIPNDBFSLOU-VQTJNVASSA-N 1 1 438.963 3.401 20 0 IGADMO FC(F)(c1cc(C2CC2)nnc1Cl)N1CC[N@H+]2C[C@@H](OCc3cccnc3)C[C@H]2C1 ZINC001164879835 721149741 /nfs/dbraw/zinc/14/97/41/721149741.db2.gz UJQRTYJWQQQVGS-IRXDYDNUSA-N 1 1 435.906 3.427 20 0 IGADMO O=C(OCc1ccccc1)c1ccc(N2CC[N@H+]3C[C@H](OCc4cccnc4)C[C@@H]3C2)nc1 ZINC001164871102 721156662 /nfs/dbraw/zinc/15/66/62/721156662.db2.gz DRFMRZANGYRYOT-DNQXCXABSA-N 1 1 444.535 3.313 20 0 IGADMO CCOc1ccc(-c2ccc(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@@H]4C3)nn2)cc1 ZINC001164872795 721162964 /nfs/dbraw/zinc/16/29/64/721162964.db2.gz IJXLSFKCRPTUHK-GGAORHGYSA-N 1 1 431.540 3.417 20 0 IGADMO Cc1cc(N2CC[N@H+]3C[C@H](OCc4cccnc4)C[C@H]3C2)nc(-c2ccc(Cl)nc2)n1 ZINC001164877047 721176500 /nfs/dbraw/zinc/17/65/00/721176500.db2.gz OFWUGEKPKRWVMH-VQTJNVASSA-N 1 1 436.947 3.375 20 0 IGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(C(F)(F)Cc4nc(Cl)cc(Cl)n4)C[C@H]3C2)cn1 ZINC001164772340 721180602 /nfs/dbraw/zinc/18/06/02/721180602.db2.gz SJCHWWDZBSRMGJ-UONOGXRCSA-N 1 1 431.318 3.106 20 0 IGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4ncnc5c(-c6ccccc6)nsc54)C[C@@H]3C2)cn1 ZINC001164772382 721202942 /nfs/dbraw/zinc/20/29/42/721202942.db2.gz UKDSCWVFVFXUQR-MOPGFXCFSA-N 1 1 431.569 3.445 20 0 IGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4ncnc5c(-c6ccccc6)nsc54)C[C@H]3C2)cn1 ZINC001164772384 721203684 /nfs/dbraw/zinc/20/36/84/721203684.db2.gz UKDSCWVFVFXUQR-RBUKOAKNSA-N 1 1 431.569 3.445 20 0 IGADMO COc1ccc(Oc2cc(N3C[C@@H]4C[N@H+](Cc5cnn(C)c5)CC[C@@H]4C3)nc(C)n2)cc1 ZINC001164760667 721230559 /nfs/dbraw/zinc/23/05/59/721230559.db2.gz FRPQYRCVYMCWJA-UXHICEINSA-N 1 1 434.544 3.278 20 0 IGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(C(Cl)(Cl)Oc4ccc(Cl)nc4)C[C@@H]3C2)cn1 ZINC001164766884 721244941 /nfs/dbraw/zinc/24/49/41/721244941.db2.gz VSXGATDYVDOTEE-GJZGRUSLSA-N 1 1 430.767 3.390 20 0 IGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2C[C@@H]3COC[C@@H](C(=O)NCc4ccco4)[C@H]3C2)nc1 ZINC001164763930 721257328 /nfs/dbraw/zinc/25/73/28/721257328.db2.gz OCNXPAXMQRKZLP-CWKRKGSWSA-N 1 1 438.572 3.237 20 0 IGADMO Cc1cc(N2CCC3(CC2)COCC[N@H+](CC(=O)N(C)C)C3)nc2cc(Cl)ccc12 ZINC001164875270 721278566 /nfs/dbraw/zinc/27/85/66/721278566.db2.gz URGPAKSMNYANAH-UHFFFAOYSA-N 1 1 430.980 3.204 20 0 IGADMO C[N@@H+](Cc1ccc(N2CC[C@H]3CN(C(=O)c4ccsc4)CCO[C@@H]3C2)nc1)C1CC1 ZINC001164876603 721299433 /nfs/dbraw/zinc/29/94/33/721299433.db2.gz JJAWOZJPZWEULU-GHTZIAJQSA-N 1 1 426.586 3.105 20 0 IGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2C[C@@H]3CN(S(=O)(=O)c4ccccc4)C[C@@H]3C2)nc1 ZINC001164877319 721309431 /nfs/dbraw/zinc/30/94/31/721309431.db2.gz IKGZPEXRIUDCNV-FUPPJEDESA-N 1 1 440.613 3.385 20 0 IGADMO COC(=O)c1cc(Cl)cnc1N1CCC[C@@]2(C1)COCC[N@H+](Cc1c(C)noc1C)C2 ZINC001164776005 721335827 /nfs/dbraw/zinc/33/58/27/721335827.db2.gz BQMFMQJCJWXZLU-JOCHJYFZSA-N 1 1 448.951 3.245 20 0 IGADMO COC(=O)c1cc(Cl)cnc1N1CCC[C@@]2(C1)COCC[N@@H+](Cc1c(C)noc1C)C2 ZINC001164776005 721335830 /nfs/dbraw/zinc/33/58/30/721335830.db2.gz BQMFMQJCJWXZLU-JOCHJYFZSA-N 1 1 448.951 3.245 20 0 IGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@]2(CCCN(c3nc4nc[nH]c4cc3Cl)C2)C1 ZINC001164780764 721356588 /nfs/dbraw/zinc/35/65/88/721356588.db2.gz HEUSTXHOBCSZIZ-OAQYLSRUSA-N 1 1 430.940 3.335 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@]2(CCCN(c3nc4nc[nH]c4cc3Cl)C2)C1 ZINC001164780764 721356592 /nfs/dbraw/zinc/35/65/92/721356592.db2.gz HEUSTXHOBCSZIZ-OAQYLSRUSA-N 1 1 430.940 3.335 20 0 IGADMO CCOC(=O)c1c(C)ccnc1N1CCC[C@@]2(C1)COCC[N@H+](Cc1c(C)noc1C)C2 ZINC001164781662 721360696 /nfs/dbraw/zinc/36/06/96/721360696.db2.gz KKWMGTIZIKUUDZ-XMMPIXPASA-N 1 1 442.560 3.291 20 0 IGADMO CCOC(=O)c1c(C)ccnc1N1CCC[C@@]2(C1)COCC[N@@H+](Cc1c(C)noc1C)C2 ZINC001164781662 721360697 /nfs/dbraw/zinc/36/06/97/721360697.db2.gz KKWMGTIZIKUUDZ-XMMPIXPASA-N 1 1 442.560 3.291 20 0 IGADMO O=C1CO[C@H]2CN(c3nc(Cl)ccc3C[NH+]3CCCC3)C[C@@H]2N1c1cccc(F)c1 ZINC001164882610 721364898 /nfs/dbraw/zinc/36/48/98/721364898.db2.gz KFWCRMBCOHATSX-OALUTQOASA-N 1 1 430.911 3.091 20 0 IGADMO O=C1CO[C@@H]2CN(c3nc(Cl)ccc3C[NH+]3CCCC3)C[C@H]2N1c1cccc(F)c1 ZINC001164882612 721365310 /nfs/dbraw/zinc/36/53/10/721365310.db2.gz KFWCRMBCOHATSX-RTBURBONSA-N 1 1 430.911 3.091 20 0 IGADMO COc1ccc2nc(Cl)nc(N3CC[C@@]4(C3)CCC[C@H](CN3CC[NH+](C)CC3)O4)c2c1 ZINC001164886727 721380026 /nfs/dbraw/zinc/38/00/26/721380026.db2.gz FYMXULOJAPPOCB-WZONZLPQSA-N 1 1 445.995 3.057 20 0 IGADMO Cc1cccc2c1nc(Cl)nc2N1CC[C@]2(C1)CCC[C@@H](CN1CC[NH+](C)CC1)O2 ZINC001164888351 721401413 /nfs/dbraw/zinc/40/14/13/721401413.db2.gz OKBYGDDENMHGBM-MBSDFSHPSA-N 1 1 429.996 3.357 20 0 IGADMO C[NH+]1CCN(C[C@H]2CCC[C@]3(CCN(c4nccc(-c5c[nH]c6ccccc56)n4)C3)O2)CC1 ZINC001164888953 721408885 /nfs/dbraw/zinc/40/88/85/721408885.db2.gz PUVWHGDTTMWMDE-FQRUVTKNSA-N 1 1 446.599 3.390 20 0 IGADMO C[NH+]1CCN(C[C@@H]2CCC[C@]3(CCN(C(F)(F)c4cc(Cl)ncc4F)C3)O2)CC1 ZINC001164886675 721410649 /nfs/dbraw/zinc/41/06/49/721410649.db2.gz KSMBAAUTEZJEGP-HNAYVOBHSA-N 1 1 432.918 3.184 20 0 IGADMO COc1cc2c(cc1Cl)ncnc2N1CC[C@@]2(C1)CCC[C@@H](CN1CC[NH+](C)CC1)O2 ZINC001164886579 721412532 /nfs/dbraw/zinc/41/25/32/721412532.db2.gz KGOOIEZBTMZDFN-GAJHUEQPSA-N 1 1 445.995 3.057 20 0 IGADMO Cc1nc2cc(Cl)ccc2c(N2CC[C@]3(C2)CCC[C@H](CN2CC[NH+](C)CC2)O3)n1 ZINC001164890516 721412772 /nfs/dbraw/zinc/41/27/72/721412772.db2.gz SWLLTMZZFOVORN-XXBNENTESA-N 1 1 429.996 3.357 20 0 IGADMO Cc1cc(Cl)ncc1C(F)(F)N1CC[C@]2(C1)CCC[C@H](CN1CC[NH+](C)CC1)O2 ZINC001164886190 721413021 /nfs/dbraw/zinc/41/30/21/721413021.db2.gz IBIMWKZQEPSLBH-XLIONFOSSA-N 1 1 428.955 3.354 20 0 IGADMO CSc1nc2ccccc2c(N2CC[C@]3(C2)CCC[C@H](CN2CC[NH+](C)CC2)O3)n1 ZINC001164888992 721417299 /nfs/dbraw/zinc/41/72/99/721417299.db2.gz PZPQTCBVDYFHCO-JPYJTQIMSA-N 1 1 427.618 3.117 20 0 IGADMO Cc1ccc(Cl)nc1C(F)(F)N1CC[C@@]2(C1)CCC[C@H](CN1CC[NH+](C)CC1)O2 ZINC001164886287 721421532 /nfs/dbraw/zinc/42/15/32/721421532.db2.gz IPSBFXKMQKEMMO-YLJYHZDGSA-N 1 1 428.955 3.354 20 0 IGADMO C[NH+]1CCN(C[C@@H]2CCC[C@]3(CCN(c4cncc(Oc5cccc(F)c5)n4)C3)O2)CC1 ZINC001164889602 721424370 /nfs/dbraw/zinc/42/43/70/721424370.db2.gz CFZOIDYCJVTVCU-XUZZJYLKSA-N 1 1 441.551 3.173 20 0 IGADMO O=C(c1cnc(N2C[C@@H]3C[N@@H+](Cc4nccs4)C[C@@H]3C2)c(Cl)c1)N1CCCCC1 ZINC001164782546 721428517 /nfs/dbraw/zinc/42/85/17/721428517.db2.gz GPPKFZPRNHRRLM-CALCHBBNSA-N 1 1 431.993 3.386 20 0 IGADMO O=C(c1cnc(N2C[C@@H]3C[N@H+](Cc4nccs4)C[C@@H]3C2)c(Cl)c1)N1CCCCC1 ZINC001164782546 721428520 /nfs/dbraw/zinc/42/85/20/721428520.db2.gz GPPKFZPRNHRRLM-CALCHBBNSA-N 1 1 431.993 3.386 20 0 IGADMO c1csc(C[NH+]2C[C@H]3CN(c4ccc(-c5ccc6c(c5)OCCCO6)nn4)C[C@@H]3C2)n1 ZINC001164787297 721430872 /nfs/dbraw/zinc/43/08/72/721430872.db2.gz PUDWKNRXZXSOCC-ROUUACIJSA-N 1 1 435.553 3.330 20 0 IGADMO Cc1nc2sc3c(c2c(N2CC[C@]4(C2)CCC[C@H](CN2CC[NH+](C)CC2)O4)n1)CCC3 ZINC001164895801 721433032 /nfs/dbraw/zinc/43/30/32/721433032.db2.gz PQUGDGGQSABMLZ-KOSHJBKYSA-N 1 1 441.645 3.254 20 0 IGADMO FC(F)(Cc1nc2c(ncnc2Cl)s1)N1C[C@@H]2C[N@@H+](Cc3nccs3)C[C@@H]2C1 ZINC001164784856 721439744 /nfs/dbraw/zinc/43/97/44/721439744.db2.gz QYQADHSFZMQORC-PHIMTYICSA-N 1 1 442.948 3.395 20 0 IGADMO FC(F)(Cc1nc2c(ncnc2Cl)s1)N1C[C@@H]2C[N@H+](Cc3nccs3)C[C@@H]2C1 ZINC001164784856 721439745 /nfs/dbraw/zinc/43/97/45/721439745.db2.gz QYQADHSFZMQORC-PHIMTYICSA-N 1 1 442.948 3.395 20 0 IGADMO C[NH+]1CCN(C[C@@H]2CCC[C@@]3(CCN(c4nccc(Oc5ccc(F)cc5)n4)C3)O2)CC1 ZINC001164892218 721440399 /nfs/dbraw/zinc/44/03/99/721440399.db2.gz HTUVIXKXSRRAJV-URXFXBBRSA-N 1 1 441.551 3.173 20 0 IGADMO C[NH+]1CCN(C[C@@H]2CCC[C@@]3(CCN(c4ccc(-c5c(F)cccc5F)nn4)C3)O2)CC1 ZINC001164893661 721441538 /nfs/dbraw/zinc/44/15/38/721441538.db2.gz JVPKPPYTZNVGRD-UUOWRZLLSA-N 1 1 443.542 3.187 20 0 IGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1ncc(OC)c(NC(C)C)n1)CC2 ZINC001164784073 721447905 /nfs/dbraw/zinc/44/79/05/721447905.db2.gz DMSNIMFQDLVUIA-FQEVSTJZSA-N 1 1 447.624 3.039 20 0 IGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1ncc(OC)c(NC(C)C)n1)CC2 ZINC001164784097 721447919 /nfs/dbraw/zinc/44/79/19/721447919.db2.gz DMSNIMFQDLVUIA-HXUWFJFHSA-N 1 1 447.624 3.039 20 0 IGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1ccc(N3CCCCC3)nn1)CC2 ZINC001164785203 721448380 /nfs/dbraw/zinc/44/83/80/721448380.db2.gz HECVCDLJDBJFOT-QFIPXVFZSA-N 1 1 443.636 3.201 20 0 IGADMO CCOC(=O)c1ccc(N2CCC3(C[C@@H](COCC4CC4)[N@@H+](CCOC)C3)CC2)nc1C ZINC001164784981 721450413 /nfs/dbraw/zinc/45/04/13/721450413.db2.gz GADAZOKFOOQPOF-NRFANRHFSA-N 1 1 445.604 3.301 20 0 IGADMO CCN(CC)c1cncc(N2CCC3(C[C@H](COCC4CC4)[N@@H+](CCOC)C3)CC2)n1 ZINC001164786904 721463563 /nfs/dbraw/zinc/46/35/63/721463563.db2.gz QLKGNBTZMLBKCD-OAQYLSRUSA-N 1 1 431.625 3.057 20 0 IGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1cc(-c3ncc[nH]3)ccn1)CC2 ZINC001164789228 721463716 /nfs/dbraw/zinc/46/37/16/721463716.db2.gz VXZGUERGLRZVHY-NRFANRHFSA-N 1 1 425.577 3.206 20 0 IGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1nnc(OC)c3ccccc31)CC2 ZINC001164791688 721467019 /nfs/dbraw/zinc/46/70/19/721467019.db2.gz XOTWCCLMJJTIPR-HXUWFJFHSA-N 1 1 440.588 3.372 20 0 IGADMO CN1CCOc2c(Cl)nnc(N3CCC4(CC([N@@H+](C)Cc5ccncc5)C4)CC3)c21 ZINC001164795112 721499522 /nfs/dbraw/zinc/49/95/22/721499522.db2.gz DKGNORMYTGSZLT-UHFFFAOYSA-N 1 1 428.968 3.235 20 0 IGADMO CC(C)C(=O)N[C@@H]1COCCC12CCN(c1nc(Cl)ccc1C[NH+]1CCCC1)CC2 ZINC001164898454 721501238 /nfs/dbraw/zinc/50/12/38/721501238.db2.gz SAIYRHJCUCKEIQ-LJQANCHMSA-N 1 1 435.012 3.479 20 0 IGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2nc(Cl)nc3c2CSCC3)[C@@H]2CCCO[C@H]12 ZINC001164809424 721534961 /nfs/dbraw/zinc/53/49/61/721534961.db2.gz UMRVMIZKAYIKHJ-QRVBRYPASA-N 1 1 431.993 3.183 20 0 IGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2nc(Cl)nc3c2CSCC3)[C@@H]2CCCO[C@H]12 ZINC001164809424 721534963 /nfs/dbraw/zinc/53/49/63/721534963.db2.gz UMRVMIZKAYIKHJ-QRVBRYPASA-N 1 1 431.993 3.183 20 0 IGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2nc(Cl)nc3c2CSCC3)[C@@H]2CCCO[C@@H]12 ZINC001164809408 721535026 /nfs/dbraw/zinc/53/50/26/721535026.db2.gz UMRVMIZKAYIKHJ-GUDVDZBRSA-N 1 1 431.993 3.183 20 0 IGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2nc(Cl)nc3c2CSCC3)[C@@H]2CCCO[C@@H]12 ZINC001164809408 721535029 /nfs/dbraw/zinc/53/50/29/721535029.db2.gz UMRVMIZKAYIKHJ-GUDVDZBRSA-N 1 1 431.993 3.183 20 0 IGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2cncc(OCc3ccccc3)n2)[C@@H]2CCCO[C@@H]12 ZINC001164807832 721537408 /nfs/dbraw/zinc/53/74/08/721537408.db2.gz RMAASUDDHKJVIM-TZBSWOFLSA-N 1 1 431.540 3.319 20 0 IGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2cncc(OCc3ccccc3)n2)[C@@H]2CCCO[C@@H]12 ZINC001164807832 721537412 /nfs/dbraw/zinc/53/74/12/721537412.db2.gz RMAASUDDHKJVIM-TZBSWOFLSA-N 1 1 431.540 3.319 20 0 IGADMO Cc1cc(NC(=O)c2cccnc2N2CC[N@H+]3C[C@@H](Oc4cccc(F)c4)C[C@H]3C2)no1 ZINC001164903536 721551691 /nfs/dbraw/zinc/55/16/91/721551691.db2.gz CCMCEVFYFKYXPB-HKUYNNGSSA-N 1 1 437.475 3.111 20 0 IGADMO CCOC(=O)c1cc2cccnc2nc1N1C[C@H]([N@H+](C)Cc2cccnc2)[C@@H]2OCCC[C@H]21 ZINC001164805636 721553397 /nfs/dbraw/zinc/55/33/97/721553397.db2.gz MNIARKONSVEOHN-BHIFYINESA-N 1 1 447.539 3.070 20 0 IGADMO CCOC(=O)c1cc2cccnc2nc1N1C[C@H]([N@@H+](C)Cc2cccnc2)[C@@H]2OCCC[C@H]21 ZINC001164805636 721553401 /nfs/dbraw/zinc/55/34/01/721553401.db2.gz MNIARKONSVEOHN-BHIFYINESA-N 1 1 447.539 3.070 20 0 IGADMO CN(C)c1cc(C(F)(F)N2CC[N@H+]3C[C@H](Oc4cccc(F)c4)C[C@@H]3C2)nc(Cl)n1 ZINC001164904239 721564647 /nfs/dbraw/zinc/56/46/47/721564647.db2.gz DOCVIWQNWDUYHD-GDBMZVCRSA-N 1 1 441.885 3.222 20 0 IGADMO COC(=O)c1cc2ccccc2nc1N1C[C@H]([N@H+](C)Cc2cccnc2)[C@H]2OCCC[C@@H]21 ZINC001164799620 721566782 /nfs/dbraw/zinc/56/67/82/721566782.db2.gz CZCDELOUOUIJJK-VABKMULXSA-N 1 1 432.524 3.285 20 0 IGADMO COC(=O)c1cc2ccccc2nc1N1C[C@H]([N@@H+](C)Cc2cccnc2)[C@H]2OCCC[C@@H]21 ZINC001164799620 721566785 /nfs/dbraw/zinc/56/67/85/721566785.db2.gz CZCDELOUOUIJJK-VABKMULXSA-N 1 1 432.524 3.285 20 0 IGADMO COc1cc(C(F)(F)N2CC[N@H+]3C[C@@H](Oc4cccc(F)c4)C[C@H]3C2)nc(Cl)n1 ZINC001164908041 721566890 /nfs/dbraw/zinc/56/68/90/721566890.db2.gz PKKGLZFGBHZUMN-ZFWWWQNUSA-N 1 1 428.842 3.165 20 0 IGADMO CC(C)n1cnc2c1nc(Cl)nc2N1C[C@H]([N@H+](C)Cc2cccnc2)[C@@H]2OCCC[C@@H]21 ZINC001164805350 721569058 /nfs/dbraw/zinc/56/90/58/721569058.db2.gz MSTHEPQOEIVTAY-JENIJYKNSA-N 1 1 441.967 3.324 20 0 IGADMO CC(C)n1cnc2c1nc(Cl)nc2N1C[C@H]([N@@H+](C)Cc2cccnc2)[C@@H]2OCCC[C@@H]21 ZINC001164805350 721569059 /nfs/dbraw/zinc/56/90/59/721569059.db2.gz MSTHEPQOEIVTAY-JENIJYKNSA-N 1 1 441.967 3.324 20 0 IGADMO COc1ccc(-c2ccc(N3C[C@H]([N@H+](C)Cc4cccnc4)[C@@H]4OCCC[C@@H]43)nn2)cc1 ZINC001164800750 721576774 /nfs/dbraw/zinc/57/67/74/721576774.db2.gz FODNHHIURZKTSU-SONWIMMPSA-N 1 1 431.540 3.415 20 0 IGADMO COc1ccc(-c2ccc(N3C[C@H]([N@@H+](C)Cc4cccnc4)[C@@H]4OCCC[C@@H]43)nn2)cc1 ZINC001164800750 721576776 /nfs/dbraw/zinc/57/67/76/721576776.db2.gz FODNHHIURZKTSU-SONWIMMPSA-N 1 1 431.540 3.415 20 0 IGADMO CC1CCN(C(=O)c2ccc(N3C[C@H]([N@@H+](C)Cc4cccnc4)[C@H]4OCCC[C@H]43)nc2)CC1 ZINC001164800216 721577145 /nfs/dbraw/zinc/57/71/45/721577145.db2.gz DJYACUULDWLNFO-CUYJMHBOSA-N 1 1 449.599 3.217 20 0 IGADMO COC(=O)c1cnc(N2CCC(F)(F)[C@@]3(CC[N@@H+](Cc4ccccn4)C3)C2)cc1OC ZINC001164906255 721586984 /nfs/dbraw/zinc/58/69/84/721586984.db2.gz MQENFSDPLYWQNR-OAQYLSRUSA-N 1 1 432.471 3.010 20 0 IGADMO CC(C)OC(=O)c1ccc(N2CCC(F)(F)[C@@]3(CC[N@@H+](Cc4ccccn4)C3)C2)nn1 ZINC001164903698 721692918 /nfs/dbraw/zinc/69/29/18/721692918.db2.gz BSIWBCWTMWHMCK-OAQYLSRUSA-N 1 1 431.487 3.175 20 0 IGADMO CC(C)N(C)Cc1nnc2n1CCCN(c1[nH+]cnc3c1ccn3Cc1ccccc1)C2 ZINC001165010450 721705619 /nfs/dbraw/zinc/70/56/19/721705619.db2.gz IMYDVLQBXZKDAA-UHFFFAOYSA-N 1 1 430.560 3.322 20 0 IGADMO CN(C)C(=O)C[NH+]1CCC2(CCCN2C(F)(F)c2ccc3c(Cl)ncnc3c2)CC1 ZINC001165008446 721732068 /nfs/dbraw/zinc/73/20/68/721732068.db2.gz OGAGBDUUMJYGPA-UHFFFAOYSA-N 1 1 437.922 3.351 20 0 IGADMO CCS(=O)(=O)c1ccnc(N2CCc3c(C[N@H+](C)Cc4ccco4)cncc3C2)c1 ZINC001164911148 721766062 /nfs/dbraw/zinc/76/60/62/721766062.db2.gz NBBPPNZXBGIULT-UHFFFAOYSA-N 1 1 426.542 3.058 20 0 IGADMO CCS(=O)(=O)c1ccnc(N2CCc3c(C[N@@H+](C)Cc4ccco4)cncc3C2)c1 ZINC001164911148 721766067 /nfs/dbraw/zinc/76/60/67/721766067.db2.gz NBBPPNZXBGIULT-UHFFFAOYSA-N 1 1 426.542 3.058 20 0 IGADMO CCC[N@H+]1CCCC[C@@H]1c1ccc(N2CCOC[C@]3(CN(C(=O)C(C)C)CCO3)C2)nc1 ZINC001165025671 721788241 /nfs/dbraw/zinc/78/82/41/721788241.db2.gz WGSSCQZWAVIDCV-RCZVLFRGSA-N 1 1 444.620 3.109 20 0 IGADMO CCOC(=O)c1c[n-]c2nc[nH+]c(N3C[C@@H]4CCC[C@H]([N@@H+](C)Cc5ccccn5)[C@H]4C3)c12 ZINC001165024611 721805883 /nfs/dbraw/zinc/80/58/83/721805883.db2.gz MJOUEQHRNBVCJP-VDGAXYAQSA-N 1 1 434.544 3.267 20 0 IGADMO CCOC(=O)c1c[nH]c2ncnc(N3C[C@@H]4CCC[C@H]([N@H+](C)Cc5ccccn5)[C@H]4C3)c12 ZINC001165024611 721805888 /nfs/dbraw/zinc/80/58/88/721805888.db2.gz MJOUEQHRNBVCJP-VDGAXYAQSA-N 1 1 434.544 3.267 20 0 IGADMO CCOC(=O)c1c[nH]c2ncnc(N3C[C@@H]4CCC[C@H]([N@@H+](C)Cc5ccccn5)[C@H]4C3)c12 ZINC001165024611 721805889 /nfs/dbraw/zinc/80/58/89/721805889.db2.gz MJOUEQHRNBVCJP-VDGAXYAQSA-N 1 1 434.544 3.267 20 0 IGADMO C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@@H]2CN(c3nc(Cl)cc(O[C@@H]4CCOC4)n3)C[C@H]21 ZINC001165025214 721831347 /nfs/dbraw/zinc/83/13/47/721831347.db2.gz MFPKKAZHAASVBV-VBSBHUPXSA-N 1 1 443.979 3.430 20 0 IGADMO CNC(=O)c1nc(N2CCC3(CC2)C[N@@H+](Cc2ccc(C)cc2)CCO3)ccc1Cl ZINC001164939680 721928348 /nfs/dbraw/zinc/92/83/48/721928348.db2.gz OEJPLTLBJATOGS-UHFFFAOYSA-N 1 1 428.964 3.274 20 0 IGADMO Cc1ccc(C[N@H+]2CCOC3(CCN(c4ccc(Cn5ccccc5=O)cn4)CC3)C2)cc1 ZINC001164939107 721931410 /nfs/dbraw/zinc/93/14/10/721931410.db2.gz JCNYKRGRRXBNCB-UHFFFAOYSA-N 1 1 444.579 3.471 20 0 IGADMO C[NH+](C)CC1CCN(c2cc(NS(=O)(=O)c3ccc(Cl)nc3)ccc2F)CC1 ZINC001165045000 721950048 /nfs/dbraw/zinc/95/00/48/721950048.db2.gz LPNLMOMTVSDWGE-UHFFFAOYSA-N 1 1 426.945 3.453 20 0 IGADMO O=C1NCC[N@@H+](Cc2ccccc2)C12CCN(c1csc3ncnc(Cl)c13)CC2 ZINC001164944113 721972566 /nfs/dbraw/zinc/97/25/66/721972566.db2.gz GMLAZNAHWQDSOQ-UHFFFAOYSA-N 1 1 427.961 3.316 20 0 IGADMO O=C1NCC[N@H+](Cc2ccccc2)C12CCN(c1csc3ncnc(Cl)c13)CC2 ZINC001164944113 721972568 /nfs/dbraw/zinc/97/25/68/721972568.db2.gz GMLAZNAHWQDSOQ-UHFFFAOYSA-N 1 1 427.961 3.316 20 0 IGADMO O=C1NCC[N@@H+](Cc2ccccc2)C12CCN(c1ncnc3[nH]c4cc(F)ccc4c31)CC2 ZINC001164947173 721981961 /nfs/dbraw/zinc/98/19/61/721981961.db2.gz GFDRNWKXFBQDLC-UHFFFAOYSA-N 1 1 444.514 3.221 20 0 IGADMO O=C1NCC[N@H+](Cc2ccccc2)C12CCN(c1ncnc3[nH]c4cc(F)ccc4c31)CC2 ZINC001164947173 721981963 /nfs/dbraw/zinc/98/19/63/721981963.db2.gz GFDRNWKXFBQDLC-UHFFFAOYSA-N 1 1 444.514 3.221 20 0 IGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2C[C@H](NC(=O)c3cscn3)[C@H]3OCCC[C@@H]32)nc1 ZINC001164950327 722001792 /nfs/dbraw/zinc/00/17/92/722001792.db2.gz HQVHTVQJTWCNMI-ZJDLJICXSA-N 1 1 441.601 3.251 20 0 IGADMO COC(=O)c1cc2c(OC)[nH]c(N3CCC4(CC[N@@H+](Cc5cccnc5)C4)CC3)cc-2n1 ZINC001164951784 722016898 /nfs/dbraw/zinc/01/68/98/722016898.db2.gz DQBCWXJYAPYACH-UHFFFAOYSA-N 1 1 435.528 3.246 20 0 IGADMO CCOC(=O)c1cc2ccc(N3CCC4(CC3)COCC[N@@H+](Cc3ccncc3)C4)[nH]c-2n1 ZINC001164962188 722058438 /nfs/dbraw/zinc/05/84/38/722058438.db2.gz PLIHGZAUGFOMJV-UHFFFAOYSA-N 1 1 449.555 3.254 20 0 IGADMO CCOC(=O)c1cc2ccc(N3CCC4(CC3)COCC[N@H+](Cc3ccncc3)C4)nc2[nH]1 ZINC001164962188 722058440 /nfs/dbraw/zinc/05/84/40/722058440.db2.gz PLIHGZAUGFOMJV-UHFFFAOYSA-N 1 1 449.555 3.254 20 0 IGADMO CCOC(=O)c1cc2ccc(N3CCC4(CC3)COCC[N@@H+](Cc3ccncc3)C4)nc2[nH]1 ZINC001164962188 722058443 /nfs/dbraw/zinc/05/84/43/722058443.db2.gz PLIHGZAUGFOMJV-UHFFFAOYSA-N 1 1 449.555 3.254 20 0 IGADMO CCOC(=O)c1nc(N2CCC3(CC2)COCC[N@@H+](Cc2ccncc2)C3)ccc1Cl ZINC001164959994 722058930 /nfs/dbraw/zinc/05/89/30/722058930.db2.gz BWFVEROQDMQGLT-UHFFFAOYSA-N 1 1 444.963 3.426 20 0 IGADMO Cc1ccc(N(c2cccc(N3CCN(C)CC3)n2)c2ncnc3c2CC[NH2+]CC3)cc1 ZINC001164968184 722078581 /nfs/dbraw/zinc/07/85/81/722078581.db2.gz VCYBSEWJHAKRFJ-UHFFFAOYSA-N 1 1 429.572 3.090 20 0 IGADMO O=C(NC1CCC1)C1C[C@@H]2CN(c3ncnc4c3CC[N@H+](Cc3ccccc3)C4)C[C@H]2C1 ZINC001164978325 722084876 /nfs/dbraw/zinc/08/48/76/722084876.db2.gz YSPBKVIEVFHXQN-NHCUHLMSSA-N 1 1 431.584 3.166 20 0 IGADMO O=C(NC1CCC1)C1C[C@@H]2CN(c3ncnc4c3CC[N@@H+](Cc3ccccc3)C4)C[C@H]2C1 ZINC001164978325 722084877 /nfs/dbraw/zinc/08/48/77/722084877.db2.gz YSPBKVIEVFHXQN-NHCUHLMSSA-N 1 1 431.584 3.166 20 0 IGADMO CS(=O)(=O)N1C[C@H]2CN(c3nc(Cl)ccc3C[NH+]3CCCC3)C[C@H]2c2ccccc21 ZINC001164972375 722090242 /nfs/dbraw/zinc/09/02/42/722090242.db2.gz GTPRYIIVLWMATK-IEBWSBKVSA-N 1 1 447.004 3.330 20 0 IGADMO CCOC(=O)c1cc(N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)ncc1Cl ZINC001164980812 722103036 /nfs/dbraw/zinc/10/30/36/722103036.db2.gz KLDPAGDFZYIKGF-XLIONFOSSA-N 1 1 430.936 3.034 20 0 IGADMO FC(F)(c1nc(Cl)ncc1Cl)N1CC[C@H]2C[N@@H+](Cc3cccnc3)CCO[C@@H]2C1 ZINC001164983881 722107212 /nfs/dbraw/zinc/10/72/12/722107212.db2.gz QVPICWBEIXZBQV-GOEBONIOSA-N 1 1 444.313 3.451 20 0 IGADMO c1ccc(COc2cnnc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)c2)cc1 ZINC001164982670 722125800 /nfs/dbraw/zinc/12/58/00/722125800.db2.gz XREBYSKMEQQDAP-LADGPHEKSA-N 1 1 431.540 3.178 20 0 IGADMO Cc1nc(-c2ccccn2)nc(N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)c1C ZINC001164978050 722148413 /nfs/dbraw/zinc/14/84/13/722148413.db2.gz JKDPXASXFDJEQS-GMAHTHKFSA-N 1 1 430.556 3.278 20 0 IGADMO c1cncc(C[N@H+]2CCO[C@@H]3CN(c4nc(-c5ccncc5)nc5c4CCC5)CC[C@@H]3C2)c1 ZINC001164984578 722149775 /nfs/dbraw/zinc/14/97/75/722149775.db2.gz XEFNXLPIMXQQDI-ZJSXRUAMSA-N 1 1 442.567 3.150 20 0 IGADMO c1cncc(C[N@H+]2CCO[C@H]3CN(c4cc(-c5nc(C6CC6)no5)ccn4)CC[C@H]3C2)c1 ZINC001164973932 722151864 /nfs/dbraw/zinc/15/18/64/722151864.db2.gz NNMXDPSPYZTHAQ-SFTDATJTSA-N 1 1 432.528 3.131 20 0 IGADMO NC(=S)c1cnc(N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)c2sccc21 ZINC001164972233 722158234 /nfs/dbraw/zinc/15/82/34/722158234.db2.gz HLJREFZNFKBFIU-APWZRJJASA-N 1 1 439.610 3.053 20 0 IGADMO Cc1nc(CN2CCO[C@@H]3CCN(c4cc(N5CCCC5)nc(C)[nH+]4)CC[C@@H]32)cs1 ZINC001164987086 722176007 /nfs/dbraw/zinc/17/60/07/722176007.db2.gz MJJNLRKOLJBHOS-VQTJNVASSA-N 1 1 428.606 3.020 20 0 IGADMO Cc1ccc(S(=O)(=O)n2ccc3c2nc(Cl)nc3N2C[C@H](C)[N@H+](C)C[C@@H]2C)cc1 ZINC001164632946 719171436 /nfs/dbraw/zinc/17/14/36/719171436.db2.gz GAIBVQVZWCFKFB-GJZGRUSLSA-N 1 1 433.965 3.159 20 0 IGADMO COC(=O)c1cc(Cl)ncc1C(F)(F)N1CCc2c(C[NH+](C)C)nn(C(C)C)c2C1 ZINC001164648205 719309734 /nfs/dbraw/zinc/30/97/34/719309734.db2.gz GEIIMXFFKQKUSM-UHFFFAOYSA-N 1 1 441.910 3.468 20 0 IGADMO O=c1cc2[nH]c(N3CCC4(CC3)COCC[N@H+]4Cc3ccc(F)cc3)c(Cl)cc-2[nH]1 ZINC001164670568 719510407 /nfs/dbraw/zinc/51/04/07/719510407.db2.gz DPJPMIASGVIZQS-UHFFFAOYSA-N 1 1 430.911 3.240 20 0 IGADMO O=c1cc2[nH]c(N3CCC4(CC3)COCC[N@@H+]4Cc3ccc(F)cc3)c(Cl)cc-2[nH]1 ZINC001164670568 719510414 /nfs/dbraw/zinc/51/04/14/719510414.db2.gz DPJPMIASGVIZQS-UHFFFAOYSA-N 1 1 430.911 3.240 20 0 IGADMO Cc1nc(C[N@H+]2CCCC23CCN(c2cc(N4CCSCC4)ncn2)CC3)cs1 ZINC001164691307 719815093 /nfs/dbraw/zinc/81/50/93/719815093.db2.gz FJMWPQQYNGWADJ-UHFFFAOYSA-N 1 1 430.647 3.430 20 0 IGADMO COC(=O)[C@@]1(C)C[C@@H]([NH+]2CCOCC2)CCN1c1nc(Cl)nc2cccc(Cl)c21 ZINC001164703000 719854260 /nfs/dbraw/zinc/85/42/60/719854260.db2.gz OKYISXKXKABXEF-RNODOKPDSA-N 1 1 439.343 3.169 20 0 IGADMO CCC[N@H+]1CCCC[C@@H]1c1ccc(N2CC[C@H](N3CCOCC3)C[C@]2(C)C(=O)OC)nc1 ZINC001164703849 719877159 /nfs/dbraw/zinc/87/71/59/719877159.db2.gz KYRIBCAIHAIRBQ-SGIRGMQISA-N 1 1 444.620 3.251 20 0 IGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(C(F)(F)c1cnc(Cl)cc1C(=O)OC)C2 ZINC001164810077 720102005 /nfs/dbraw/zinc/10/20/05/720102005.db2.gz JPHKCOHQMKMWAC-YWZLYKJASA-N 1 1 443.922 3.251 20 0 IGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(C(F)(F)c1cc(C(=O)OC)cc(Cl)n1)C2 ZINC001164810457 720127758 /nfs/dbraw/zinc/12/77/58/720127758.db2.gz JWIBJRCKIAUNIR-UZLBHIALSA-N 1 1 443.922 3.251 20 0 IGADMO COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1cc(C(=O)N3CCCC3)ccn1)CC2 ZINC001164714575 720130200 /nfs/dbraw/zinc/13/02/00/720130200.db2.gz XIAUOCPHAFTSSJ-QHCPKHFHSA-N 1 1 449.599 3.220 20 0 IGADMO COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1nc[nH]c3nc(=S)sc1-3)CC2 ZINC001164712233 720137608 /nfs/dbraw/zinc/13/76/08/720137608.db2.gz LJZVWYFVEIDESN-MRXNPFEDSA-N 1 1 442.614 3.278 20 0 IGADMO CC(C)[N@@H+](C)Cc1cc(=O)n2c(n1)CN(C(F)(F)c1nc(Cl)ccc1F)CCC2 ZINC001164812871 720221962 /nfs/dbraw/zinc/22/19/62/720221962.db2.gz JXTIRKGAOSGIST-UHFFFAOYSA-N 1 1 429.874 3.226 20 0 IGADMO Cc1ccc(Cl)nc1C(F)(F)N1CCCn2c(=O)cc(C[N@H+](C)C(C)C)nc2C1 ZINC001164812821 720228328 /nfs/dbraw/zinc/22/83/28/720228328.db2.gz IUTCYFQUSNSWMP-UHFFFAOYSA-N 1 1 425.911 3.396 20 0 IGADMO CCOc1ccc(-c2ccc(N3CCCn4c(=O)cc(C[N@@H+](C)C(C)C)nc4C3)nn2)cc1 ZINC001164813323 720240259 /nfs/dbraw/zinc/24/02/59/720240259.db2.gz MSKUQTZEEITTLU-UHFFFAOYSA-N 1 1 448.571 3.350 20 0 IGADMO O=C(Nc1cccnc1)[C@]12CCO[C@H]1CCN(c1nc(Cl)ccc1C[NH+]1CCCC1)C2 ZINC001164725799 720501320 /nfs/dbraw/zinc/50/13/20/720501320.db2.gz KLJJHWNJTXDVQM-CVDCTZTESA-N 1 1 441.963 3.350 20 0 IGADMO CSc1nc2ncnc(N3CC[C@@H]4[C@H](C[C@H](Cn5cccn5)[N@H+]4C(C)C)C3)c2s1 ZINC001164835466 720572747 /nfs/dbraw/zinc/57/27/47/720572747.db2.gz HJNUQCGFQLUVCX-BZUAXINKSA-N 1 1 429.619 3.383 20 0 IGADMO CCOC(=O)c1c[n-]c2nc[nH+]c(N3CCC4(C[C@@H]([N@@H+](C)Cc5ccccc5)CO4)CC3)c12 ZINC001164841112 720674373 /nfs/dbraw/zinc/67/43/73/720674373.db2.gz PFOFIRMYTOGJLN-LJQANCHMSA-N 1 1 449.555 3.395 20 0 IGADMO CCOC(=O)c1c[nH]c2ncnc(N3CCC4(C[C@@H]([N@H+](C)Cc5ccccc5)CO4)CC3)c12 ZINC001164841112 720674389 /nfs/dbraw/zinc/67/43/89/720674389.db2.gz PFOFIRMYTOGJLN-LJQANCHMSA-N 1 1 449.555 3.395 20 0 IGADMO CCOC(=O)c1c[nH]c2ncnc(N3CCC4(C[C@@H]([N@@H+](C)Cc5ccccc5)CO4)CC3)c12 ZINC001164841112 720674395 /nfs/dbraw/zinc/67/43/95/720674395.db2.gz PFOFIRMYTOGJLN-LJQANCHMSA-N 1 1 449.555 3.395 20 0 IGADMO C[N@@H+](Cc1ccccc1)[C@@H]1COC2(C1)CCN(c1nc(Cl)c(F)c3c1C(=O)NC3)CC2 ZINC001164839906 720697026 /nfs/dbraw/zinc/69/70/26/720697026.db2.gz CTWPIXPUVBMBSQ-INIZCTEOSA-N 1 1 444.938 3.377 20 0 IGADMO CSc1ccc(Oc2cc(N3CC[N@H+]4C[C@H](Oc5cncnc5)C[C@H]4C3)ncn2)cc1 ZINC001164739935 720742944 /nfs/dbraw/zinc/74/29/44/720742944.db2.gz JYSCNELEJSTIRX-FUHWJXTLSA-N 1 1 436.541 3.123 20 0 IGADMO FC(F)(c1cc(-c2ccco2)nnc1Cl)N1CC[N@@H+]2C[C@H](Oc3cncnc3)C[C@H]2C1 ZINC001164741137 720768394 /nfs/dbraw/zinc/76/83/94/720768394.db2.gz MJBOBIXBWAIXPE-UONOGXRCSA-N 1 1 448.861 3.067 20 0 IGADMO FC(F)(c1cc(-c2ccco2)nnc1Cl)N1CC[N@H+]2C[C@H](Oc3cncnc3)C[C@H]2C1 ZINC001164741137 720768402 /nfs/dbraw/zinc/76/84/02/720768402.db2.gz MJBOBIXBWAIXPE-UONOGXRCSA-N 1 1 448.861 3.067 20 0 IGADMO Fc1c(Cl)nccc1C(F)(F)N1CC[C@@H]2[C@@H](C[C@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164752744 720812288 /nfs/dbraw/zinc/81/22/88/720812288.db2.gz ZQHSLASGCGLTPO-ZMSDIMECSA-N 1 1 440.901 3.390 20 0 IGADMO Fc1cc(C(F)(F)N2CC[C@@H]3[C@H](C[C@H](Cn4cncn4)[N@H+]3CC3CC3)C2)cnc1Cl ZINC001164741537 720825815 /nfs/dbraw/zinc/82/58/15/720825815.db2.gz NXGQRVOKWLMURO-QGPMSJSTSA-N 1 1 440.901 3.390 20 0 IGADMO c1ncn(C[C@H]2C[C@@H]3CN(c4cc(OCc5ccccc5)cnn4)CC[C@H]3[N@@H+]2CC2CC2)n1 ZINC001164750999 720834897 /nfs/dbraw/zinc/83/48/97/720834897.db2.gz XOOUABRHCFDCFD-CQOQZXRMSA-N 1 1 445.571 3.027 20 0 IGADMO COc1cc2ccc(N3CC[C@@H]4[C@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)nc2cc1OC ZINC001164751119 720835201 /nfs/dbraw/zinc/83/52/01/720835201.db2.gz YNKDVOKXZQXUPQ-RZUBCFFCSA-N 1 1 448.571 3.223 20 0 IGADMO Fc1cc2ncnc(Cl)c2c(N2CC[C@@H]3[C@@H](C[C@@H](Cn4cncn4)[N@H+]3CC3CC3)C2)c1 ZINC001164740033 720842183 /nfs/dbraw/zinc/84/21/83/720842183.db2.gz BOZOGJFDQOISBE-VDZJLULYSA-N 1 1 441.942 3.393 20 0 IGADMO COc1ccc(-c2cc(N3CC[C@@H]4[C@@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)ncn2)cc1 ZINC001164750330 720850351 /nfs/dbraw/zinc/85/03/51/720850351.db2.gz XGVDMKIUFPIZFA-YZUZCNPQSA-N 1 1 445.571 3.123 20 0 IGADMO COCC[N@H+]1CCO[C@H]2CN(C(F)(F)c3ccc4nc(Cl)cnc4c3)CC[C@@H]2C1 ZINC001164853727 720851779 /nfs/dbraw/zinc/85/17/79/720851779.db2.gz OTALPLACKPLMPD-KDOFPFPSSA-N 1 1 426.895 3.002 20 0 IGADMO Fc1ccc2c(Cl)nnc(N3CC[C@@H]4[C@@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)c2c1 ZINC001164747607 720854080 /nfs/dbraw/zinc/85/40/80/720854080.db2.gz IGENLSRETUPOKP-RIFZZMRRSA-N 1 1 441.942 3.393 20 0 IGADMO COCC[N@H+]1CCO[C@H]2CN(c3cc(F)ccc3Oc3ccc(Cl)nn3)CC[C@H]2C1 ZINC001164854461 720874675 /nfs/dbraw/zinc/87/46/75/720874675.db2.gz FGLRLPCMSJULCS-KXBFYZLASA-N 1 1 436.915 3.235 20 0 IGADMO COCC[N@H+]1CCO[C@@H]2CN(c3nc(C)nc4sc5c(c43)CCCCC5)CC[C@@H]2C1 ZINC001164862314 720877306 /nfs/dbraw/zinc/87/73/06/720877306.db2.gz ROTDFWSXAZBTLV-IEBWSBKVSA-N 1 1 430.618 3.442 20 0 IGADMO Cn1ccc2c1ncnc2N1CC[C@@]2(C1)C[N@@H+](CC1CC1)C[C@@H]2COCc1cccnc1 ZINC001164754844 720877323 /nfs/dbraw/zinc/87/73/23/720877323.db2.gz TXUDFVWJEAHZJK-BWKNWUBXSA-N 1 1 432.572 3.118 20 0 IGADMO c1cncc(COC[C@@H]2C[N@@H+](CC3CC3)C[C@@]23CCN(c2ncnc4cnccc42)C3)c1 ZINC001164750139 720877718 /nfs/dbraw/zinc/87/77/18/720877718.db2.gz JAVCCWCBGHHMGC-SQJMNOBHSA-N 1 1 430.556 3.175 20 0 IGADMO COCC[N@H+]1CCO[C@@H]2CN(c3nc(-c4cccc(OC)c4)nc4ccccc43)CC[C@@H]2C1 ZINC001164859825 720882499 /nfs/dbraw/zinc/88/24/99/720882499.db2.gz MVOMRVJDYUMWJR-HYBUGGRVSA-N 1 1 448.567 3.479 20 0 IGADMO COCC[N@H+]1CCO[C@H]2CN(c3nc(-c4cccc(OC)c4)nc4ccccc43)CC[C@H]2C1 ZINC001164859828 720882682 /nfs/dbraw/zinc/88/26/82/720882682.db2.gz MVOMRVJDYUMWJR-RDPSFJRHSA-N 1 1 448.567 3.479 20 0 IGADMO COCC[N@H+]1CCO[C@H]2CN(c3cnc(Cl)nc3Oc3ccc(C)cc3)CC[C@H]2C1 ZINC001164853765 720888887 /nfs/dbraw/zinc/88/88/87/720888887.db2.gz CRINLIZFSYJSJJ-PXNSSMCTSA-N 1 1 432.952 3.404 20 0 IGADMO c1cncc(COC[C@@H]2C[N@@H+](CC3CC3)C[C@@]23CCN(c2ncc4cccnc4n2)C3)c1 ZINC001164755970 720892706 /nfs/dbraw/zinc/89/27/06/720892706.db2.gz NVADXEXWOBEBHG-WIOPSUGQSA-N 1 1 430.556 3.175 20 0 IGADMO Cc1nc2c(c(N3CC[C@@]4(C3)C[N@@H+](CC3CC3)C[C@H]4COCc3cccnc3)n1)CCC2 ZINC001164758166 720901787 /nfs/dbraw/zinc/90/17/87/720901787.db2.gz XIFHYUVPSDUEEK-NVQXNPDNSA-N 1 1 433.600 3.424 20 0 IGADMO CC(C)N1Cc2c(nc(Cl)nc2N2CCn3c(C[N@@H+](C)C(C)C)cnc3[C@H]2C)C1=O ZINC001164863370 720994119 /nfs/dbraw/zinc/99/41/19/720994119.db2.gz UTGBPBWQMLGWPV-CQSZACIVSA-N 1 1 431.972 3.112 20 0 IGADMO CC(C)CCNS(=O)(=O)c1ccc(N2CCn3c(C[N@@H+](C)C(C)C)cnc3[C@@H]2C)nc1 ZINC001164856309 721007515 /nfs/dbraw/zinc/00/75/15/721007515.db2.gz BFKPRYHFRJODJX-SFHVURJKSA-N 1 1 448.637 3.024 20 0 IGADMO CN1C[C@H](COCC2CC2)[C@H]2CCN(c3ccc(C[N@@H+](C)C4CC4)cn3)CC[C@H]2C1=O ZINC001164860346 721029301 /nfs/dbraw/zinc/02/93/01/721029301.db2.gz LKZSCWVRRMZCFR-YMPZKCBVSA-N 1 1 426.605 3.023 20 0 IGADMO FC(F)(c1ccc2ncc(Cl)nc2c1)N1CCc2[nH+]cc(Cn3cccn3)n2CC1 ZINC001164862021 721031464 /nfs/dbraw/zinc/03/14/64/721031464.db2.gz KDRWRSCEIBUHDM-UHFFFAOYSA-N 1 1 429.862 3.332 20 0 IGADMO FC(F)(c1cnc(Cl)nc1Cl)N1CC[N@H+]2C[C@@H](OCc3cccnc3)C[C@@H]2C1 ZINC001164868446 721048187 /nfs/dbraw/zinc/04/81/87/721048187.db2.gz OMARNPIHUYWKGG-KGLIPLIRSA-N 1 1 430.286 3.203 20 0 IGADMO CCOC(=O)c1cnc(Cl)c(C)c1N1CC[N@H+]2C[C@H](OCc3cccnc3)C[C@H]2C1 ZINC001164862858 721098949 /nfs/dbraw/zinc/09/89/49/721098949.db2.gz BGLUOQUMWXBJKJ-ZWKOTPCHSA-N 1 1 430.936 3.095 20 0 IGADMO c1cn(Cc2ccccc2)c2ncnc(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@@H]4C3)c12 ZINC001164866330 721099270 /nfs/dbraw/zinc/09/92/70/721099270.db2.gz SFLQFUXTWBGADR-DHIUTWEWSA-N 1 1 440.551 3.354 20 0 IGADMO COc1cccc(Oc2cncc(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@H]4C3)n2)c1 ZINC001164865441 721116112 /nfs/dbraw/zinc/11/61/12/721116112.db2.gz LIVCORMLIBVJBK-UGKGYDQZSA-N 1 1 433.512 3.152 20 0 IGADMO FC(F)(Cc1nc(Cl)cc(Cl)n1)N1CC[N@H+]2C[C@@H](OCc3cccnc3)C[C@H]2C1 ZINC001164870223 721127034 /nfs/dbraw/zinc/12/70/34/721127034.db2.gz BWYIIKZKRIECAO-GJZGRUSLSA-N 1 1 444.313 3.289 20 0 IGADMO FC(F)(Cc1nc(Cl)cc(Cl)n1)N1CC[N@H+]2C[C@H](OCc3cccnc3)C[C@@H]2C1 ZINC001164870224 721127069 /nfs/dbraw/zinc/12/70/69/721127069.db2.gz BWYIIKZKRIECAO-HUUCEWRRSA-N 1 1 444.313 3.289 20 0 IGADMO COC(=O)C[C@H](c1ccnc(N2CC[N@H+]3C[C@@H](OCc4cccnc4)C[C@H]3C2)c1)C1CC1 ZINC001164881015 721135369 /nfs/dbraw/zinc/13/53/69/721135369.db2.gz YVIMDUHZMUBJRW-VABKMULXSA-N 1 1 436.556 3.013 20 0 IGADMO Clc1nc2c(Cl)nccc2c(N2CC[N@H+]3C[C@@H](OCc4cccnc4)C[C@H]3C2)n1 ZINC001164871034 721137013 /nfs/dbraw/zinc/13/70/13/721137013.db2.gz DARPSMGLARGFJO-GJZGRUSLSA-N 1 1 431.327 3.206 20 0 IGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4nc(-c5ccccn5)nc5ccccc54)C[C@@H]3C2)cn1 ZINC001164771847 721196980 /nfs/dbraw/zinc/19/69/80/721196980.db2.gz RGZRSQIOSGVLDC-UXHICEINSA-N 1 1 425.540 3.384 20 0 IGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2C[C@@H]3OCC[C@H]3[C@H](C(=O)NCc3cccnc3)C2)nc1 ZINC001164873364 721304865 /nfs/dbraw/zinc/30/48/65/721304865.db2.gz BEQDIDBHBXVLSE-KEZOAJOQSA-N 1 1 449.599 3.181 20 0 IGADMO COC(=O)c1cnc(Cl)cc1N1CCC[C@@]2(C1)COCC[N@H+](Cc1c(C)noc1C)C2 ZINC001164778567 721333247 /nfs/dbraw/zinc/33/32/47/721333247.db2.gz XKVYGIIQZYGFOV-JOCHJYFZSA-N 1 1 448.951 3.245 20 0 IGADMO COC(=O)c1cnc(Cl)cc1N1CCC[C@@]2(C1)COCC[N@@H+](Cc1c(C)noc1C)C2 ZINC001164778567 721333252 /nfs/dbraw/zinc/33/32/52/721333252.db2.gz XKVYGIIQZYGFOV-JOCHJYFZSA-N 1 1 448.951 3.245 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@]2(CCCN(c3ncnc4c(F)cccc43)C2)C1 ZINC001164776288 721347299 /nfs/dbraw/zinc/34/72/99/721347299.db2.gz APMWFTIULUWQAN-HSZRJFAPSA-N 1 1 425.508 3.493 20 0 IGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@@]2(CCCN(c3cnc4ccc(F)cc4n3)C2)C1 ZINC001164776449 721347720 /nfs/dbraw/zinc/34/77/20/721347720.db2.gz BMMVMMBQKBIQFT-QHCPKHFHSA-N 1 1 425.508 3.493 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@@]2(CCCN(c3cnc4ccc(F)cc4n3)C2)C1 ZINC001164776449 721347727 /nfs/dbraw/zinc/34/77/27/721347727.db2.gz BMMVMMBQKBIQFT-QHCPKHFHSA-N 1 1 425.508 3.493 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@]2(CCCN(c3nncc4ccc(F)cc43)C2)C1 ZINC001164779425 721353872 /nfs/dbraw/zinc/35/38/72/721353872.db2.gz TUKUIYFYRDFKSH-HSZRJFAPSA-N 1 1 425.508 3.493 20 0 IGADMO Cc1noc(-c2ccc(N3CCC[C@]4(C3)COCC[N@H+](Cc3c(C)noc3C)C4)nc2)n1 ZINC001164785318 721367672 /nfs/dbraw/zinc/36/76/72/721367672.db2.gz UKRJRSAEBXAAJQ-QHCPKHFHSA-N 1 1 438.532 3.164 20 0 IGADMO Cc1noc(-c2ccc(N3CCC[C@]4(C3)COCC[N@@H+](Cc3c(C)noc3C)C4)nc2)n1 ZINC001164785318 721367677 /nfs/dbraw/zinc/36/76/77/721367677.db2.gz UKRJRSAEBXAAJQ-QHCPKHFHSA-N 1 1 438.532 3.164 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@]2(CCCN(c3nc(C(N)=O)cc4ccccc43)C2)C1 ZINC001164782947 721368770 /nfs/dbraw/zinc/36/87/70/721368770.db2.gz NZHPDFSTHZPSJL-RUZDIDTESA-N 1 1 449.555 3.058 20 0 IGADMO CCOC(=O)c1c2ccccn2c2ncnc(N3C[C@@H]4C[N@@H+](Cc5nccs5)C[C@@H]4C3)c21 ZINC001164779636 721389668 /nfs/dbraw/zinc/38/96/68/721389668.db2.gz BMTZHUMUVKPODX-IYBDPMFKSA-N 1 1 448.552 3.084 20 0 IGADMO CCOC(=O)c1c2ccccn2c2ncnc(N3C[C@@H]4C[N@H+](Cc5nccs5)C[C@@H]4C3)c21 ZINC001164779636 721389670 /nfs/dbraw/zinc/38/96/70/721389670.db2.gz BMTZHUMUVKPODX-IYBDPMFKSA-N 1 1 448.552 3.084 20 0 IGADMO CCOc1cc2ncnc(N3C[C@@H]4C[NH+](Cc5nccs5)C[C@H]4C3)c2cc1OCC ZINC001164781147 721410612 /nfs/dbraw/zinc/41/06/12/721410612.db2.gz CBOLCFDGAVXYHS-HOTGVXAUSA-N 1 1 425.558 3.452 20 0 IGADMO COC(=O)c1ccc2c(c1)nc(Cl)nc2N1C[C@@H]2C[N@@H+](Cc3nccs3)C[C@@H]2C1 ZINC001164781827 721411369 /nfs/dbraw/zinc/41/13/69/721411369.db2.gz FIXDTGBRPHKEIT-OKILXGFUSA-N 1 1 429.933 3.095 20 0 IGADMO COC(=O)c1ccc2c(c1)nc(Cl)nc2N1C[C@@H]2C[N@H+](Cc3nccs3)C[C@@H]2C1 ZINC001164781827 721411372 /nfs/dbraw/zinc/41/13/72/721411372.db2.gz FIXDTGBRPHKEIT-OKILXGFUSA-N 1 1 429.933 3.095 20 0 IGADMO Cc1nc(C(F)(F)N2CC[C@]3(C2)CCC[C@@H](CN2CC[NH+](C)CC2)O3)nc(Cl)c1C ZINC001164883892 721421004 /nfs/dbraw/zinc/42/10/04/721421004.db2.gz CKGCDUDYJCLBDA-PXNSSMCTSA-N 1 1 443.970 3.057 20 0 IGADMO C[NH+]1CCN(C[C@H]2CCC[C@@]3(CCN(c4cncc(Oc5cccc(F)c5)n4)C3)O2)CC1 ZINC001164889598 721424383 /nfs/dbraw/zinc/42/43/83/721424383.db2.gz CFZOIDYCJVTVCU-QPPBQGQZSA-N 1 1 441.551 3.173 20 0 IGADMO Cc1cccc2nc(Cl)nc(N3CC[C@@]4(C3)CCC[C@@H](CN3CC[NH+](C)CC3)O4)c12 ZINC001164892349 721424926 /nfs/dbraw/zinc/42/49/26/721424926.db2.gz IFJVIJKFQZGPCE-FDDCHVKYSA-N 1 1 429.996 3.357 20 0 IGADMO C[NH+]1CCN(C[C@@H]2CCC[C@@]3(CCN(c4cccc(OCc5ccccc5)n4)C3)O2)CC1 ZINC001164896725 721426246 /nfs/dbraw/zinc/42/62/46/721426246.db2.gz RVTCWMCKPRXVDE-OZXSUGGESA-N 1 1 436.600 3.426 20 0 IGADMO O=C(NC1CCCC1)c1cnc(N2C[C@@H]3C[NH+](Cc4nccs4)C[C@H]3C2)c(Cl)c1 ZINC001164782757 721428768 /nfs/dbraw/zinc/42/87/68/721428768.db2.gz HTYHWOYOASUFFH-HOTGVXAUSA-N 1 1 431.993 3.432 20 0 IGADMO O=C(Nc1cccnc1Cl)OCC(F)(F)N1C[C@@H]2C[NH+](Cc3nccs3)C[C@H]2C1 ZINC001164787241 721435418 /nfs/dbraw/zinc/43/54/18/721435418.db2.gz PRYDNZQCSAFAPF-STQMWFEESA-N 1 1 443.907 3.397 20 0 IGADMO CCc1nc(Cl)c(N2CC[C@@]3(C2)CCC[C@@H](CN2CC[NH+](C)CC2)O3)c(Cl)n1 ZINC001164895841 721439677 /nfs/dbraw/zinc/43/96/77/721439677.db2.gz QGWUWAWCVLDCFH-MGPUTAFESA-N 1 1 428.408 3.111 20 0 IGADMO Cn1cnc2c1[C@H](COCc1cccnc1)N(c1cc(OC3CC[NH+](C)CC3)ccn1)CC2 ZINC001164780448 721442215 /nfs/dbraw/zinc/44/22/15/721442215.db2.gz AJYGNBDZDIIRIO-QHCPKHFHSA-N 1 1 448.571 3.004 20 0 IGADMO Cc1cc(-c2cccc(F)c2)nnc1N1CC[C@]2(C1)CCC[C@@H](CN1CC[NH+](C)CC1)O2 ZINC001164886565 721447944 /nfs/dbraw/zinc/44/79/44/721447944.db2.gz HHHVJGYZQMRJSG-DHLKQENFSA-N 1 1 439.579 3.357 20 0 IGADMO CCOc1nc(Cl)cc(N2CCC3(C[C@@H](COCC4CC4)[N@@H+](CCOC)C3)CC2)n1 ZINC001164784381 721455749 /nfs/dbraw/zinc/45/57/49/721455749.db2.gz FBHPCTVHFBTTGV-SFHVURJKSA-N 1 1 439.000 3.263 20 0 IGADMO Cc1nc(CN2CC[C@]3(CCCN(c4ccc(C[N@H+](C)C5CC5)cn4)C3)C2=O)cs1 ZINC001164891315 721461868 /nfs/dbraw/zinc/46/18/68/721461868.db2.gz UHSJYJVHJJDQPI-QHCPKHFHSA-N 1 1 425.602 3.460 20 0 IGADMO CCOC(=O)c1c(C)ccnc1N1CCC2(C[C@@H](COCC3CC3)[N@@H+](CCOC)C2)CC1 ZINC001164787485 721463515 /nfs/dbraw/zinc/46/35/15/721463515.db2.gz RBHKJITZDZDRON-NRFANRHFSA-N 1 1 445.604 3.301 20 0 IGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1cc(-c3ccncc3)ncn1)CC2 ZINC001164791675 721467897 /nfs/dbraw/zinc/46/78/97/721467897.db2.gz XNGBZDIYJKKTOP-JOCHJYFZSA-N 1 1 437.588 3.273 20 0 IGADMO CCC[N@H+]1CCCC[C@@H]1c1ccc(N2C[C@@H]3COC[C@@]3(CC(=O)NCC3CC3)C2)nc1 ZINC001164893905 721484727 /nfs/dbraw/zinc/48/47/27/721484727.db2.gz FSNOIGKSPCOGNF-TZBSWOFLSA-N 1 1 426.605 3.388 20 0 IGADMO COC(=O)c1cc2cnc(N3CCC4(CC([N@@H+](C)Cc5ccncc5)C4)CC3)nc2n1C ZINC001164796716 721499112 /nfs/dbraw/zinc/49/91/12/721499112.db2.gz WGFPHAXNGGPBES-UHFFFAOYSA-N 1 1 434.544 3.031 20 0 IGADMO CC(C)C(=O)N[C@H]1COCCC12CCN(c1nc(Cl)ccc1C[NH+]1CCCC1)CC2 ZINC001164898452 721501131 /nfs/dbraw/zinc/50/11/31/721501131.db2.gz SAIYRHJCUCKEIQ-IBGZPJMESA-N 1 1 435.012 3.479 20 0 IGADMO CCOC(=O)c1c(Cl)cc(C)nc1N1C[C@H]([N@H+](C)Cc2cccnc2)[C@@H]2OCCC[C@@H]21 ZINC001164806079 721529287 /nfs/dbraw/zinc/52/92/87/721529287.db2.gz NROGUKUPWFDMBW-IRFCIJBXSA-N 1 1 444.963 3.483 20 0 IGADMO CCOC(=O)c1c(Cl)cc(C)nc1N1C[C@H]([N@@H+](C)Cc2cccnc2)[C@@H]2OCCC[C@@H]21 ZINC001164806079 721529291 /nfs/dbraw/zinc/52/92/91/721529291.db2.gz NROGUKUPWFDMBW-IRFCIJBXSA-N 1 1 444.963 3.483 20 0 IGADMO CCOC(=O)c1cc(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@H]3OCCC[C@@H]32)ncc1Cl ZINC001164805507 721530869 /nfs/dbraw/zinc/53/08/69/721530869.db2.gz LYMMUGOBXKNGPX-ZJOUEHCJSA-N 1 1 430.936 3.175 20 0 IGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2nccc(OCc3ccccc3)n2)[C@H]2CCCO[C@H]12 ZINC001164803130 721553048 /nfs/dbraw/zinc/55/30/48/721553048.db2.gz IFHQUEMPHCJXQW-ZDXQCDESSA-N 1 1 431.540 3.319 20 0 IGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2nccc(OCc3ccccc3)n2)[C@H]2CCCO[C@H]12 ZINC001164803130 721553049 /nfs/dbraw/zinc/55/30/49/721553049.db2.gz IFHQUEMPHCJXQW-ZDXQCDESSA-N 1 1 431.540 3.319 20 0 IGADMO CC1CCN(C(=O)c2ccc(N3CC[N@H+]4C[C@H](Oc5cccc(F)c5)C[C@H]4C3)nc2)CC1 ZINC001164908580 721553707 /nfs/dbraw/zinc/55/37/07/721553707.db2.gz QMOUICJBLRZCLN-JTHBVZDNSA-N 1 1 438.547 3.435 20 0 IGADMO COc1cc2nc(C)nc(N3C[C@H]([N@@H+](C)Cc4cccnc4)[C@H]4OCCC[C@@H]43)c2cc1OC ZINC001164810528 721556008 /nfs/dbraw/zinc/55/60/08/721556008.db2.gz YQQJXZFHXJTLTI-HFMPRLQTSA-N 1 1 449.555 3.219 20 0 IGADMO CCOC(=O)c1cnc(Cl)c(C)c1N1C[C@H]([N@@H+](C)Cc2cccnc2)[C@@H]2OCCC[C@@H]21 ZINC001164798120 721560274 /nfs/dbraw/zinc/56/02/74/721560274.db2.gz AHNRVQULRPIVRB-IRFCIJBXSA-N 1 1 444.963 3.483 20 0 IGADMO Fc1cccc(O[C@@H]2C[C@@H]3CN(c4ncnc5c4ncn5-c4ccccc4)CC[N@H+]3C2)c1 ZINC001164905893 721562989 /nfs/dbraw/zinc/56/29/89/721562989.db2.gz HUGQULFEPAYMFU-TZIWHRDSSA-N 1 1 430.487 3.297 20 0 IGADMO COC(=O)c1nc(Cl)c(N2CC[N@@H+]3C[C@@H](Oc4cccc(F)c4)C[C@H]3C2)c(Cl)n1 ZINC001164906105 721566279 /nfs/dbraw/zinc/56/62/79/721566279.db2.gz ITWUUAUFPWXDOA-JSGCOSHPSA-N 1 1 441.290 3.051 20 0 IGADMO COC(=O)c1nc(Cl)c(N2CC[N@H+]3C[C@@H](Oc4cccc(F)c4)C[C@H]3C2)c(Cl)n1 ZINC001164906105 721566285 /nfs/dbraw/zinc/56/62/85/721566285.db2.gz ITWUUAUFPWXDOA-JSGCOSHPSA-N 1 1 441.290 3.051 20 0 IGADMO CCOC(=O)c1cc2ccc(N3C[C@H]([N@@H+](C)Cc4cccnc4)[C@H]4OCCC[C@H]43)[nH]c-2n1 ZINC001164798132 721567135 /nfs/dbraw/zinc/56/71/35/721567135.db2.gz AIMXKWAUHHFEFM-URVUXULASA-N 1 1 435.528 3.003 20 0 IGADMO CCOC(=O)c1cc2ccc(N3C[C@H]([N@H+](C)Cc4cccnc4)[C@H]4OCCC[C@H]43)nc2[nH]1 ZINC001164798132 721567144 /nfs/dbraw/zinc/56/71/44/721567144.db2.gz AIMXKWAUHHFEFM-URVUXULASA-N 1 1 435.528 3.003 20 0 IGADMO CCOC(=O)c1cc2ccc(N3C[C@H]([N@@H+](C)Cc4cccnc4)[C@H]4OCCC[C@H]43)nc2[nH]1 ZINC001164798132 721567147 /nfs/dbraw/zinc/56/71/47/721567147.db2.gz AIMXKWAUHHFEFM-URVUXULASA-N 1 1 435.528 3.003 20 0 IGADMO CSc1nc2ncnc(N3C[C@H]([N@H+](C)Cc4cccnc4)[C@H]4OCCC[C@@H]43)c2s1 ZINC001164807278 721568175 /nfs/dbraw/zinc/56/81/75/721568175.db2.gz SGXJGCXLQSXHKR-JYJNAYRXSA-N 1 1 428.587 3.071 20 0 IGADMO CSc1nc2ncnc(N3C[C@H]([N@@H+](C)Cc4cccnc4)[C@H]4OCCC[C@@H]43)c2s1 ZINC001164807278 721568178 /nfs/dbraw/zinc/56/81/78/721568178.db2.gz SGXJGCXLQSXHKR-JYJNAYRXSA-N 1 1 428.587 3.071 20 0 IGADMO CC(C)n1cnc2c1nc(Cl)nc2N1C[C@H]([N@H+](C)Cc2cccnc2)[C@H]2OCCC[C@H]21 ZINC001164805349 721569020 /nfs/dbraw/zinc/56/90/20/721569020.db2.gz MSTHEPQOEIVTAY-AOIWGVFYSA-N 1 1 441.967 3.324 20 0 IGADMO CC(C)n1cnc2c1nc(Cl)nc2N1C[C@H]([N@@H+](C)Cc2cccnc2)[C@H]2OCCC[C@H]21 ZINC001164805349 721569022 /nfs/dbraw/zinc/56/90/22/721569022.db2.gz MSTHEPQOEIVTAY-AOIWGVFYSA-N 1 1 441.967 3.324 20 0 IGADMO CN(C)c1ccc(-c2ccnc(N3C[C@H]([N@H+](C)Cc4cccnc4)[C@@H]4OCCC[C@@H]43)n2)cc1 ZINC001164806649 721571063 /nfs/dbraw/zinc/57/10/63/721571063.db2.gz QKGMWQHVERIKON-CCDWMCETSA-N 1 1 444.583 3.473 20 0 IGADMO CN(C)c1ccc(-c2ccnc(N3C[C@H]([N@@H+](C)Cc4cccnc4)[C@@H]4OCCC[C@@H]43)n2)cc1 ZINC001164806649 721571065 /nfs/dbraw/zinc/57/10/65/721571065.db2.gz QKGMWQHVERIKON-CCDWMCETSA-N 1 1 444.583 3.473 20 0 IGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(C(F)(F)c2cc(Cl)nc(=S)[nH]2)[C@@H]2CCCO[C@@H]21 ZINC001164803947 721571257 /nfs/dbraw/zinc/57/12/57/721571257.db2.gz JXNJGLHNZAZVFD-CPUCHLNUSA-N 1 1 441.935 3.227 20 0 IGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(C(F)(F)c2cc(Cl)nc(=S)[nH]2)[C@@H]2CCCO[C@@H]21 ZINC001164803947 721571259 /nfs/dbraw/zinc/57/12/59/721571259.db2.gz JXNJGLHNZAZVFD-CPUCHLNUSA-N 1 1 441.935 3.227 20 0 IGADMO CCc1cc2c(nc(Cl)nc2N2C[C@H]([N@H+](C)Cc3cccnc3)[C@H]3OCCC[C@@H]32)[nH]1 ZINC001164806050 721572685 /nfs/dbraw/zinc/57/26/85/721572685.db2.gz PFJQCNXTRFULHT-FHWLQOOXSA-N 1 1 426.952 3.437 20 0 IGADMO CCc1cc2c(nc(Cl)nc2N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@H]3OCCC[C@@H]32)[nH]1 ZINC001164806050 721572687 /nfs/dbraw/zinc/57/26/87/721572687.db2.gz PFJQCNXTRFULHT-FHWLQOOXSA-N 1 1 426.952 3.437 20 0 IGADMO COc1cccc(-c2ccc(N3C[C@H]([N@H+](C)Cc4cccnc4)[C@H]4OCCC[C@@H]43)nn2)c1 ZINC001164808329 721578260 /nfs/dbraw/zinc/57/82/60/721578260.db2.gz QQEJSAOCLGRSEB-LSQMVHIFSA-N 1 1 431.540 3.415 20 0 IGADMO COc1cccc(-c2ccc(N3C[C@H]([N@@H+](C)Cc4cccnc4)[C@H]4OCCC[C@@H]43)nn2)c1 ZINC001164808329 721578264 /nfs/dbraw/zinc/57/82/64/721578264.db2.gz QQEJSAOCLGRSEB-LSQMVHIFSA-N 1 1 431.540 3.415 20 0 IGADMO COc1ccccc1-c1ccc(N2C[C@H]([N@H+](C)Cc3cccnc3)[C@H]3OCCC[C@@H]32)nn1 ZINC001164808937 721578277 /nfs/dbraw/zinc/57/82/77/721578277.db2.gz RVKCMTDUHRVIII-HWBMXIPRSA-N 1 1 431.540 3.415 20 0 IGADMO COc1ccccc1-c1ccc(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@H]3OCCC[C@@H]32)nn1 ZINC001164808937 721578283 /nfs/dbraw/zinc/57/82/83/721578283.db2.gz RVKCMTDUHRVIII-HWBMXIPRSA-N 1 1 431.540 3.415 20 0 IGADMO NC(=O)c1cc(F)c(Cl)nc1N1CCC(F)(F)[C@@]2(CC[N@@H+](Cc3ccccn3)C2)C1 ZINC001164907061 721694623 /nfs/dbraw/zinc/69/46/23/721694623.db2.gz QTNIQYPLNLBKPW-LJQANCHMSA-N 1 1 439.869 3.106 20 0 IGADMO CCOC(=O)c1cnc(C)nc1N1CCC(F)(F)[C@@]2(CC[N@@H+](Cc3ccccn3)C2)C1 ZINC001164905572 721696997 /nfs/dbraw/zinc/69/69/97/721696997.db2.gz KAUUXKKIJZQGSF-OAQYLSRUSA-N 1 1 431.487 3.094 20 0 IGADMO Cn1cnc2c1nc(Cl)nc2N1CCC(F)(F)[C@]2(CC[N@@H+](Cc3ccccn3)C2)C1 ZINC001164905972 721698576 /nfs/dbraw/zinc/69/85/76/721698576.db2.gz KLTNWXYSCZJQCG-IBGZPJMESA-N 1 1 433.894 3.149 20 0 IGADMO CCOC(=O)c1cnc(CC)nc1N1CCC(F)(F)[C@]2(CC[N@@H+](Cc3ccccn3)C2)C1 ZINC001164913157 721733542 /nfs/dbraw/zinc/73/35/42/721733542.db2.gz UMYDSGIORSJWTH-QFIPXVFZSA-N 1 1 445.514 3.348 20 0 IGADMO CCNC(=O)c1cc(Cl)nc(N2CCc3c(C[N@H+](C)Cc4ccco4)cncc3C2)n1 ZINC001164911659 721766282 /nfs/dbraw/zinc/76/62/82/721766282.db2.gz QSTUURBCGPQGKY-UHFFFAOYSA-N 1 1 440.935 3.062 20 0 IGADMO CCNC(=O)c1cc(Cl)nc(N2CCc3c(C[N@@H+](C)Cc4ccco4)cncc3C2)n1 ZINC001164911659 721766287 /nfs/dbraw/zinc/76/62/87/721766287.db2.gz QSTUURBCGPQGKY-UHFFFAOYSA-N 1 1 440.935 3.062 20 0 IGADMO COC(=O)CSc1cccc(N2C[C@@H]3CCC[C@@H]([N@@H+](C)Cc4ccccn4)[C@@H]3C2)n1 ZINC001165022583 721820901 /nfs/dbraw/zinc/82/09/01/721820901.db2.gz FZESWOOTQVUSKG-DFQSSKMNSA-N 1 1 426.586 3.479 20 0 IGADMO CN1CCOc2c(Cl)nnc(N3C[C@@H]4CCC[C@H]([N@@H+](C)Cc5ccccn5)[C@@H]4C3)c21 ZINC001165030168 721821073 /nfs/dbraw/zinc/82/10/73/721821073.db2.gz YDJZPNLCIUBPEF-JQHSSLGASA-N 1 1 428.968 3.091 20 0 IGADMO CCOC(=O)[C@@H]1CCc2nnc(N3C[C@@H]4CCC[C@H]([N@@H+](C)Cc5ccccn5)[C@@H]4C3)cc2C1 ZINC001165026360 721831913 /nfs/dbraw/zinc/83/19/13/721831913.db2.gz PCRYBFLJMVTCFP-PDXXHEQOSA-N 1 1 449.599 3.277 20 0 IGADMO CN(C)CC[N@@H+]1CC[C@H]2[C@H]1CCN2c1cc(C(=O)Nc2ccc(Cl)nc2)ccc1F ZINC001164923095 721863552 /nfs/dbraw/zinc/86/35/52/721863552.db2.gz IBMQJKFCXNSYFF-MOPGFXCFSA-N 1 1 431.943 3.341 20 0 IGADMO CN(C)CC[N@H+]1CC[C@H]2[C@H]1CCN2c1cc(C(=O)Nc2ccc(Cl)nc2)ccc1F ZINC001164923095 721863555 /nfs/dbraw/zinc/86/35/55/721863555.db2.gz IBMQJKFCXNSYFF-MOPGFXCFSA-N 1 1 431.943 3.341 20 0 IGADMO COC(=O)c1nc(Cl)cnc1N1CCC2(CC1)C[N@@H+](Cc1ccc(C)cc1)CCO2 ZINC001164940932 721926511 /nfs/dbraw/zinc/92/65/11/721926511.db2.gz WUOOAHLNEWNXPU-UHFFFAOYSA-N 1 1 430.936 3.096 20 0 IGADMO CCOc1ccc(C(=O)OC)c(N2CCC3(CC2)C[N@@H+](Cc2ccc(C)cc2)CCO3)n1 ZINC001164938716 721927234 /nfs/dbraw/zinc/92/72/34/721927234.db2.gz FLSFHKMROMFCCT-UHFFFAOYSA-N 1 1 439.556 3.447 20 0 IGADMO C[C@@H]1CCc2c(sc3nc(C[NH+]4CCCCC4)nc(N4CCN(C(N)=O)CC4)c32)C1 ZINC001165042277 721941309 /nfs/dbraw/zinc/94/13/09/721941309.db2.gz MBXOYTQOBODPMP-OAHLLOKOSA-N 1 1 428.606 3.003 20 0 IGADMO CC(=O)N1CC[C@]2(c3ccccc3)CCN(c3cc(OC4CC[NH+](C)CC4)ccn3)C[C@H]12 ZINC001164947130 721968100 /nfs/dbraw/zinc/96/81/00/721968100.db2.gz PQFUPJKKANZAGI-AHWVRZQESA-N 1 1 434.584 3.324 20 0 IGADMO CSc1nc2ccccc2c(N2CCC3(CC2)C(=O)NCC[N@H+]3Cc2ccccc2)n1 ZINC001164948395 721975235 /nfs/dbraw/zinc/97/52/35/721975235.db2.gz YRYDAXAMDOVBIA-UHFFFAOYSA-N 1 1 433.581 3.323 20 0 IGADMO CSc1nc2ccccc2c(N2CCC3(CC2)C(=O)NCC[N@@H+]3Cc2ccccc2)n1 ZINC001164948395 721975240 /nfs/dbraw/zinc/97/52/40/721975240.db2.gz YRYDAXAMDOVBIA-UHFFFAOYSA-N 1 1 433.581 3.323 20 0 IGADMO C[NH+]1CCN(c2nccc(N3CCC(Oc4ccc(OC(F)(F)F)cc4)CC3)n2)CC1 ZINC001165047964 721979776 /nfs/dbraw/zinc/97/97/76/721979776.db2.gz BYSSNIVPKNUMDR-UHFFFAOYSA-N 1 1 437.466 3.175 20 0 IGADMO COc1nc(N2CCC3(CC[N@@H+](Cc4cccnc4)C3)CC2)nc(N2CCCCCC2)n1 ZINC001164955442 722021879 /nfs/dbraw/zinc/02/18/79/722021879.db2.gz GYDYFDIRXPTKAQ-UHFFFAOYSA-N 1 1 437.592 3.148 20 0 IGADMO COC(=O)c1cnc(Cl)cc1N1CCC2(CC1)COCC[N@@H+](Cc1ccncc1)C2 ZINC001164961938 722052631 /nfs/dbraw/zinc/05/26/31/722052631.db2.gz ZIAJNJPNVVGPKN-UHFFFAOYSA-N 1 1 430.936 3.036 20 0 IGADMO COc1ccc2nc(N3CCC4(CC3)COCC[N@@H+](Cc3ccncc3)C4)c(C)nc2c1 ZINC001164963320 722060215 /nfs/dbraw/zinc/06/02/15/722060215.db2.gz WQVLPVWGTOIWDF-UHFFFAOYSA-N 1 1 433.556 3.461 20 0 IGADMO CC[NH+](CC)Cc1nc2sc(C)c(C)c2c(N2CCO[C@]3(CCCN(C(C)=O)C3)C2)n1 ZINC001164969033 722083764 /nfs/dbraw/zinc/08/37/64/722083764.db2.gz JKWUCLWTEHOSQD-QHCPKHFHSA-N 1 1 445.633 3.368 20 0 IGADMO CCOC(=O)c1cnc(Cl)cc1N1CC[C@@H]2C[N@@H+](Cc3cccnc3)CCO[C@@H]2C1 ZINC001164974659 722099899 /nfs/dbraw/zinc/09/98/99/722099899.db2.gz BFJGDAKKSSMEGS-YLJYHZDGSA-N 1 1 430.936 3.034 20 0 IGADMO CCOC(=O)c1cc(N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)ncc1Cl ZINC001164980814 722102830 /nfs/dbraw/zinc/10/28/30/722102830.db2.gz KLDPAGDFZYIKGF-YLJYHZDGSA-N 1 1 430.936 3.034 20 0 IGADMO O=C(NC1CCCCC1)c1cccnc1N1CC[C@H]2C[N@@H+](Cc3cccnc3)CCO[C@@H]2C1 ZINC001164986103 722102996 /nfs/dbraw/zinc/10/29/96/722102996.db2.gz YANBDNBJAFLNGK-XUZZJYLKSA-N 1 1 449.599 3.266 20 0 IGADMO c1ccc(COc2cncc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)n2)cc1 ZINC001164983921 722105932 /nfs/dbraw/zinc/10/59/32/722105932.db2.gz RCFRUVJMDXURQO-GOTSBHOMSA-N 1 1 431.540 3.178 20 0 IGADMO Clc1nc(-c2ccccc2)nc(N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)n1 ZINC001164971401 722109893 /nfs/dbraw/zinc/10/98/93/722109893.db2.gz BXXCITBALYPLQX-WOJBJXKFSA-N 1 1 436.947 3.314 20 0 IGADMO COc1ccc(C(F)(F)N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)c(Cl)n1 ZINC001164973892 722115139 /nfs/dbraw/zinc/11/51/39/722115139.db2.gz HVEKDBQXWGFKSO-WMZOPIPTSA-N 1 1 438.906 3.411 20 0 IGADMO COc1cc2c(cc1Cl)ncnc2N1CC[C@@H]2C[N@@H+](Cc3cccnc3)CCO[C@H]2C1 ZINC001164982001 722119887 /nfs/dbraw/zinc/11/98/87/722119887.db2.gz VPYILDWYERGWRF-VGSWGCGISA-N 1 1 439.947 3.414 20 0 IGADMO CCc1cc2c(nc(Cl)nc2N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)[nH]1 ZINC001164979646 722136225 /nfs/dbraw/zinc/13/62/25/722136225.db2.gz LQDMBZWZIOPKIR-LPHOPBHVSA-N 1 1 426.952 3.296 20 0 IGADMO Clc1nc2c(Cl)nccc2c(N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)n1 ZINC001164979680 722137789 /nfs/dbraw/zinc/13/77/89/722137789.db2.gz LSYCPITZRFFEAF-DOTOQJQBSA-N 1 1 445.354 3.454 20 0 IGADMO FC(F)(c1c2c(nnc1Cl)CCC2)N1CC[C@@H]2C[N@@H+](Cc3cccnc3)CCO[C@H]2C1 ZINC001164982708 722143245 /nfs/dbraw/zinc/14/32/45/722143245.db2.gz SETMZUXMSALMOM-APWZRJJASA-N 1 1 449.933 3.286 20 0 IGADMO Fc1cnc(N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)nc1-c1ccsc1 ZINC001164977200 722154958 /nfs/dbraw/zinc/15/49/58/722154958.db2.gz YGACMOUUOZXGBT-FXAWDEMLSA-N 1 1 425.533 3.467 20 0 IGADMO C[NH+]1CCN(c2ncnc3c2CCN(C(F)(F)c2cc(Cl)cnc2Cl)CC3)CC1 ZINC001164996436 722230035 /nfs/dbraw/zinc/23/00/35/722230035.db2.gz HFQAMAYBQVNANB-UHFFFAOYSA-N 1 1 443.329 3.080 20 0 IGADMO C[NH+]1CCN(c2ncnc3c2CCN(c2c(Cl)cc(Cl)nc2Cl)CC3)CC1 ZINC001164997684 722231017 /nfs/dbraw/zinc/23/10/17/722231017.db2.gz SLSAYEWYSQANHX-UHFFFAOYSA-N 1 1 427.767 3.189 20 0 IGADMO C[NH+]1CCN(c2ncnc3c2CCN(C(F)(F)c2ccc(Cl)c(Cl)n2)CC3)CC1 ZINC001164996269 722233355 /nfs/dbraw/zinc/23/33/55/722233355.db2.gz APFLXRLUZKXJDT-UHFFFAOYSA-N 1 1 443.329 3.080 20 0 IGADMO CCN(CC)S(=O)(=O)c1ccc(N2CCC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)nc1 ZINC001164626841 719097765 /nfs/dbraw/zinc/09/77/65/719097765.db2.gz JEKMLIAVYZUVHR-IRLDBZIGSA-N 1 1 428.602 3.213 20 0 IGADMO CC1(C)NC(=O)N(Cc2ccc(N3CCC[C@H]4C[N@@H+](Cc5ccccc5)C[C@@H]43)nc2)C1=O ZINC001164630416 719101009 /nfs/dbraw/zinc/10/10/09/719101009.db2.gz WEWLGCQUXFVYED-SFTDATJTSA-N 1 1 433.556 3.013 20 0 IGADMO O=S(=O)(c1cccnc1N1CCC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21)N1CCCCC1 ZINC001164628121 719103273 /nfs/dbraw/zinc/10/32/73/719103273.db2.gz MCFWMJVSEIZAET-YADHBBJMSA-N 1 1 440.613 3.357 20 0 IGADMO Cc1noc([C@@H]2C[C@@H]3CCN(c4ncnc5c4CC[N@H+](Cc4ccccc4)C5)C[C@H]3O2)n1 ZINC001164647136 719298830 /nfs/dbraw/zinc/29/88/30/719298830.db2.gz CLLPDZCRQJULJO-YUXAGFNASA-N 1 1 432.528 3.083 20 0 IGADMO Cc1noc([C@@H]2C[C@@H]3CCN(c4ncnc5c4CC[N@@H+](Cc4ccccc4)C5)C[C@H]3O2)n1 ZINC001164647136 719298834 /nfs/dbraw/zinc/29/88/34/719298834.db2.gz CLLPDZCRQJULJO-YUXAGFNASA-N 1 1 432.528 3.083 20 0 IGADMO COC(=O)c1ccc(C(F)(F)N2CCc3c(C[NH+](C)C)nn(C(C)C)c3C2)c(Cl)n1 ZINC001164648864 719310355 /nfs/dbraw/zinc/31/03/55/719310355.db2.gz MJJLONHBHFPFCB-UHFFFAOYSA-N 1 1 441.910 3.468 20 0 IGADMO CCC[N@H+]1CCCC[C@@H]1c1ccc(N2CCc3onc(COCC(=O)N(C)C)c3C2)nc1 ZINC001164662182 719341768 /nfs/dbraw/zinc/34/17/68/719341768.db2.gz OITINIFJVVQTET-OAQYLSRUSA-N 1 1 441.576 3.174 20 0 IGADMO CNC(=O)C[N@H+]1CCCC12CCN(c1cnc(Cl)nc1Oc1ccccc1C)CC2 ZINC001164689605 719753412 /nfs/dbraw/zinc/75/34/12/719753412.db2.gz JAHAAEFELWQTTC-UHFFFAOYSA-N 1 1 429.952 3.412 20 0 IGADMO CNC(=O)C[N@H+]1CCCC12CCN(c1cnc(Cl)nc1Oc1cccc(F)c1)CC2 ZINC001164689366 719756016 /nfs/dbraw/zinc/75/60/16/719756016.db2.gz CVDNWVLZKVIPEG-UHFFFAOYSA-N 1 1 433.915 3.242 20 0 IGADMO O=C1C[C@@H]2[C@H](CCN2c2ccc3c(n2)CC[N@H+](Cc2ccccc2)C3)N1Cc1cccnc1 ZINC001164691060 719765525 /nfs/dbraw/zinc/76/55/25/719765525.db2.gz KQOGXBLAKPNRRY-LOSJGSFVSA-N 1 1 439.563 3.415 20 0 IGADMO COC(=O)c1nc2cnccc2c(N2CCC3(CCC[N@H+]3Cc3csc(C)n3)CC2)n1 ZINC001164694381 719810498 /nfs/dbraw/zinc/81/04/98/719810498.db2.gz WPHHZRYFCCBPFR-UHFFFAOYSA-N 1 1 438.557 3.211 20 0 IGADMO COC(=O)[C@@]1(C)C[C@H]([NH+]2CCOCC2)CCN1c1nc(Cl)cc2cc(OC)ccc21 ZINC001164700117 719861550 /nfs/dbraw/zinc/86/15/50/719861550.db2.gz GMOIHOABHPSTGG-OPAMFIHVSA-N 1 1 433.936 3.130 20 0 IGADMO COC(=O)[C@]1(C)C[C@@H]([NH+]2CCOCC2)CCN1c1c(Cl)ccc2c(Cl)ncnc21 ZINC001164700818 719879563 /nfs/dbraw/zinc/87/95/63/719879563.db2.gz MFEUXGUWWVQQSX-RBZFPXEDSA-N 1 1 439.343 3.169 20 0 IGADMO CCOC(=O)c1cc(C)cnc1N1CCC2(C[C@H](COC)[N@@H+](Cc3ccccn3)C2)CC1 ZINC001164718650 720118528 /nfs/dbraw/zinc/11/85/28/720118528.db2.gz UIQFNQGKTAHPJL-OAQYLSRUSA-N 1 1 438.572 3.469 20 0 IGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1cc(C(=O)NC(C)(C)C)cc(Cl)n1)C2 ZINC001164807300 720127580 /nfs/dbraw/zinc/12/75/80/720127580.db2.gz BUKVIKPJHBRAQX-JPYJTQIMSA-N 1 1 435.012 3.448 20 0 IGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1nc(Cl)ccc1C(=O)NC(C)(C)C)C2 ZINC001164814438 720128028 /nfs/dbraw/zinc/12/80/28/720128028.db2.gz SOALMGHIBGVTDO-HXOBKFHXSA-N 1 1 435.012 3.448 20 0 IGADMO CCOC(=O)c1cc2ncnc(N3CC[C@]4(C3)C[N@@H+](CC3CC3)C[C@@H]4COC)c2s1 ZINC001164810485 720144693 /nfs/dbraw/zinc/14/46/93/720144693.db2.gz JXEMKJYXBULKEY-OPAMFIHVSA-N 1 1 430.574 3.053 20 0 IGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(C(F)(F)c1cc(C(=O)OC)cnc1Cl)C2 ZINC001164819744 720155530 /nfs/dbraw/zinc/15/55/30/720155530.db2.gz XYKFVCPDNMXPHO-UZLBHIALSA-N 1 1 443.922 3.251 20 0 IGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(C(F)(F)c1nc3ccc(Cl)nc3[nH]1)C2 ZINC001164820156 720178081 /nfs/dbraw/zinc/17/80/81/720178081.db2.gz ZSDOTNPMOGHTNK-KUHUBIRLSA-N 1 1 425.911 3.341 20 0 IGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN([C@](F)(COc1cncc(Cl)n1)C(F)F)C2 ZINC001164816351 720179973 /nfs/dbraw/zinc/17/99/73/720179973.db2.gz KZSCQAZOUMLCGS-RYGJVYDSSA-N 1 1 448.917 3.120 20 0 IGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1ccc(-c3cc(OC)ccc3OC)nn1)C2 ZINC001164814399 720182673 /nfs/dbraw/zinc/18/26/73/720182673.db2.gz GCJNQBFANUMWRC-CLOONOSVSA-N 1 1 438.572 3.346 20 0 IGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1cc(C)nc(NC(=O)c3ccccc3)n1)C2 ZINC001164818391 720189146 /nfs/dbraw/zinc/18/91/46/720189146.db2.gz SLYXDXDXLZWPRP-BWKNWUBXSA-N 1 1 435.572 3.222 20 0 IGADMO Cc1cc(Cl)nc(C(F)(F)N2CCCn3c(=O)cc(C[N@H+](C)C(C)C)nc3C2)c1 ZINC001164813505 720226350 /nfs/dbraw/zinc/22/63/50/720226350.db2.gz NGDQDRPHFIYDHT-UHFFFAOYSA-N 1 1 425.911 3.396 20 0 IGADMO CC(C)CNC(=O)c1ccc2c(c1)ncnc2N1CC[C@@H]2[C@H]1CC[N@H+]2Cc1cccnc1 ZINC001164730935 720415192 /nfs/dbraw/zinc/41/51/92/720415192.db2.gz JWFICHANGJYQHD-DHIUTWEWSA-N 1 1 430.556 3.264 20 0 IGADMO FC(F)[C@](F)(COc1cncc(Cl)n1)N1CC[C@H]2[C@H]1CC[N@@H+]2Cc1cccnc1 ZINC001164730165 720452463 /nfs/dbraw/zinc/45/24/63/720452463.db2.gz IDDHRZBATAYNOR-KHYOSLBOSA-N 1 1 427.858 3.184 20 0 IGADMO FC(F)[C@](F)(COc1cncc(Cl)n1)N1CC[C@H]2[C@H]1CC[N@H+]2Cc1cccnc1 ZINC001164730165 720452470 /nfs/dbraw/zinc/45/24/70/720452470.db2.gz IDDHRZBATAYNOR-KHYOSLBOSA-N 1 1 427.858 3.184 20 0 IGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@@H]2CN(c3ncccc3C(=O)N3CCCCC3)CC[C@@H]21 ZINC001164832945 720512058 /nfs/dbraw/zinc/51/20/58/720512058.db2.gz CBQNSXXGFDIGDE-GIWBLDEGSA-N 1 1 436.604 3.282 20 0 IGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@H]2CN(c3nc(Cl)nc4c3CSCC4)CC[C@@H]21 ZINC001164841750 720516576 /nfs/dbraw/zinc/51/65/76/720516576.db2.gz ZZFCNGXFBHHNAD-BXWFABGCSA-N 1 1 433.025 3.494 20 0 IGADMO CCOC(=O)c1cc2ccnc(N3CC[C@@H]4[C@@H](C[C@@H](Cn5cccn5)[N@H+]4C(C)C)C3)c2[nH]1 ZINC001164836785 720531753 /nfs/dbraw/zinc/53/17/53/720531753.db2.gz KXDUGLAXWZFBCM-IRFCIJBXSA-N 1 1 436.560 3.314 20 0 IGADMO CCOC(=O)c1cnc(N2CC[C@@H]3[C@H](C[C@@H](Cn4cccn4)[N@H+]3C(C)C)C2)cc1OCC ZINC001164838437 720540820 /nfs/dbraw/zinc/54/08/20/720540820.db2.gz NUWXPCZFWBNCPO-SVFBPWRDSA-N 1 1 441.576 3.231 20 0 IGADMO C[NH+]1CCC(Oc2ccnc(N3CCO[C@]4(CCC[C@H]4COc4ccccn4)C3)c2)CC1 ZINC001164734309 720541637 /nfs/dbraw/zinc/54/16/37/720541637.db2.gz HSYIAHKMKHVPTN-NBGIEHNGSA-N 1 1 438.572 3.404 20 0 IGADMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@@H]2CN(c3ccc(NC(=O)C(C)(C)C)nn3)CC[C@@H]21 ZINC001164842968 720543908 /nfs/dbraw/zinc/54/39/08/720543908.db2.gz ZGWOBTSBYQMBSS-QYZOEREBSA-N 1 1 425.581 3.036 20 0 IGADMO CSc1cnc(Cl)c(C(F)(F)N2CC[N@@H+]3C[C@@H](Oc4cncnc4)C[C@@H]3C2)c1 ZINC001164744119 720749334 /nfs/dbraw/zinc/74/93/34/720749334.db2.gz REYHFDFWWFLQOL-OLZOCXBDSA-N 1 1 427.908 3.134 20 0 IGADMO CSc1cnc(Cl)c(C(F)(F)N2CC[N@H+]3C[C@@H](Oc4cncnc4)C[C@@H]3C2)c1 ZINC001164744119 720749340 /nfs/dbraw/zinc/74/93/40/720749340.db2.gz REYHFDFWWFLQOL-OLZOCXBDSA-N 1 1 427.908 3.134 20 0 IGADMO Fc1ccc(-c2ccc(Cl)nn2)cc1N1CC[N@H+]2C[C@H](Oc3cncnc3)C[C@@H]2C1 ZINC001164737524 720781337 /nfs/dbraw/zinc/78/13/37/720781337.db2.gz CDLADTVAJNBBFO-HZPDHXFCSA-N 1 1 426.883 3.068 20 0 IGADMO Fc1cccc(Oc2nc(Cl)ncc2N2CC[N@H+]3C[C@H](Oc4cncnc4)C[C@@H]3C2)c1 ZINC001164751275 720802936 /nfs/dbraw/zinc/80/29/36/720802936.db2.gz XTTDHZUIKHDWCP-NVXWUHKLSA-N 1 1 442.882 3.193 20 0 IGADMO Cc1ccccc1Oc1nc(Cl)ncc1N1CC[N@H+]2C[C@@H](Oc3cncnc3)C[C@@H]2C1 ZINC001164740711 720803286 /nfs/dbraw/zinc/80/32/86/720803286.db2.gz AFIBAXAIGFCHRT-SJORKVTESA-N 1 1 438.919 3.363 20 0 IGADMO O=C1[C@H]2CN(c3ccc4c(n3)CC[N@H+](Cc3ccccc3)C4)C[C@H]2CN1Cc1ccncc1 ZINC001164851984 720810435 /nfs/dbraw/zinc/81/04/35/720810435.db2.gz MEYKJBQCEPRYAJ-ZEQRLZLVSA-N 1 1 439.563 3.130 20 0 IGADMO Fc1c(Cl)nccc1C(F)(F)N1CC[C@@H]2[C@H](C[C@@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164752733 720812292 /nfs/dbraw/zinc/81/22/92/720812292.db2.gz ZQHSLASGCGLTPO-HLLBOEOZSA-N 1 1 440.901 3.390 20 0 IGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2C[C@@H]3COC[C@@]3(C(=O)NCCc3ccccc3)C2)nc1 ZINC001164848603 720817143 /nfs/dbraw/zinc/81/71/43/720817143.db2.gz DEZOGPFPGSSFRU-OASJLCFRSA-N 1 1 448.611 3.440 20 0 IGADMO FC(F)(Oc1cccc(Cl)n1)N1CC[C@@H]2[C@@H](C[C@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164738787 720820795 /nfs/dbraw/zinc/82/07/95/720820795.db2.gz GNCWLIOVBBZFIV-GVDBMIGSSA-N 1 1 438.910 3.131 20 0 IGADMO Fc1cccc2c1nc(Cl)nc2N1CC[C@@H]2[C@H](C[C@@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164737972 720825127 /nfs/dbraw/zinc/82/51/27/720825127.db2.gz CTJYLAGEEANGOM-JTDSTZFVSA-N 1 1 441.942 3.393 20 0 IGADMO COCC[N@H+]1CCO[C@H]2CN(C(F)(F)c3ccc4c(Cl)ncnc4c3)CC[C@H]2C1 ZINC001164857080 720840257 /nfs/dbraw/zinc/84/02/57/720840257.db2.gz XFCGGHHUSMBXHF-KSSFIOAISA-N 1 1 426.895 3.002 20 0 IGADMO Fc1cc2ncnc(Cl)c2c(N2CC[C@@H]3[C@@H](C[C@H](Cn4cncn4)[N@H+]3CC3CC3)C2)c1 ZINC001164740031 720842636 /nfs/dbraw/zinc/84/26/36/720842636.db2.gz BOZOGJFDQOISBE-KVSKMBFKSA-N 1 1 441.942 3.393 20 0 IGADMO Cc1cccc(-c2ccc(N3CC[C@@H]4[C@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)nn2)c1 ZINC001164740454 720847691 /nfs/dbraw/zinc/84/76/91/720847691.db2.gz BSZADPQNGOHZIE-AOHZBQACSA-N 1 1 429.572 3.423 20 0 IGADMO CCc1nc(Cl)c(N2CC[C@@H]3[C@@H](C[C@H](Cn4cncn4)[N@H+]3CC3CC3)C2)c(Cl)n1 ZINC001164745190 720850893 /nfs/dbraw/zinc/85/08/93/720850893.db2.gz MNNQCNMYWZCKIM-ARFHVFGLSA-N 1 1 436.391 3.317 20 0 IGADMO COCC[N@H+]1CCO[C@@H]2CN(C(F)(F)c3ccc4nc(Cl)cnc4c3)CC[C@@H]2C1 ZINC001164853729 720851532 /nfs/dbraw/zinc/85/15/32/720851532.db2.gz OTALPLACKPLMPD-RDTXWAMCSA-N 1 1 426.895 3.002 20 0 IGADMO Cc1cc(N2CC[C@@H]3[C@H](C[C@H](Cn4cncn4)[N@H+]3CC3CC3)C2)nc(-c2ccsc2)n1 ZINC001164743925 720851577 /nfs/dbraw/zinc/85/15/77/720851577.db2.gz BAGAISFFCFJHJV-NJDAHSKKSA-N 1 1 435.601 3.484 20 0 IGADMO Cc1nc(-c2ccccn2)nc(N2CC[C@@H]3[C@@H](C[C@H](Cn4cncn4)[N@H+]3CC3CC3)C2)c1C ZINC001164752687 720852608 /nfs/dbraw/zinc/85/26/08/720852608.db2.gz UGIGPAWMQOUFFJ-QZNHQXDQSA-N 1 1 444.587 3.126 20 0 IGADMO COCC[N@H+]1CCO[C@@H]2CN(C(F)(F)c3nc(Cl)c4cc(F)ccc4n3)CC[C@@H]2C1 ZINC001164854846 720852657 /nfs/dbraw/zinc/85/26/57/720852657.db2.gz LERXIRNZFRRYKW-CXAGYDPISA-N 1 1 444.885 3.141 20 0 IGADMO CSc1ccc2ncnc(N3CC[C@@H]4[C@@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)c2c1 ZINC001164748097 720856640 /nfs/dbraw/zinc/85/66/40/720856640.db2.gz JTFFDIKNKXDPRT-NPPFBWRTSA-N 1 1 435.601 3.323 20 0 IGADMO CSc1ccc2ncnc(N3CC[C@@H]4[C@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)c2c1 ZINC001164748095 720856973 /nfs/dbraw/zinc/85/69/73/720856973.db2.gz JTFFDIKNKXDPRT-KGVIQGDOSA-N 1 1 435.601 3.323 20 0 IGADMO Fc1ccc(-c2cncc(N3CC[C@@H]4[C@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)n2)cc1 ZINC001164750284 720857659 /nfs/dbraw/zinc/85/76/59/720857659.db2.gz PHFLSYJLDODYAB-KJXAQDMKSA-N 1 1 433.535 3.254 20 0 IGADMO COCC[N@H+]1CCO[C@@H]2CN(c3ccc(-c4ccc(C(=O)OC)cc4)c(C)n3)CC[C@@H]2C1 ZINC001164855165 720872114 /nfs/dbraw/zinc/87/21/14/720872114.db2.gz GKIJYKAOPJARAD-FYYLOGMGSA-N 1 1 439.556 3.017 20 0 IGADMO COCc1cc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COCc2cccnc2)nc(C)n1 ZINC001164758816 720885558 /nfs/dbraw/zinc/88/55/58/720885558.db2.gz ZQQRSYAHHSGSOS-DHLKQENFSA-N 1 1 437.588 3.082 20 0 IGADMO c1cncc(COC[C@H]2C[N@@H+](CC3CC3)C[C@@]23CCN(c2cnc4cccnc4n2)C3)c1 ZINC001164753474 720885669 /nfs/dbraw/zinc/88/56/69/720885669.db2.gz HBJSNGZKZIARSY-PXDATVDWSA-N 1 1 430.556 3.175 20 0 IGADMO COCc1cc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COCc2cccnc2)nc(C)n1 ZINC001164758822 720885795 /nfs/dbraw/zinc/88/57/95/720885795.db2.gz ZQQRSYAHHSGSOS-WIOPSUGQSA-N 1 1 437.588 3.082 20 0 IGADMO COCC[N@H+]1CCO[C@H]2CN(c3cnc(Cl)nc3Oc3cccc(F)c3)CC[C@H]2C1 ZINC001164858536 720888995 /nfs/dbraw/zinc/88/89/95/720888995.db2.gz KZYHCYGPVIYJFF-KXBFYZLASA-N 1 1 436.915 3.235 20 0 IGADMO Nc1cnc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COCc2cccnc2)c(Cl)c1 ZINC001164758493 720890999 /nfs/dbraw/zinc/89/09/99/720890999.db2.gz YOXBTPZHJRUZLC-WMZHIEFXSA-N 1 1 427.980 3.467 20 0 IGADMO c1nc2cnc(N3CC[C@]4(C3)C[N@H+](CC3CC3)C[C@@H]4COCc3cccnc3)nc2s1 ZINC001164755626 720896849 /nfs/dbraw/zinc/89/68/49/720896849.db2.gz MFKNDAIGNZVKCY-AUSIDOKSSA-N 1 1 436.585 3.236 20 0 IGADMO Cc1nc2c(c(N3CC[C@]4(C3)C[N@@H+](CC3CC3)C[C@@H]4COCc3cccnc3)n1)CCC2 ZINC001164758163 720902394 /nfs/dbraw/zinc/90/23/94/720902394.db2.gz XIFHYUVPSDUEEK-ATIYNZHBSA-N 1 1 433.600 3.424 20 0 IGADMO COc1ncc(Cl)c(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COCc2cccnc2)n1 ZINC001164746497 720929724 /nfs/dbraw/zinc/92/97/24/720929724.db2.gz BAMSKLBUQXPHIA-AUSIDOKSSA-N 1 1 443.979 3.289 20 0 IGADMO CCC(C)(C)NS(=O)(=O)c1ccc(N2CCn3c(C[N@@H+](C)C(C)C)cnc3[C@H]2C)nc1 ZINC001164856317 721007730 /nfs/dbraw/zinc/00/77/30/721007730.db2.gz BIQKWQUUDIFVEL-QGZVFWFLSA-N 1 1 448.637 3.166 20 0 IGADMO CN1C[C@H](COCC2CC2)[C@H]2CCN(c3ccc(C[N@@H+](C)C4CC4)cn3)CC[C@@H]2C1=O ZINC001164860344 721030027 /nfs/dbraw/zinc/03/00/27/721030027.db2.gz LKZSCWVRRMZCFR-MZYLBHOOSA-N 1 1 426.605 3.023 20 0 IGADMO COc1ccc2nc(Cl)nc(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@@H]4C3)c2c1 ZINC001164870646 721042534 /nfs/dbraw/zinc/04/25/34/721042534.db2.gz WNMZATPDQAMCCH-SJLPKXTDSA-N 1 1 425.920 3.167 20 0 IGADMO FC(F)(c1nc(Cl)ncc1Cl)N1CC[N@H+]2C[C@@H](OCc3cccnc3)C[C@@H]2C1 ZINC001164868649 721064900 /nfs/dbraw/zinc/06/49/00/721064900.db2.gz OZXIMYBUEUIGFD-KGLIPLIRSA-N 1 1 430.286 3.203 20 0 IGADMO CCOC(=O)c1c(C)nc(Cl)cc1N1CC[N@H+]2C[C@@H](OCc3cccnc3)C[C@H]2C1 ZINC001164871543 721070863 /nfs/dbraw/zinc/07/08/63/721070863.db2.gz ZNWRAUKWXMVPPL-ROUUACIJSA-N 1 1 430.936 3.095 20 0 IGADMO CC(C)(C)c1noc(-c2ccnc(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@H]4C3)c2)n1 ZINC001164872057 721127023 /nfs/dbraw/zinc/12/70/23/721127023.db2.gz GEVUNCGEFFUETA-VQTJNVASSA-N 1 1 434.544 3.304 20 0 IGADMO COC(=O)C[C@H](c1ccnc(N2CC[N@H+]3C[C@@H](OCc4cccnc4)C[C@@H]3C2)c1)C1CC1 ZINC001164881016 721134939 /nfs/dbraw/zinc/13/49/39/721134939.db2.gz YVIMDUHZMUBJRW-VJBWXMMDSA-N 1 1 436.556 3.013 20 0 IGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4cncc(OCc5cccc(Cl)c5)n4)C[C@H]3C2)cn1 ZINC001164767901 721237337 /nfs/dbraw/zinc/23/73/37/721237337.db2.gz WYOCBRJFWYPFBV-VQTJNVASSA-N 1 1 438.963 3.401 20 0 IGADMO CN(C)C(=O)C[N@H+]1CCOCC2(CCN(c3cc(C(C)(C)C)nc(C(C)(C)C)n3)CC2)C1 ZINC001164872927 721283310 /nfs/dbraw/zinc/28/33/10/721283310.db2.gz IMSIHSNLMSXEKQ-UHFFFAOYSA-N 1 1 445.652 3.079 20 0 IGADMO COC(=O)c1cnc(N2CCC[C@@]3(C2)COCC[N@H+](Cc2c(C)noc2C)C3)c(Cl)c1 ZINC001164778028 721330993 /nfs/dbraw/zinc/33/09/93/721330993.db2.gz SWLUGWVMODUDGQ-JOCHJYFZSA-N 1 1 448.951 3.245 20 0 IGADMO COC(=O)c1cnc(N2CCC[C@@]3(C2)COCC[N@@H+](Cc2c(C)noc2C)C3)c(Cl)c1 ZINC001164778028 721330995 /nfs/dbraw/zinc/33/09/95/721330995.db2.gz SWLUGWVMODUDGQ-JOCHJYFZSA-N 1 1 448.951 3.245 20 0 IGADMO COC(=O)c1cc(N2CCC[C@@]3(C2)COCC[N@H+](Cc2c(C)noc2C)C3)ncc1Cl ZINC001164778043 721335628 /nfs/dbraw/zinc/33/56/28/721335628.db2.gz TVLYPMSLPJGEEM-JOCHJYFZSA-N 1 1 448.951 3.245 20 0 IGADMO COC(=O)c1cc(N2CCC[C@@]3(C2)COCC[N@@H+](Cc2c(C)noc2C)C3)ncc1Cl ZINC001164778043 721335631 /nfs/dbraw/zinc/33/56/31/721335631.db2.gz TVLYPMSLPJGEEM-JOCHJYFZSA-N 1 1 448.951 3.245 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@]2(CCCN(c3ncnc4cc(F)ccc43)C2)C1 ZINC001164778402 721336963 /nfs/dbraw/zinc/33/69/63/721336963.db2.gz VKFYWLWIRRQTRV-HSZRJFAPSA-N 1 1 425.508 3.493 20 0 IGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@]2(CCCN(C(F)(F)c3ccc(Cl)nn3)C2)C1 ZINC001164779356 721339260 /nfs/dbraw/zinc/33/92/60/721339260.db2.gz SJPDABIYMZCRGJ-LJQANCHMSA-N 1 1 441.910 3.399 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@]2(CCCN(C(F)(F)c3ccc(Cl)nn3)C2)C1 ZINC001164779356 721339266 /nfs/dbraw/zinc/33/92/66/721339266.db2.gz SJPDABIYMZCRGJ-LJQANCHMSA-N 1 1 441.910 3.399 20 0 IGADMO CCOC(=O)c1cnc(N2CCC[C@@]3(C2)COCC[N@H+](Cc2c(C)noc2C)C3)c(C)c1 ZINC001164778313 721343342 /nfs/dbraw/zinc/34/33/42/721343342.db2.gz MHWHJXDWBNTUNZ-XMMPIXPASA-N 1 1 442.560 3.291 20 0 IGADMO CCOC(=O)c1cnc(N2CCC[C@@]3(C2)COCC[N@@H+](Cc2c(C)noc2C)C3)c(C)c1 ZINC001164778313 721343346 /nfs/dbraw/zinc/34/33/46/721343346.db2.gz MHWHJXDWBNTUNZ-XMMPIXPASA-N 1 1 442.560 3.291 20 0 IGADMO COc1ccc2nc(N3CCC[C@@]4(C3)COCC[N@H+](Cc3c(C)noc3C)C4)ncc2c1 ZINC001164779352 721352035 /nfs/dbraw/zinc/35/20/35/721352035.db2.gz SISYYEPJVPKLNM-XMMPIXPASA-N 1 1 437.544 3.362 20 0 IGADMO COc1ccc2nc(N3CCC[C@@]4(C3)COCC[N@@H+](Cc3c(C)noc3C)C4)ncc2c1 ZINC001164779352 721352040 /nfs/dbraw/zinc/35/20/40/721352040.db2.gz SISYYEPJVPKLNM-XMMPIXPASA-N 1 1 437.544 3.362 20 0 IGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@]2(CCCN(C(F)(F)c3cncc(Cl)n3)C2)C1 ZINC001164784217 721361940 /nfs/dbraw/zinc/36/19/40/721361940.db2.gz QXMIZFUKMSTMLT-LJQANCHMSA-N 1 1 441.910 3.399 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@]2(CCCN(C(F)(F)c3cncc(Cl)n3)C2)C1 ZINC001164784217 721361943 /nfs/dbraw/zinc/36/19/43/721361943.db2.gz QXMIZFUKMSTMLT-LJQANCHMSA-N 1 1 441.910 3.399 20 0 IGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@]2(CCCN(c3nccnc3OC3CCC3)C2)C1 ZINC001164783817 721371628 /nfs/dbraw/zinc/37/16/28/721371628.db2.gz PVBNWZQYMDGUIH-HSZRJFAPSA-N 1 1 427.549 3.132 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@]2(CCCN(c3nccnc3OC3CCC3)C2)C1 ZINC001164783817 721371630 /nfs/dbraw/zinc/37/16/30/721371630.db2.gz PVBNWZQYMDGUIH-HSZRJFAPSA-N 1 1 427.549 3.132 20 0 IGADMO Cc1cc(C(F)(F)N2CC[C@]3(C2)CCC[C@H](CN2CC[NH+](C)CC2)O3)cc(Cl)n1 ZINC001164894060 721383830 /nfs/dbraw/zinc/38/38/30/721383830.db2.gz XBBOZBIIUKMSAS-QUCCMNQESA-N 1 1 428.955 3.354 20 0 IGADMO CSc1nc2sccc2c(N2CC[C@]3(C2)CCC[C@@H](CN2CC[NH+](C)CC2)O3)n1 ZINC001164888072 721388203 /nfs/dbraw/zinc/38/82/03/721388203.db2.gz JFFCYHSGOZOQPC-KKSFZXQISA-N 1 1 433.647 3.179 20 0 IGADMO CC(C)(C)C(=O)OCn1ccc2c1ncnc2N1C[C@@H]2C[N@@H+](Cc3nccs3)C[C@@H]2C1 ZINC001164789557 721410496 /nfs/dbraw/zinc/41/04/96/721410496.db2.gz VCCGLEPEZFWSHH-IYBDPMFKSA-N 1 1 440.573 3.003 20 0 IGADMO CC(C)(C)C(=O)OCn1ccc2c1ncnc2N1C[C@@H]2C[N@H+](Cc3nccs3)C[C@@H]2C1 ZINC001164789557 721410499 /nfs/dbraw/zinc/41/04/99/721410499.db2.gz VCCGLEPEZFWSHH-IYBDPMFKSA-N 1 1 440.573 3.003 20 0 IGADMO Cc1ccc(C(F)(F)N2CC[C@]3(C2)CCC[C@@H](CN2CC[NH+](C)CC2)O3)nc1Cl ZINC001164892861 721415698 /nfs/dbraw/zinc/41/56/98/721415698.db2.gz YZAQPNCUFHDTFE-PXNSSMCTSA-N 1 1 428.955 3.354 20 0 IGADMO C[NH+]1CCN(C[C@@H]2CCC[C@@]3(CCN(c4ncccc4OCc4ccccc4)C3)O2)CC1 ZINC001164892212 721432336 /nfs/dbraw/zinc/43/23/36/721432336.db2.gz HSLJVZBZYDWPEM-OZXSUGGESA-N 1 1 436.600 3.426 20 0 IGADMO C[NH+]1CCN(C[C@H]2CCC[C@@]3(CCN(c4nccc(Oc5ccc(F)cc5)n4)C3)O2)CC1 ZINC001164892215 721440095 /nfs/dbraw/zinc/44/00/95/721440095.db2.gz HTUVIXKXSRRAJV-QPPBQGQZSA-N 1 1 441.551 3.173 20 0 IGADMO Cc1cnc(N2CC[C@@]3(C2)CCC[C@H](CN2CC[NH+](C)CC2)O3)nc1-c1ccccc1F ZINC001164887146 721448349 /nfs/dbraw/zinc/44/83/49/721448349.db2.gz IXZAXXADMONGFJ-CJFMBICVSA-N 1 1 439.579 3.357 20 0 IGADMO C[NH+]1CCN(C[C@@H]2CCC[C@@]3(CCN(c4c(F)ccc5c(Cl)ncnc54)C3)O2)CC1 ZINC001164891644 721451910 /nfs/dbraw/zinc/45/19/10/721451910.db2.gz VDEUEHNTJAXGBK-AOMKIAJQSA-N 1 1 433.959 3.188 20 0 IGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1nc(C)c(F)cc1C(=O)OC)CC2 ZINC001164790239 721459778 /nfs/dbraw/zinc/45/97/78/721459778.db2.gz ZVKGMOVPNNSUCJ-LJQANCHMSA-N 1 1 449.567 3.050 20 0 IGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1ccnc(-c3cccnc3)n1)CC2 ZINC001164782776 721461846 /nfs/dbraw/zinc/46/18/46/721461846.db2.gz BSOWQOYLONIZAI-QFIPXVFZSA-N 1 1 437.588 3.273 20 0 IGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1ncnc3cc(Cl)cnc31)CC2 ZINC001164783717 721461987 /nfs/dbraw/zinc/46/19/87/721461987.db2.gz GBRKYZOEFLSNSQ-IBGZPJMESA-N 1 1 445.995 3.412 20 0 IGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1nccc(N3CCCCC3)n1)CC2 ZINC001164783585 721462998 /nfs/dbraw/zinc/46/29/98/721462998.db2.gz DNLVAWJWVZSFKB-QFIPXVFZSA-N 1 1 443.636 3.201 20 0 IGADMO CCN(CC)c1cncc(N2CCC3(C[C@@H](COCC4CC4)[N@@H+](CCOC)C3)CC2)n1 ZINC001164786902 721463704 /nfs/dbraw/zinc/46/37/04/721463704.db2.gz QLKGNBTZMLBKCD-NRFANRHFSA-N 1 1 431.625 3.057 20 0 IGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1ncc3ncn(C(C)C)c3n1)CC2 ZINC001164786355 721467414 /nfs/dbraw/zinc/46/74/14/721467414.db2.gz AWTHPHYHJMNKKF-HXUWFJFHSA-N 1 1 442.608 3.141 20 0 IGADMO Fc1cccnc1OC[C@@]12COC[C@@H]1CN(c1nc(Cl)ccc1C[NH+]1CCCC1)C2 ZINC001164793357 721486608 /nfs/dbraw/zinc/48/66/08/721486608.db2.gz QTMYMBNQYNJZKU-HTAPYJJXSA-N 1 1 432.927 3.397 20 0 IGADMO O=C(NC1CCC1)[C@H]1COC2(C1)CCN(c1nc(Cl)ccc1C[NH+]1CCCC1)CC2 ZINC001164902452 721489593 /nfs/dbraw/zinc/48/95/93/721489593.db2.gz ZUQNJIUODHPOJH-GOSISDBHSA-N 1 1 432.996 3.375 20 0 IGADMO CC(C)(C)OC(=O)Nc1cc(N2CC[N@H+]3C[C@@H](Oc4cccc(F)c4)C[C@@H]3C2)ncn1 ZINC001164902060 721520027 /nfs/dbraw/zinc/52/00/27/721520027.db2.gz YWNQXCXXDKIEMB-AEFFLSMTSA-N 1 1 429.496 3.305 20 0 IGADMO CC(C)(C)OC(=O)Nc1nccc(N2CC[N@H+]3C[C@@H](Oc4cccc(F)c4)C[C@H]3C2)n1 ZINC001164902093 721525133 /nfs/dbraw/zinc/52/51/33/721525133.db2.gz ZDDWXKMPKORBCQ-WMZOPIPTSA-N 1 1 429.496 3.305 20 0 IGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2ncccc2C(=O)NC2CCCCC2)[C@H]2CCCO[C@@H]12 ZINC001164810523 721532486 /nfs/dbraw/zinc/53/24/86/721532486.db2.gz XFHRBYOCOWWQQI-RBZQAINGSA-N 1 1 449.599 3.407 20 0 IGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2ncccc2C(=O)NC2CCCCC2)[C@H]2CCCO[C@@H]12 ZINC001164810523 721532492 /nfs/dbraw/zinc/53/24/92/721532492.db2.gz XFHRBYOCOWWQQI-RBZQAINGSA-N 1 1 449.599 3.407 20 0 IGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2ncccc2C(=O)NC2CCCCC2)[C@@H]2CCCO[C@@H]12 ZINC001164810529 721532509 /nfs/dbraw/zinc/53/25/09/721532509.db2.gz XFHRBYOCOWWQQI-WXFUMESZSA-N 1 1 449.599 3.407 20 0 IGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2ncccc2C(=O)NC2CCCCC2)[C@@H]2CCCO[C@@H]12 ZINC001164810529 721532516 /nfs/dbraw/zinc/53/25/16/721532516.db2.gz XFHRBYOCOWWQQI-WXFUMESZSA-N 1 1 449.599 3.407 20 0 IGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2cncc(OCc3ccccc3)n2)[C@H]2CCCO[C@@H]12 ZINC001164807831 721537258 /nfs/dbraw/zinc/53/72/58/721537258.db2.gz RMAASUDDHKJVIM-SGIRGMQISA-N 1 1 431.540 3.319 20 0 IGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2cncc(OCc3ccccc3)n2)[C@H]2CCCO[C@@H]12 ZINC001164807831 721537259 /nfs/dbraw/zinc/53/72/59/721537259.db2.gz RMAASUDDHKJVIM-SGIRGMQISA-N 1 1 431.540 3.319 20 0 IGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2nc(Cl)nc(-c3ccccc3)n2)[C@@H]2CCCO[C@H]12 ZINC001164803021 721545241 /nfs/dbraw/zinc/54/52/41/721545241.db2.gz HKYQMCWCTSCWIE-AQNXPRMDSA-N 1 1 436.947 3.455 20 0 IGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2nc(Cl)nc(-c3ccccc3)n2)[C@@H]2CCCO[C@H]12 ZINC001164803021 721545246 /nfs/dbraw/zinc/54/52/46/721545246.db2.gz HKYQMCWCTSCWIE-AQNXPRMDSA-N 1 1 436.947 3.455 20 0 IGADMO COC(=O)c1cc2c(N3CC[N@H+]4C[C@H](Oc5cccc(F)c5)C[C@H]4C3)[nH]c(Cl)cc-2n1 ZINC001164908808 721546248 /nfs/dbraw/zinc/54/62/48/721546248.db2.gz QQRIZYUWZNKVAV-GOEBONIOSA-N 1 1 444.894 3.484 20 0 IGADMO CC1CCN(C(=O)c2cccnc2N2CC[N@H+]3C[C@@H](Oc4cccc(F)c4)C[C@H]3C2)CC1 ZINC001164907254 721553280 /nfs/dbraw/zinc/55/32/80/721553280.db2.gz NLFZXEDTHDBYEZ-UNMCSNQZSA-N 1 1 438.547 3.435 20 0 IGADMO CCOC(=O)c1cnc(N2C[C@H]([N@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@H]32)c(Cl)c1 ZINC001164800705 721557580 /nfs/dbraw/zinc/55/75/80/721557580.db2.gz FNNRGDBYMWCVKR-HSALFYBXSA-N 1 1 430.936 3.175 20 0 IGADMO CCOC(=O)c1cnc(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@H]32)c(Cl)c1 ZINC001164800705 721557583 /nfs/dbraw/zinc/55/75/83/721557583.db2.gz FNNRGDBYMWCVKR-HSALFYBXSA-N 1 1 430.936 3.175 20 0 IGADMO Cc1nc2c(nc(Cl)nc2N2C[C@H]([N@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@@H]32)s1 ZINC001164798182 721559254 /nfs/dbraw/zinc/55/92/54/721559254.db2.gz ANRJESDIEJAJEC-YQQAZPJKSA-N 1 1 430.965 3.311 20 0 IGADMO Cc1nc2c(nc(Cl)nc2N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@@H]32)s1 ZINC001164798182 721559257 /nfs/dbraw/zinc/55/92/57/721559257.db2.gz ANRJESDIEJAJEC-YQQAZPJKSA-N 1 1 430.965 3.311 20 0 IGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2cc(OCc3ccccc3)cnn2)[C@@H]2CCCO[C@H]12 ZINC001164804026 721562170 /nfs/dbraw/zinc/56/21/70/721562170.db2.gz KSRVPUYIORUVGM-OYRHQHFDSA-N 1 1 431.540 3.319 20 0 IGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2cc(OCc3ccccc3)cnn2)[C@@H]2CCCO[C@H]12 ZINC001164804026 721562171 /nfs/dbraw/zinc/56/21/71/721562171.db2.gz KSRVPUYIORUVGM-OYRHQHFDSA-N 1 1 431.540 3.319 20 0 IGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(C(F)(F)COc2cccc(Cl)n2)[C@H]2CCCO[C@H]12 ZINC001164809383 721564238 /nfs/dbraw/zinc/56/42/38/721564238.db2.gz WRSHHTBMCNONLW-QKLQHJQFSA-N 1 1 438.906 3.465 20 0 IGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(C(F)(F)COc2cccc(Cl)n2)[C@H]2CCCO[C@H]12 ZINC001164809383 721564239 /nfs/dbraw/zinc/56/42/39/721564239.db2.gz WRSHHTBMCNONLW-QKLQHJQFSA-N 1 1 438.906 3.465 20 0 IGADMO COc1cccc(-c2ccnc(N3C[C@H]([N@H+](C)Cc4cccnc4)[C@@H]4OCCC[C@@H]43)n2)c1 ZINC001164807341 721567095 /nfs/dbraw/zinc/56/70/95/721567095.db2.gz SSKGZPFDNNJZMP-KMDXXIMOSA-N 1 1 431.540 3.415 20 0 IGADMO COc1cccc(-c2ccnc(N3C[C@H]([N@@H+](C)Cc4cccnc4)[C@@H]4OCCC[C@@H]43)n2)c1 ZINC001164807341 721567100 /nfs/dbraw/zinc/56/71/00/721567100.db2.gz SSKGZPFDNNJZMP-KMDXXIMOSA-N 1 1 431.540 3.415 20 0 IGADMO COc1cc(C(F)(F)N2CC[N@H+]3C[C@@H](Oc4cccc(F)c4)C[C@@H]3C2)nc(Cl)n1 ZINC001164908039 721567405 /nfs/dbraw/zinc/56/74/05/721567405.db2.gz PKKGLZFGBHZUMN-HIFRSBDPSA-N 1 1 428.842 3.165 20 0 IGADMO COC(=O)c1ccc2cc(N3C[C@H]([N@@H+](C)Cc4cccnc4)[C@@H]4OCCC[C@H]43)ncc2c1 ZINC001164804700 721573934 /nfs/dbraw/zinc/57/39/34/721573934.db2.gz MHJDAKUIJICOQX-AOHZBQACSA-N 1 1 432.524 3.285 20 0 IGADMO COc1cnc(N2CCC(F)(F)[C@@]3(CC[N@@H+](Cc4ccccn4)C3)C2)nc1NC(C)C ZINC001164902886 721582836 /nfs/dbraw/zinc/58/28/36/721582836.db2.gz JWKZNCJOBBAVIQ-OAQYLSRUSA-N 1 1 432.519 3.438 20 0 IGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2nc(-c3cccnc3)nc3c2CCC3)[C@H]2CCCO[C@H]12 ZINC001164807531 721585789 /nfs/dbraw/zinc/58/57/89/721585789.db2.gz OIZMJHGXGTWZLW-VXNXHJTFSA-N 1 1 442.567 3.291 20 0 IGADMO COC(=O)c1ccc(N2CCC(F)(F)[C@@]3(CC[N@@H+](Cc4ccccn4)C3)C2)nc1OC ZINC001164904957 721586905 /nfs/dbraw/zinc/58/69/05/721586905.db2.gz IJOFATFWIMZZHU-OAQYLSRUSA-N 1 1 432.471 3.010 20 0 IGADMO CCOC(=O)c1c(C)ncnc1N1CCC(F)(F)[C@@]2(CC[N@@H+](Cc3ccccn3)C2)C1 ZINC001164908722 721706798 /nfs/dbraw/zinc/70/67/98/721706798.db2.gz YUMNJELYDSDTMU-OAQYLSRUSA-N 1 1 431.487 3.094 20 0 IGADMO C[C@H]1CC(=O)Nc2ncnc(N3CCC(F)(F)[C@]4(CC[N@@H+](Cc5ccccn5)C4)C3)c21 ZINC001164906645 721707116 /nfs/dbraw/zinc/70/71/16/721707116.db2.gz NMYILNXCQSAXDL-BTYIYWSLSA-N 1 1 428.487 3.055 20 0 IGADMO O=C1[C@H]2CN(c3ccc4c(n3)CC[N@H+](Cc3ccccc3)C4)C[C@@H]2CN1c1cccnc1 ZINC001165024871 721789909 /nfs/dbraw/zinc/78/99/09/721789909.db2.gz UDHSTBBRASRLDA-GGAORHGYSA-N 1 1 425.536 3.134 20 0 IGADMO COC(=O)c1cc2c(OC)[nH]c(N3C[C@@H]4CCC[C@H]([N@@H+](C)Cc5ccccn5)[C@@H]4C3)cc-2n1 ZINC001165027086 721811011 /nfs/dbraw/zinc/81/10/11/721811011.db2.gz SARAZBPAYUIDJS-NBCNXNJRSA-N 1 1 449.555 3.490 20 0 IGADMO C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@H]2CN(c3c(Cl)nc(Cl)nc3C(N)=O)C[C@@H]21 ZINC001165025230 721815231 /nfs/dbraw/zinc/81/52/31/721815231.db2.gz MAYKWRQJVYOVBP-AEGPPILISA-N 1 1 435.359 3.014 20 0 IGADMO CCc1cc(N2C[C@@H]3CCC[C@@H]([N@H+](C)Cc4ccccn4)[C@H]3C2)nc(N2CCOCC2)n1 ZINC001165025343 721817848 /nfs/dbraw/zinc/81/78/48/721817848.db2.gz MRYDJIVJBJAURT-AJSBUHFISA-N 1 1 436.604 3.008 20 0 IGADMO CCc1cc(N2C[C@@H]3CCC[C@@H]([N@@H+](C)Cc4ccccn4)[C@H]3C2)nc(N2CCOCC2)n1 ZINC001165025343 721817849 /nfs/dbraw/zinc/81/78/49/721817849.db2.gz MRYDJIVJBJAURT-AJSBUHFISA-N 1 1 436.604 3.008 20 0 IGADMO CCOC(=O)c1nc2ccn(C)c2c(N2C[C@@H]3CCC[C@@H]([N@@H+](C)Cc4ccccn4)[C@@H]3C2)n1 ZINC001165025481 721820752 /nfs/dbraw/zinc/82/07/52/721820752.db2.gz MXIQZGJZRXZBQU-FBBABVLZSA-N 1 1 448.571 3.277 20 0 IGADMO COc1ccc(CN(C)c2cc[nH+]c(N3CCC4(CC3)c3ncc(C)n3CCN4C)n2)cc1 ZINC001164919567 721820806 /nfs/dbraw/zinc/82/08/06/721820806.db2.gz SWCKTGZGJWMEIF-UHFFFAOYSA-N 1 1 447.587 3.068 20 0 IGADMO COC(=O)c1cc(OC)cnc1N1CCC2(CC1)C[N@@H+](Cc1ccc(C)cc1)CCO2 ZINC001164939314 721924411 /nfs/dbraw/zinc/92/44/11/721924411.db2.gz HZXZEEGTUQXILL-UHFFFAOYSA-N 1 1 425.529 3.057 20 0 IGADMO CC(=O)N1CC[C@]2(c3ccccc3)CCN(c3cc(OC4CC[NH+](C)CC4)ccn3)C[C@@H]12 ZINC001164947133 721968052 /nfs/dbraw/zinc/96/80/52/721968052.db2.gz PQFUPJKKANZAGI-RSXGOPAZSA-N 1 1 434.584 3.324 20 0 IGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2CCN(C(=O)[C@@H]3COc4ccccc4O3)CC2)nc1 ZINC001165049877 721981785 /nfs/dbraw/zinc/98/17/85/721981785.db2.gz NEKBDVYFPMXMPS-OFNKIYASSA-N 1 1 436.556 3.117 20 0 IGADMO O=C(NCc1cccnc1)[C@H]1C[C@]12CCN(c1nc(Cl)ccc1C[NH+]1CCCC1)C2 ZINC001164961467 722034161 /nfs/dbraw/zinc/03/41/61/722034161.db2.gz VVGGIEMDLKWHKO-XXBNENTESA-N 1 1 425.964 3.259 20 0 IGADMO COC(=O)c1cc(N2CCC3(CC2)COCC[N@@H+](Cc2ccncc2)C3)ncc1Cl ZINC001164961945 722053181 /nfs/dbraw/zinc/05/31/81/722053181.db2.gz ZOQLIAVADFULBF-UHFFFAOYSA-N 1 1 430.936 3.036 20 0 IGADMO COC(=O)c1cc(Cl)cc(N2CCC3(CC2)COCC[N@@H+](Cc2ccncc2)C3)n1 ZINC001164958046 722054174 /nfs/dbraw/zinc/05/41/74/722054174.db2.gz BBLLITGIFRXKIL-UHFFFAOYSA-N 1 1 430.936 3.036 20 0 IGADMO CC(=O)N1[C@@H]2CCN(c3nc(Cl)ccc3C[NH+]3CCCC3)C[C@H]2C[C@H]1Cn1cccn1 ZINC001164969531 722080515 /nfs/dbraw/zinc/08/05/15/722080515.db2.gz LERXATSQCUYIQO-QHAWAJNXSA-N 1 1 442.995 3.043 20 0 IGADMO CCOC(=O)c1cc(Cl)nc(N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)c1 ZINC001164982845 722099354 /nfs/dbraw/zinc/09/93/54/722099354.db2.gz PJVARSORUXQIKZ-IEBWSBKVSA-N 1 1 430.936 3.034 20 0 IGADMO COc1cc2nc(C)nc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)c2cc1OC ZINC001164982478 722119366 /nfs/dbraw/zinc/11/93/66/722119366.db2.gz WQADPYMMFBUGRH-NTKDMRAZSA-N 1 1 449.555 3.078 20 0 IGADMO COc1ccc2nc(Cl)cc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)c2n1 ZINC001164983764 722122559 /nfs/dbraw/zinc/12/25/59/722122559.db2.gz ZZGUVYIYLKXMRF-PXNSSMCTSA-N 1 1 439.947 3.414 20 0 IGADMO COc1cccc2nc(Cl)nc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)c21 ZINC001164972440 722123183 /nfs/dbraw/zinc/12/31/83/722123183.db2.gz FJQPCRMFCWBHHD-PXNSSMCTSA-N 1 1 439.947 3.414 20 0 IGADMO c1ccc2c(c1)CCc1cnc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)nc1-2 ZINC001164982287 722134203 /nfs/dbraw/zinc/13/42/03/722134203.db2.gz RNVYZQOSMSFYAI-UPVQGACJSA-N 1 1 427.552 3.365 20 0 IGADMO CCOC(=O)c1nc(N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)ccc1Cl ZINC001164974174 722134991 /nfs/dbraw/zinc/13/49/91/722134991.db2.gz CLLAGKREDGPCNQ-HKUYNNGSSA-N 1 1 430.936 3.034 20 0 IGADMO COc1ccc(-c2ccc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)nn2)cc1 ZINC001164973384 722139622 /nfs/dbraw/zinc/13/96/22/722139622.db2.gz CAYTWHUUAHENNE-QPPBQGQZSA-N 1 1 431.540 3.275 20 0 IGADMO COC(=O)c1cc2ccccc2c(N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)n1 ZINC001164980258 722144998 /nfs/dbraw/zinc/14/49/98/722144998.db2.gz MFZYUVPKVRFQJX-OFNKIYASSA-N 1 1 432.524 3.144 20 0 IGADMO COc1ccccc1-c1cc(N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)ncn1 ZINC001164980884 722145154 /nfs/dbraw/zinc/14/51/54/722145154.db2.gz NHPJZEXDYSHTPV-HYBUGGRVSA-N 1 1 431.540 3.275 20 0 IGADMO COc1ccc(-c2cc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)ncn2)cc1 ZINC001164975235 722145231 /nfs/dbraw/zinc/14/52/31/722145231.db2.gz GDGHMLCIXPJPPQ-XUZZJYLKSA-N 1 1 431.540 3.275 20 0 IGADMO CCOC[C@H]1C(=O)N(CC)CC12CCN(c1nc(Cl)ccc1C[NH+]1CCCC1)CC2 ZINC001164990817 722187556 /nfs/dbraw/zinc/18/75/56/722187556.db2.gz NNAOQSBPDLVGHM-IBGZPJMESA-N 1 1 435.012 3.432 20 0 IGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2CC[C@@H](OCCOC)[C@H]2Cc2cnn(C)c2)nc1 ZINC001164998395 722224984 /nfs/dbraw/zinc/22/49/84/722224984.db2.gz BHBXFRLUIGMKFM-DNVJHFABSA-N 1 1 427.593 3.215 20 0 IGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2CC[C@H](OCCOC)[C@@H]2Cc2cnn(C)c2)nc1 ZINC001164998396 722225068 /nfs/dbraw/zinc/22/50/68/722225068.db2.gz BHBXFRLUIGMKFM-VJBWXMMDSA-N 1 1 427.593 3.215 20 0 IGADMO CCC[N@H+]1CCCC[C@H]1c1ccc(N2CCc3ncnc(N4CCN(C)CC4)c3CC2)nc1 ZINC001165002259 722239884 /nfs/dbraw/zinc/23/98/84/722239884.db2.gz SFQCVGGEILWVTQ-DEOSSOPVSA-N 1 1 449.647 3.166 20 0 IGADMO CCOC(=O)C1CCN(c2ccc(N3CCC[C@@H]4C[N@@H+](Cc5ccccc5)C[C@H]43)nn2)CC1 ZINC001164629065 719087292 /nfs/dbraw/zinc/08/72/92/719087292.db2.gz QTFGMHYFBSATJF-DHIUTWEWSA-N 1 1 449.599 3.357 20 0 IGADMO c1ccc(C[N@H+]2C[C@H]3CCCN(c4nc(N5CCCC5)nc(N5CCCC5)n4)[C@H]3C2)cc1 ZINC001164621877 719096691 /nfs/dbraw/zinc/09/66/91/719096691.db2.gz BIWYZKFHAUSSSX-YADHBBJMSA-N 1 1 433.604 3.173 20 0 IGADMO CC(C)n1nc(C[NH+](C)C)c2c1CN([C@@](F)(COc1cncc(Cl)n1)C(F)F)CC2 ZINC001164651269 719316193 /nfs/dbraw/zinc/31/61/93/719316193.db2.gz ISWRDJNIDHZPFT-IBGZPJMESA-N 1 1 446.905 3.337 20 0 IGADMO CC(C)n1nc(C[NH+](C)C)c2c1CN(C(F)(F)c1cc(N(C)C)nc(Cl)n1)CC2 ZINC001164652666 719317443 /nfs/dbraw/zinc/31/74/43/719317443.db2.gz KPCGNHZSIIAPNS-UHFFFAOYSA-N 1 1 427.931 3.143 20 0 IGADMO CNC(=O)C[N@H+]1CCCC12CCN(c1cc(F)ccc1Oc1ccc(Cl)nn1)CC2 ZINC001164689544 719738681 /nfs/dbraw/zinc/73/86/81/719738681.db2.gz HFBFZVPEFIQGKJ-UHFFFAOYSA-N 1 1 433.915 3.242 20 0 IGADMO CNC(=O)C[N@H+]1CCCC12CCN(c1nc3ccccc3nc1N1CCCC[C@H]1C)CC2 ZINC001164689546 719740811 /nfs/dbraw/zinc/74/08/11/719740811.db2.gz HGOFRGWTNYUCTF-LJQANCHMSA-N 1 1 436.604 3.189 20 0 IGADMO CNC(=O)C[N@H+]1CCCC12CCN(c1cnc(Cl)nc1Oc1ccccc1OC)CC2 ZINC001164689880 719755113 /nfs/dbraw/zinc/75/51/13/719755113.db2.gz NMUAXECDUCDISH-UHFFFAOYSA-N 1 1 445.951 3.112 20 0 IGADMO COC(=O)[C@]1(C)C[C@H]([NH+]2CCOCC2)CCN1c1cc(Cl)nc2c(OC)cccc12 ZINC001164702608 719838185 /nfs/dbraw/zinc/83/81/85/719838185.db2.gz OEWWVBORUQXJPY-QRQCRPRQSA-N 1 1 433.936 3.130 20 0 IGADMO COC(=O)[C@]1(C)C[C@@H]([NH+]2CCOCC2)CCN1c1ncc(OC)c2ccc(Cl)cc21 ZINC001164701363 719854549 /nfs/dbraw/zinc/85/45/49/719854549.db2.gz KIKWUCJFCMQGQG-AOMKIAJQSA-N 1 1 433.936 3.130 20 0 IGADMO COC(=O)[C@@]1(C)C[C@H]([NH+]2CCOCC2)CCN1c1nc(C)nc2sc3c(c21)CCCC3 ZINC001164701674 719867089 /nfs/dbraw/zinc/86/70/89/719867089.db2.gz GPBINTHBCRFQDD-WAIKUNEKSA-N 1 1 444.601 3.111 20 0 IGADMO COC(=O)c1ccc2cnc(N3CCC4(CC3)C[N@H+](Cc3cccs3)CCO4)nc2c1 ZINC001164695278 719888347 /nfs/dbraw/zinc/88/83/47/719888347.db2.gz LBKZUDPPNYTMMV-UHFFFAOYSA-N 1 1 438.553 3.349 20 0 IGADMO COC(=O)c1ccc2cnc(N3CCC4(CC3)C[N@@H+](Cc3cccs3)CCO4)nc2c1 ZINC001164695278 719888348 /nfs/dbraw/zinc/88/83/48/719888348.db2.gz LBKZUDPPNYTMMV-UHFFFAOYSA-N 1 1 438.553 3.349 20 0 IGADMO O=C1NCc2c1c(N1CCC3(CC1)C[N@@H+](Cc1cccs1)CCO3)nc(Cl)c2F ZINC001164697472 719893547 /nfs/dbraw/zinc/89/35/47/719893547.db2.gz KDEQHUCFSMANOD-UHFFFAOYSA-N 1 1 436.940 3.050 20 0 IGADMO O=C(c1ccnc(N2CCC3(CC2)C[N@@H+](Cc2cccs2)CCO3)c1)N1CCCC1 ZINC001164696655 719896074 /nfs/dbraw/zinc/89/60/74/719896074.db2.gz GNRXFTREIMSRGM-UHFFFAOYSA-N 1 1 426.586 3.251 20 0 IGADMO c1csc(CN2CCOC3(CCN(c4cccc(OCC[NH+]5CCCC5)n4)CC3)C2)c1 ZINC001164698287 719897235 /nfs/dbraw/zinc/89/72/35/719897235.db2.gz QVBGIMLHZGGQHJ-UHFFFAOYSA-N 1 1 442.629 3.489 20 0 IGADMO COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1ncc(C)c(N3CCCC3)n1)CC2 ZINC001164710017 720092739 /nfs/dbraw/zinc/09/27/39/720092739.db2.gz FMNYEWNTCXMXCD-QFIPXVFZSA-N 1 1 436.604 3.288 20 0 IGADMO COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1ccc(N3CCCCC3)nn1)CC2 ZINC001164710653 720093999 /nfs/dbraw/zinc/09/39/99/720093999.db2.gz KNUFVLLKGIGTAV-JOCHJYFZSA-N 1 1 436.604 3.369 20 0 IGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(C(F)(F)c1cnc(Cl)c(C(=O)OC)c1)C2 ZINC001164809253 720096430 /nfs/dbraw/zinc/09/64/30/720096430.db2.gz IZPBYZXUIAURQY-JXFKEZNVSA-N 1 1 443.922 3.251 20 0 IGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1nc(Cl)nc3cc(C(=O)OC)ccc31)C2 ZINC001164813831 720119315 /nfs/dbraw/zinc/11/93/15/720119315.db2.gz RBNWMQOZFWSADZ-UZUQRXQVSA-N 1 1 444.963 3.255 20 0 IGADMO CCOC(=O)c1cc2ncnc(N3CC[C@@]4(C3)C[N@@H+](CC3CC3)C[C@H]4COC)c2s1 ZINC001164810481 720144744 /nfs/dbraw/zinc/14/47/44/720144744.db2.gz JXEMKJYXBULKEY-AOMKIAJQSA-N 1 1 430.574 3.053 20 0 IGADMO CC(C)[N@@H+](C)Cc1cc(=O)n2c(n1)CN(c1cc(C(=O)Nc3ccccc3)ccn1)CCC2 ZINC001164813956 720224412 /nfs/dbraw/zinc/22/44/12/720224412.db2.gz QCWIHKFGFHYVDG-UHFFFAOYSA-N 1 1 446.555 3.141 20 0 IGADMO COc1cccc2nc(Cl)nc(N3CCCn4c(=O)cc(C[N@@H+](C)C(C)C)nc4C3)c21 ZINC001164813560 720225654 /nfs/dbraw/zinc/22/56/54/720225654.db2.gz PGFZSNBLOCVDMU-UHFFFAOYSA-N 1 1 442.951 3.099 20 0 IGADMO CC(C)(C)C(=O)OCn1ccc2c1ncnc2N1CC[C@@H]2[C@@H]1CC[N@H+]2Cc1cccnc1 ZINC001164727791 720385317 /nfs/dbraw/zinc/38/53/17/720385317.db2.gz RLFPSRBDTOFCOH-UXHICEINSA-N 1 1 434.544 3.226 20 0 IGADMO c1ccc(N2CCN(c3ccc(N4CC[C@@H]5[C@@H]4CC[N@@H+]5Cc4cccnc4)nn3)CC2)cc1 ZINC001164729303 720442041 /nfs/dbraw/zinc/44/20/41/720442041.db2.gz GVDHVYHXWRZGIG-RPWUZVMVSA-N 1 1 441.583 3.051 20 0 IGADMO O=C(Nc1nncs1)c1cnc(N2CC[C@H]3[C@@H]2CC[N@@H+]3Cc2cccnc2)c(Cl)c1 ZINC001164735921 720451794 /nfs/dbraw/zinc/45/17/94/720451794.db2.gz ZNFCUBTUXHUZRG-IRXDYDNUSA-N 1 1 441.948 3.087 20 0 IGADMO O=C(Nc1nncs1)c1cnc(N2CC[C@H]3[C@@H]2CC[N@H+]3Cc2cccnc2)c(Cl)c1 ZINC001164735921 720451803 /nfs/dbraw/zinc/45/18/03/720451803.db2.gz ZNFCUBTUXHUZRG-IRXDYDNUSA-N 1 1 441.948 3.087 20 0 IGADMO CCOC(=O)c1cc(N2CC[C@@H]3[C@H](C[C@H](Cn4cccn4)[N@H+]3C(C)C)C2)ncc1Cl ZINC001164839050 720513076 /nfs/dbraw/zinc/51/30/76/720513076.db2.gz SEXIBUDJBJFKRG-MBOZVWFJSA-N 1 1 431.968 3.486 20 0 IGADMO C[NH+]1CCC(Oc2ccnc(N3CCO[C@@]4(CCC[C@H]4COc4ccccn4)C3)c2)CC1 ZINC001164734306 720541854 /nfs/dbraw/zinc/54/18/54/720541854.db2.gz HSYIAHKMKHVPTN-CPJSRVTESA-N 1 1 438.572 3.404 20 0 IGADMO CCOC(=O)c1cnc(C2CC2)nc1N1CC[C@@H]2[C@H](C[C@@H](Cn3cccn3)[N@H+]2C(C)C)C1 ZINC001164835026 720543066 /nfs/dbraw/zinc/54/30/66/720543066.db2.gz GTJGMRKEALXJJU-SVFBPWRDSA-N 1 1 438.576 3.105 20 0 IGADMO CC(C)[N@@H+]1[C@@H]2CCN(c3nc(Cl)nc4c(Cl)ncnc43)C[C@H]2C[C@H]1Cn1cccn1 ZINC001164844208 720630463 /nfs/dbraw/zinc/63/04/63/720630463.db2.gz ZYRUXIOPPLQQMH-QLFBSQMISA-N 1 1 447.374 3.301 20 0 IGADMO COc1cc(C(F)(F)N2CC[C@@H]3[C@H](C[C@@H](Cn4cccn4)[N@H+]3C(C)C)C2)nc(Cl)n1 ZINC001164843775 720647485 /nfs/dbraw/zinc/64/74/85/720647485.db2.gz YEQTVMCMWCRGGD-OWCLPIDISA-N 1 1 440.926 3.258 20 0 IGADMO FC(F)(c1nc2ccsc2c(Cl)n1)N1CC[N@@H+]2C[C@@H](Oc3cncnc3)C[C@H]2C1 ZINC001164743637 720651779 /nfs/dbraw/zinc/65/17/79/720651779.db2.gz PUOFHDAGMGZACF-RYUDHWBXSA-N 1 1 438.891 3.022 20 0 IGADMO FC(F)(c1nc2ccsc2c(Cl)n1)N1CC[N@H+]2C[C@@H](Oc3cncnc3)C[C@H]2C1 ZINC001164743637 720651793 /nfs/dbraw/zinc/65/17/93/720651793.db2.gz PUOFHDAGMGZACF-RYUDHWBXSA-N 1 1 438.891 3.022 20 0 IGADMO Fc1ccc(Oc2ccc(Cl)nn2)c(N2CC[N@H+]3C[C@H](Oc4cncnc4)C[C@@H]3C2)c1 ZINC001164743402 720760629 /nfs/dbraw/zinc/76/06/29/720760629.db2.gz PVAYLBWCAHZENS-HZPDHXFCSA-N 1 1 442.882 3.193 20 0 IGADMO Clc1c[nH]c2nc(Cl)nc(N3CC[C@@H]4[C@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)c12 ZINC001164747694 720810640 /nfs/dbraw/zinc/81/06/40/720810640.db2.gz PCPKBCLHNCVMMF-IJEWVQPXSA-N 1 1 447.374 3.236 20 0 IGADMO Clc1ncnc2scc(N3CC[C@@H]4[C@@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)c21 ZINC001164741733 720822935 /nfs/dbraw/zinc/82/29/35/720822935.db2.gz OCJIHNAEMHBMMB-ARFHVFGLSA-N 1 1 429.981 3.316 20 0 IGADMO CSc1nc2ccccc2c(N2CC[C@@H]3[C@@H](C[C@H](Cn4cncn4)[N@H+]3CC3CC3)C2)n1 ZINC001164750226 720832826 /nfs/dbraw/zinc/83/28/26/720832826.db2.gz WSDUWUOFCFJQOY-WAOWUJCRSA-N 1 1 435.601 3.323 20 0 IGADMO c1ncn(C[C@H]2C[C@H]3CN(c4cnc(OCc5ccccc5)cn4)CC[C@H]3[N@@H+]2CC2CC2)n1 ZINC001164741267 720841284 /nfs/dbraw/zinc/84/12/84/720841284.db2.gz DWERNKSWSQKXSD-YTFSRNRJSA-N 1 1 445.571 3.027 20 0 IGADMO Cc1c[nH]c2nc(Cl)cc(N3CC[C@@H]4[C@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)c12 ZINC001164740010 720844465 /nfs/dbraw/zinc/84/44/65/720844465.db2.gz BMWQZTRJGFOWKP-FGTMMUONSA-N 1 1 425.968 3.496 20 0 IGADMO Cc1nc2sc3c(c2c(N2CC[C@@H]4[C@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C2)n1)CCC3 ZINC001164745773 720846219 /nfs/dbraw/zinc/84/62/19/720846219.db2.gz NHLXHSHYPCPQSO-WSTZPKSXSA-N 1 1 449.628 3.459 20 0 IGADMO Fc1ccc(-c2cc(N3CC[C@@H]4[C@@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)ncn2)cc1 ZINC001164745927 720850484 /nfs/dbraw/zinc/85/04/84/720850484.db2.gz OEGRYXYCTUGYGG-XKCSPQBFSA-N 1 1 433.535 3.254 20 0 IGADMO c1ncn(C[C@H]2C[C@H]3CN(c4nccnc4Oc4ccccc4)CC[C@H]3[N@H+]2CC2CC2)n1 ZINC001164751172 720853870 /nfs/dbraw/zinc/85/38/70/720853870.db2.gz QMWQWBZPBRWIOY-TUNNFDKTSA-N 1 1 431.544 3.240 20 0 IGADMO CSc1ccc2ncnc(N3CC[C@@H]4[C@@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)c2c1 ZINC001164748096 720856842 /nfs/dbraw/zinc/85/68/42/720856842.db2.gz JTFFDIKNKXDPRT-NJNPRVFISA-N 1 1 435.601 3.323 20 0 IGADMO c1cncc(COC[C@H]2C[N@@H+](CC3CC3)C[C@@]23CCN(c2nccc(NC4CC4)n2)C3)c1 ZINC001164754416 720868195 /nfs/dbraw/zinc/86/81/95/720868195.db2.gz RRPBCNTZEZCEJJ-PXDATVDWSA-N 1 1 434.588 3.201 20 0 IGADMO COCC[N@H+]1CCO[C@@H]2CN(c3ncnc4c3c(C)c(C)n4Cc3ccccc3)CC[C@H]2C1 ZINC001164858364 720875842 /nfs/dbraw/zinc/87/58/42/720875842.db2.gz KSIDLUKERCBJIO-XZOQPEGZSA-N 1 1 449.599 3.270 20 0 IGADMO Fc1cc2c(cn1)ncnc2N1CC[C@]2(C1)C[N@@H+](CC1CC1)C[C@@H]2COCc1cccnc1 ZINC001164752178 720881396 /nfs/dbraw/zinc/88/13/96/720881396.db2.gz LYZAMSAJIYDMHK-CJFMBICVSA-N 1 1 448.546 3.314 20 0 IGADMO COCC[N@H+]1CCO[C@@H]2CN(c3cnc(Cl)nc3Oc3ccccc3F)CC[C@@H]2C1 ZINC001164854391 720888707 /nfs/dbraw/zinc/88/87/07/720888707.db2.gz FFBXIEAUNXWMMM-DNVCBOLYSA-N 1 1 436.915 3.235 20 0 IGADMO CSc1cnc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COCc2cccnc2)nc1 ZINC001164754544 720895035 /nfs/dbraw/zinc/89/50/35/720895035.db2.gz JHIIJWLLJASIOK-OFNKIYASSA-N 1 1 425.602 3.349 20 0 IGADMO c1ccc(C[N@H+]2CCc3nc(N4C[C@H](OCc5cccnc5)[C@H]5COC[C@@H]54)ccc3C2)cc1 ZINC001164755542 721004426 /nfs/dbraw/zinc/00/44/26/721004426.db2.gz AFKWJOBLEFHKKE-RNXOBYDBSA-N 1 1 442.563 3.455 20 0 IGADMO c1ccc(C[N@H+]2CCc3nc(N4C[C@H](OCc5cccnc5)[C@H]5COC[C@H]54)ccc3C2)cc1 ZINC001164755541 721004602 /nfs/dbraw/zinc/00/46/02/721004602.db2.gz AFKWJOBLEFHKKE-DMDYGQEQSA-N 1 1 442.563 3.455 20 0 IGADMO c1[nH]c2ccccc2c1-c1ccnc(N2CC[N@H+]3C[C@H](OCc4cccnc4)C[C@@H]3C2)n1 ZINC001164866917 721084313 /nfs/dbraw/zinc/08/43/13/721084313.db2.gz UZZDQJOTUCTPKS-WOJBJXKFSA-N 1 1 426.524 3.500 20 0 IGADMO CCOc1cc2ncnc(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@@H]4C3)c2cc1OCC ZINC001164866937 721089984 /nfs/dbraw/zinc/08/99/84/721089984.db2.gz VGVTYOGEGONCKS-WOJBJXKFSA-N 1 1 449.555 3.302 20 0 IGADMO COc1cccc2nc(Cl)nc(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@H]4C3)c21 ZINC001164866192 721097292 /nfs/dbraw/zinc/09/72/92/721097292.db2.gz RUEYRKTWXARRMP-IRXDYDNUSA-N 1 1 425.920 3.167 20 0 IGADMO Cn1cc(C[N@@H+]2CC[C@H]3CN(c4ccc5c(n4)CCN(Cc4ccccc4)C5)C[C@@H]3C2)cn1 ZINC001164769927 721104668 /nfs/dbraw/zinc/10/46/68/721104668.db2.gz QHBLZCMZGCLGTG-ZCYQVOJMSA-N 1 1 442.611 3.332 20 0 IGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4ccc5c(n4)CCN(Cc4ccccc4)C5)C[C@@H]3C2)cn1 ZINC001164769927 721104671 /nfs/dbraw/zinc/10/46/71/721104671.db2.gz QHBLZCMZGCLGTG-ZCYQVOJMSA-N 1 1 442.611 3.332 20 0 IGADMO COc1cccc(Oc2cncc(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@@H]4C3)n2)c1 ZINC001164865438 721115697 /nfs/dbraw/zinc/11/56/97/721115697.db2.gz LIVCORMLIBVJBK-DENIHFKCSA-N 1 1 433.512 3.152 20 0 IGADMO O=C(OCc1ccccc1)c1ccc(N2CC[N@H+]3C[C@@H](OCc4cccnc4)C[C@H]3C2)nc1 ZINC001164871104 721157493 /nfs/dbraw/zinc/15/74/93/721157493.db2.gz DRFMRZANGYRYOT-ZEQRLZLVSA-N 1 1 444.535 3.313 20 0 IGADMO COc1ccc(-c2ccc(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@H]4C3)nn2)c(OC)c1 ZINC001164879109 721161931 /nfs/dbraw/zinc/16/19/31/721161931.db2.gz RTSRKVBWWNGCIH-PZJWPPBQSA-N 1 1 447.539 3.036 20 0 IGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4cncc(OCc5cccc(Cl)c5)n4)C[C@@H]3C2)cn1 ZINC001164767895 721237317 /nfs/dbraw/zinc/23/73/17/721237317.db2.gz WYOCBRJFWYPFBV-PMACEKPBSA-N 1 1 438.963 3.401 20 0 IGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2C[C@@H]3COC[C@H](C(=O)NCc4ccco4)[C@H]3C2)nc1 ZINC001164763933 721257573 /nfs/dbraw/zinc/25/75/73/721257573.db2.gz OCNXPAXMQRKZLP-YPIGPJMWSA-N 1 1 438.572 3.237 20 0 IGADMO CN(C)C(=O)C[N@H+]1CCOCC2(CCN(c3nc(Cl)ccc3-c3ccccc3)CC2)C1 ZINC001164869388 721272247 /nfs/dbraw/zinc/27/22/47/721272247.db2.gz NCNVFGXSICZIIS-UHFFFAOYSA-N 1 1 442.991 3.409 20 0 IGADMO CN(C)C(=O)C[N@H+]1CCOCC2(CCN(c3cc(F)cc4ccc(Cl)nc43)CC2)C1 ZINC001164869904 721274140 /nfs/dbraw/zinc/27/41/40/721274140.db2.gz TYARSJROHRLWGQ-UHFFFAOYSA-N 1 1 434.943 3.034 20 0 IGADMO CN(C)C(=O)C[N@H+]1CCOCC2(CCN(c3nc(Cl)cc4cccc(F)c43)CC2)C1 ZINC001164873839 721294399 /nfs/dbraw/zinc/29/43/99/721294399.db2.gz BPTRAJOQKMKSDJ-UHFFFAOYSA-N 1 1 434.943 3.034 20 0 IGADMO O=S(=O)(Nc1cc(F)ccc1F)c1ccc(N2CC3(C2)CC[N@@H+](CC2CC2)C3)nc1 ZINC001164770744 721300484 /nfs/dbraw/zinc/30/04/84/721300484.db2.gz VDUASWFXXKHICP-UHFFFAOYSA-N 1 1 434.512 3.083 20 0 IGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2C[C@@H]3CN(S(=O)(=O)c4ccccc4)C[C@H]3C2)nc1 ZINC001164877322 721309560 /nfs/dbraw/zinc/30/95/60/721309560.db2.gz IKGZPEXRIUDCNV-MQSCRBSSSA-N 1 1 440.613 3.385 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@@]2(CCCN(c3ccc(N4CCCCC4)nn3)C2)C1 ZINC001164777996 721332086 /nfs/dbraw/zinc/33/20/86/721332086.db2.gz RYRUELXJRABTTJ-DEOSSOPVSA-N 1 1 440.592 3.191 20 0 IGADMO COC(=O)c1cnc(Cl)cc1N1CCC[C@]2(C1)COCC[N@H+](Cc1c(C)noc1C)C2 ZINC001164778570 721333613 /nfs/dbraw/zinc/33/36/13/721333613.db2.gz XKVYGIIQZYGFOV-QFIPXVFZSA-N 1 1 448.951 3.245 20 0 IGADMO COC(=O)c1cnc(Cl)cc1N1CCC[C@]2(C1)COCC[N@@H+](Cc1c(C)noc1C)C2 ZINC001164778570 721333616 /nfs/dbraw/zinc/33/36/16/721333616.db2.gz XKVYGIIQZYGFOV-QFIPXVFZSA-N 1 1 448.951 3.245 20 0 IGADMO CCOC(=O)c1cc(C)cc(N2CCC[C@@]3(C2)COCC[N@@H+](Cc2c(C)noc2C)C3)n1 ZINC001164778207 721339210 /nfs/dbraw/zinc/33/92/10/721339210.db2.gz KZCYNPRIHCIDRC-XMMPIXPASA-N 1 1 442.560 3.291 20 0 IGADMO Cc1nc2nc(Cl)nc(N3CCC[C@@]4(C3)COCC[N@@H+](Cc3c(C)noc3C)C4)c2[nH]1 ZINC001164776835 721344255 /nfs/dbraw/zinc/34/42/55/721344255.db2.gz DEKQARRDISBOCR-OAQYLSRUSA-N 1 1 445.955 3.039 20 0 IGADMO COC(=O)c1c(C)cc(C)nc1N1CCC[C@@]2(C1)COCC[N@H+](Cc1c(C)noc1C)C2 ZINC001164777861 721349866 /nfs/dbraw/zinc/34/98/66/721349866.db2.gz JJZMBPMFSSRQIO-XMMPIXPASA-N 1 1 442.560 3.209 20 0 IGADMO COC(=O)c1c(C)cc(C)nc1N1CCC[C@@]2(C1)COCC[N@@H+](Cc1c(C)noc1C)C2 ZINC001164777861 721349870 /nfs/dbraw/zinc/34/98/70/721349870.db2.gz JJZMBPMFSSRQIO-XMMPIXPASA-N 1 1 442.560 3.209 20 0 IGADMO COc1cccc2cnc(N3CCC[C@@]4(C3)COCC[N@H+](Cc3c(C)noc3C)C4)nc21 ZINC001164777436 721352049 /nfs/dbraw/zinc/35/20/49/721352049.db2.gz GZGGHQLZMHQLAM-XMMPIXPASA-N 1 1 437.544 3.362 20 0 IGADMO COc1cccc2cnc(N3CCC[C@@]4(C3)COCC[N@@H+](Cc3c(C)noc3C)C4)nc21 ZINC001164777436 721352054 /nfs/dbraw/zinc/35/20/54/721352054.db2.gz GZGGHQLZMHQLAM-XMMPIXPASA-N 1 1 437.544 3.362 20 0 IGADMO CCOc1c(Cl)ncnc1N1CCC[C@]2(C1)COCC[N@H+](Cc1c(C)noc1C)C2 ZINC001164780011 721353215 /nfs/dbraw/zinc/35/32/15/721353215.db2.gz YHEDHLQDHZOQBW-NRFANRHFSA-N 1 1 435.956 3.253 20 0 IGADMO CCOc1c(Cl)ncnc1N1CCC[C@]2(C1)COCC[N@@H+](Cc1c(C)noc1C)C2 ZINC001164780011 721353218 /nfs/dbraw/zinc/35/32/18/721353218.db2.gz YHEDHLQDHZOQBW-NRFANRHFSA-N 1 1 435.956 3.253 20 0 IGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@@]2(CCCN(c3cc(N4CCCCC4)ncn3)C2)C1 ZINC001164786071 721365076 /nfs/dbraw/zinc/36/50/76/721365076.db2.gz VTRDRCCLFWJJOP-DEOSSOPVSA-N 1 1 440.592 3.191 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@@]2(CCCN(c3cc(N4CCCCC4)ncn3)C2)C1 ZINC001164786071 721365083 /nfs/dbraw/zinc/36/50/83/721365083.db2.gz VTRDRCCLFWJJOP-DEOSSOPVSA-N 1 1 440.592 3.191 20 0 IGADMO C[NH+]1CCN(C[C@H]2CCC[C@@]3(CCN(c4nc(Cl)nc5[nH]cc(Cl)c54)C3)O2)CC1 ZINC001164884993 721381671 /nfs/dbraw/zinc/38/16/71/721381671.db2.gz BLDFVBCHNDQGJV-VLIAUNLRSA-N 1 1 439.391 3.030 20 0 IGADMO CCOC(=O)c1cnc(-c2cccs2)nc1N1C[C@H]2C[NH+](Cc3nccs3)C[C@@H]2C1 ZINC001164786854 721405767 /nfs/dbraw/zinc/40/57/67/721405767.db2.gz PHVGTXJGAUQNIZ-HUUCEWRRSA-N 1 1 441.582 3.407 20 0 IGADMO Cc1ccc2nc(N3CC[C@]4(C3)CCC[C@@H](CN3CC[NH+](C)CC3)O4)c(Cl)nc2c1 ZINC001164888939 721406835 /nfs/dbraw/zinc/40/68/35/721406835.db2.gz PPXXNKVIJOYHOZ-MBSDFSHPSA-N 1 1 429.996 3.357 20 0 IGADMO C[NH+]1CCN(C[C@@H]2CCC[C@]3(CCN(C(F)(F)c4cnc(Cl)c(F)c4)C3)O2)CC1 ZINC001164885633 721407188 /nfs/dbraw/zinc/40/71/88/721407188.db2.gz GWGBKCSWFWIPPO-QFBILLFUSA-N 1 1 432.918 3.184 20 0 IGADMO C[NH+]1CCN(C[C@H]2CCC[C@@]3(CCN(C(F)(F)c4nc(Cl)ccc4F)C3)O2)CC1 ZINC001164885136 721409400 /nfs/dbraw/zinc/40/94/00/721409400.db2.gz FWUPUDRSKKNCDY-BEFAXECRSA-N 1 1 432.918 3.184 20 0 IGADMO CCOC(=O)c1c(Cl)nc(SC)nc1N1C[C@@H]2C[NH+](Cc3nccs3)C[C@H]2C1 ZINC001164784655 721410075 /nfs/dbraw/zinc/41/00/75/721410075.db2.gz KYBQFHGZMVIDDL-RYUDHWBXSA-N 1 1 439.994 3.053 20 0 IGADMO COc1cccc2nc(Cl)nc(N3CC[C@@]4(C3)CCC[C@@H](CN3CC[NH+](C)CC3)O4)c21 ZINC001164891936 721417077 /nfs/dbraw/zinc/41/70/77/721417077.db2.gz WTHUHPRRRFSOQN-GAJHUEQPSA-N 1 1 445.995 3.057 20 0 IGADMO Cc1nc2sc3c(c2c(N2CC[C@]4(C2)CCC[C@@H](CN2CC[NH+](C)CC2)O4)n1)CCC3 ZINC001164895803 721433543 /nfs/dbraw/zinc/43/35/43/721433543.db2.gz PQUGDGGQSABMLZ-UUOWRZLLSA-N 1 1 441.645 3.254 20 0 IGADMO Cn1cnc2c1[C@@H](COCc1cccnc1)N(c1cc(OC3CC[NH+](C)CC3)ccn1)CC2 ZINC001164780447 721442437 /nfs/dbraw/zinc/44/24/37/721442437.db2.gz AJYGNBDZDIIRIO-HSZRJFAPSA-N 1 1 448.571 3.004 20 0 IGADMO Cc1cc(-c2cccc(F)c2)nnc1N1CC[C@]2(C1)CCC[C@H](CN1CC[NH+](C)CC1)O2 ZINC001164886569 721447647 /nfs/dbraw/zinc/44/76/47/721447647.db2.gz HHHVJGYZQMRJSG-RDGATRHJSA-N 1 1 439.579 3.357 20 0 IGADMO CSc1ccc2ncnc(N3CC[C@@]4(C3)CCC[C@@H](CN3CC[NH+](C)CC3)O4)c2c1 ZINC001164886523 721447795 /nfs/dbraw/zinc/44/77/95/721447795.db2.gz GYJSWKWUEBLNJP-FDDCHVKYSA-N 1 1 427.618 3.117 20 0 IGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1ncnc3nc(Cl)ccc31)CC2 ZINC001164783623 721453338 /nfs/dbraw/zinc/45/33/38/721453338.db2.gz CLMCZHKDWSSFTC-SFHVURJKSA-N 1 1 445.995 3.412 20 0 IGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1nc3ccccc3nc1OC)CC2 ZINC001164783541 721454883 /nfs/dbraw/zinc/45/48/83/721454883.db2.gz CGPXHBNRELYOCF-HXUWFJFHSA-N 1 1 440.588 3.372 20 0 IGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1cnc(-c3ccco3)cn1)CC2 ZINC001164784732 721457838 /nfs/dbraw/zinc/45/78/38/721457838.db2.gz JYCIHJOEMVTSCG-FQEVSTJZSA-N 1 1 426.561 3.471 20 0 IGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1c(C)nc(Cl)nc1OC)CC2 ZINC001164784484 721460006 /nfs/dbraw/zinc/46/00/06/721460006.db2.gz IISSZCQWQPLFIL-SFHVURJKSA-N 1 1 439.000 3.181 20 0 IGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1ccc3nc(C)n(C)c3n1)CC2 ZINC001164784003 721460036 /nfs/dbraw/zinc/46/00/36/721460036.db2.gz GQACWNMPPOOLOT-FQEVSTJZSA-N 1 1 427.593 3.011 20 0 IGADMO C[N@H+](Cc1ccncc1)C1CC2(C1)CCN(c1nc(Cl)ccc1S(C)(=O)=O)CC2 ZINC001164796787 721499563 /nfs/dbraw/zinc/49/95/63/721499563.db2.gz XRLDXAYWRSVETP-UHFFFAOYSA-N 1 1 434.993 3.415 20 0 IGADMO C[N@@H+](Cc1ccncc1)C1CC2(C1)CCN(c1nc(Cl)ccc1S(C)(=O)=O)CC2 ZINC001164796787 721499564 /nfs/dbraw/zinc/49/95/64/721499564.db2.gz XRLDXAYWRSVETP-UHFFFAOYSA-N 1 1 434.993 3.415 20 0 IGADMO CCOC(=O)c1cnc(N2CC[N@H+]3C[C@@H](Oc4cccc(F)c4)C[C@@H]3C2)cc1OCC ZINC001164911281 721532164 /nfs/dbraw/zinc/53/21/64/721532164.db2.gz VYHRSJYHRKNWLA-MJGOQNOKSA-N 1 1 429.492 3.138 20 0 IGADMO CCOC(=O)c1c(C)cc(Cl)nc1N1C[C@H]([N@H+](C)Cc2cccnc2)[C@@H]2OCCC[C@H]21 ZINC001164801534 721543731 /nfs/dbraw/zinc/54/37/31/721543731.db2.gz FOIWUCUBPQKYHG-LVCYWYKZSA-N 1 1 444.963 3.483 20 0 IGADMO CCOC(=O)c1c(C)cc(Cl)nc1N1C[C@H]([N@@H+](C)Cc2cccnc2)[C@@H]2OCCC[C@H]21 ZINC001164801534 721543732 /nfs/dbraw/zinc/54/37/32/721543732.db2.gz FOIWUCUBPQKYHG-LVCYWYKZSA-N 1 1 444.963 3.483 20 0 IGADMO COC(=O)/C=C/c1cc2cc[nH]c2c(N2CC[N@H+]3C[C@H](Oc4cccc(F)c4)C[C@H]3C2)n1 ZINC001164908656 721547703 /nfs/dbraw/zinc/54/77/03/721547703.db2.gz QBJPSSVRAACBSV-FZUCFXCGSA-N 1 1 436.487 3.230 20 0 IGADMO CCOC(=O)c1cc2ccnc(N3C[C@H]([N@@H+](C)Cc4cccnc4)[C@H]4OCCC[C@@H]43)c2[nH]1 ZINC001164803062 721547734 /nfs/dbraw/zinc/54/77/34/721547734.db2.gz HQFDKIOYRDHLNY-ONTIZHBOSA-N 1 1 435.528 3.003 20 0 IGADMO COC(=O)/C=C\c1cc2cc[nH]c2c(N2CC[N@H+]3C[C@H](Oc4cccc(F)c4)C[C@H]3C2)n1 ZINC001164908661 721547808 /nfs/dbraw/zinc/54/78/08/721547808.db2.gz QBJPSSVRAACBSV-LJQWKTEUSA-N 1 1 436.487 3.230 20 0 IGADMO COc1nc(Cl)ncc1C(F)(F)N1CC[N@H+]2C[C@H](Oc3cccc(F)c3)C[C@@H]2C1 ZINC001164902674 721549557 /nfs/dbraw/zinc/54/95/57/721549557.db2.gz AWNSGBYMHMJIRZ-UKRRQHHQSA-N 1 1 428.842 3.165 20 0 IGADMO CCOC(=O)c1cnc(N2C[C@H]([N@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@@H]32)c(Cl)c1 ZINC001164800714 721557343 /nfs/dbraw/zinc/55/73/43/721557343.db2.gz FNNRGDBYMWCVKR-SLFFLAALSA-N 1 1 430.936 3.175 20 0 IGADMO CCOC(=O)c1cnc(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@@H]32)c(Cl)c1 ZINC001164800714 721557346 /nfs/dbraw/zinc/55/73/46/721557346.db2.gz FNNRGDBYMWCVKR-SLFFLAALSA-N 1 1 430.936 3.175 20 0 IGADMO CCOC(=O)c1cnc(Cl)c(C)c1N1C[C@H]([N@@H+](C)Cc2cccnc2)[C@@H]2OCCC[C@H]21 ZINC001164798122 721559752 /nfs/dbraw/zinc/55/97/52/721559752.db2.gz AHNRVQULRPIVRB-SVFBPWRDSA-N 1 1 444.963 3.483 20 0 IGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2cc(OCc3ccccc3)cnn2)[C@@H]2CCCO[C@@H]12 ZINC001164804027 721561743 /nfs/dbraw/zinc/56/17/43/721561743.db2.gz KSRVPUYIORUVGM-VDKIKQQVSA-N 1 1 431.540 3.319 20 0 IGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2cc(OCc3ccccc3)cnn2)[C@@H]2CCCO[C@@H]12 ZINC001164804027 721561745 /nfs/dbraw/zinc/56/17/45/721561745.db2.gz KSRVPUYIORUVGM-VDKIKQQVSA-N 1 1 431.540 3.319 20 0 IGADMO CCOC(=O)c1cnc2cc(N3C[C@H]([N@@H+](C)Cc4cccnc4)[C@H]4OCCC[C@@H]43)[nH]cc1-2 ZINC001164801179 721573492 /nfs/dbraw/zinc/57/34/92/721573492.db2.gz GJQIXASIRQKTNE-FUDKSRODSA-N 1 1 435.528 3.003 20 0 IGADMO CC1CCN(C(=O)c2cccnc2N2C[C@H]([N@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@H]32)CC1 ZINC001164801774 721576931 /nfs/dbraw/zinc/57/69/31/721576931.db2.gz HESJDPYGXNTARI-TZRRMPRUSA-N 1 1 449.599 3.217 20 0 IGADMO CC1CCN(C(=O)c2cccnc2N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@H]32)CC1 ZINC001164801774 721576935 /nfs/dbraw/zinc/57/69/35/721576935.db2.gz HESJDPYGXNTARI-TZRRMPRUSA-N 1 1 449.599 3.217 20 0 IGADMO COc1ccc(-c2ccc(N3C[C@H]([N@H+](C)Cc4cccnc4)[C@@H]4OCCC[C@H]43)nn2)cc1 ZINC001164800735 721577169 /nfs/dbraw/zinc/57/71/69/721577169.db2.gz FODNHHIURZKTSU-GIFXNVAJSA-N 1 1 431.540 3.415 20 0 IGADMO COc1ccc(-c2ccc(N3C[C@H]([N@@H+](C)Cc4cccnc4)[C@@H]4OCCC[C@H]43)nn2)cc1 ZINC001164800735 721577170 /nfs/dbraw/zinc/57/71/70/721577170.db2.gz FODNHHIURZKTSU-GIFXNVAJSA-N 1 1 431.540 3.415 20 0 IGADMO COc1ccccc1-c1ccnc(N2C[C@H]([N@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@H]32)n1 ZINC001164800141 721581411 /nfs/dbraw/zinc/58/14/11/721581411.db2.gz CEKMLFYERPUZET-AOHZBQACSA-N 1 1 431.540 3.415 20 0 IGADMO COc1ccccc1-c1ccnc(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@H]32)n1 ZINC001164800141 721581413 /nfs/dbraw/zinc/58/14/13/721581413.db2.gz CEKMLFYERPUZET-AOHZBQACSA-N 1 1 431.540 3.415 20 0 IGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(C(F)(F)c2nc3ccc(Cl)nc3[nH]2)[C@@H]2CCCO[C@H]12 ZINC001164808346 721582421 /nfs/dbraw/zinc/58/24/21/721582421.db2.gz QUKZNNMJIXEXST-NUJGCVRESA-N 1 1 448.905 3.419 20 0 IGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(C(F)(F)c2nc3ccc(Cl)nc3[nH]2)[C@@H]2CCCO[C@H]12 ZINC001164808346 721582423 /nfs/dbraw/zinc/58/24/23/721582423.db2.gz QUKZNNMJIXEXST-NUJGCVRESA-N 1 1 448.905 3.419 20 0 IGADMO Cc1nc(-c2ccccn2)nc(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@H]3OCCC[C@@H]32)c1C ZINC001164802571 721585209 /nfs/dbraw/zinc/58/52/09/721585209.db2.gz GMKVJAPKSYFLDR-VABKMULXSA-N 1 1 430.556 3.419 20 0 IGADMO Cc1cc(Cl)nc(N2CCC(F)(F)[C@]3(CC[N@@H+](Cc4ccccn4)C3)C2)c1C(N)=O ZINC001164904171 721585607 /nfs/dbraw/zinc/58/56/07/721585607.db2.gz DMLYMVQYEJULOQ-FQEVSTJZSA-N 1 1 435.906 3.275 20 0 IGADMO FC1(F)CCN(c2ccc(CN3CCOCC3)cn2)C[C@@]12CC[N@@H+](Cc1ccccn1)C2 ZINC001164907908 721585621 /nfs/dbraw/zinc/58/56/21/721585621.db2.gz WHZZQZDSOIEMEC-QHCPKHFHSA-N 1 1 443.542 3.047 20 0 IGADMO COC(=O)c1cccc2nc(N3C[C@H]([N@@H+](C)Cc4cccnc4)[C@@H]4OCCC[C@H]43)ccc21 ZINC001164801869 721586040 /nfs/dbraw/zinc/58/60/40/721586040.db2.gz GAHPIODUJJMENJ-AOHZBQACSA-N 1 1 432.524 3.285 20 0 IGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2CC[C@@]3(C2)COCc2c(C)nc(N(C)C)nc23)nc1 ZINC001164799761 721606786 /nfs/dbraw/zinc/60/67/86/721606786.db2.gz BPEANRDCCBIODG-PXDATVDWSA-N 1 1 436.604 3.471 20 0 IGADMO CNC(=O)c1nc(N2CCC(F)(F)[C@]3(CC[N@@H+](Cc4ccccn4)C3)C2)ccc1Cl ZINC001164904154 721712689 /nfs/dbraw/zinc/71/26/89/721712689.db2.gz AHWQHFIXHXBKAG-FQEVSTJZSA-N 1 1 435.906 3.227 20 0 IGADMO O=C(c1ccnc(N2CCC(F)(F)[C@]3(CC[N@@H+](Cc4ccccn4)C3)C2)c1)N1CCCC1 ZINC001164906781 721716414 /nfs/dbraw/zinc/71/64/14/721716414.db2.gz ODQNKYQTKAYPFF-QHCPKHFHSA-N 1 1 441.526 3.450 20 0 IGADMO F[C@@H](Oc1cncc(Cl)n1)N1CCC(F)(F)[C@]2(CC[N@@H+](Cc3ccccn3)C2)C1 ZINC001164911239 721733118 /nfs/dbraw/zinc/73/31/18/721733118.db2.gz JFONKRGRPRILSH-MSOLQXFVSA-N 1 1 427.858 3.390 20 0 IGADMO CCOC(=O)c1ncnc(Cl)c1N1CCc2c(C[N@H+](C)Cc3ccco3)cncc2C1 ZINC001164908975 721759926 /nfs/dbraw/zinc/75/99/26/721759926.db2.gz ATNIBCRVBUVFOH-UHFFFAOYSA-N 1 1 441.919 3.489 20 0 IGADMO CCOC(=O)c1ncnc(Cl)c1N1CCc2c(C[N@@H+](C)Cc3ccco3)cncc2C1 ZINC001164908975 721759931 /nfs/dbraw/zinc/75/99/31/721759931.db2.gz ATNIBCRVBUVFOH-UHFFFAOYSA-N 1 1 441.919 3.489 20 0 IGADMO Cc1cccc2c(Cl)nnc(N3CCO[C@]4(C3)COCC[N@H+](Cc3cccnc3)C4)c12 ZINC001164914412 721781682 /nfs/dbraw/zinc/78/16/82/721781682.db2.gz CYSHRVMSUCVTLE-HSZRJFAPSA-N 1 1 439.947 3.094 20 0 IGADMO Cc1cccc2c(Cl)nnc(N3CCO[C@]4(C3)COCC[N@@H+](Cc3cccnc3)C4)c12 ZINC001164914412 721781685 /nfs/dbraw/zinc/78/16/85/721781685.db2.gz CYSHRVMSUCVTLE-HSZRJFAPSA-N 1 1 439.947 3.094 20 0 IGADMO Cc1sc2nc(C[NH+]3CCCC3)nc(N3C[C@@H]4CN(c5cccnc5)C(=O)[C@H]4C3)c2c1C ZINC001165022747 721792079 /nfs/dbraw/zinc/79/20/79/721792079.db2.gz OBVSJRMQBLCTBW-MJGOQNOKSA-N 1 1 448.596 3.398 20 0 IGADMO c1ccc(C[N@@H+]2CCc3c(ncnc3N3CC[C@@]4(C[C@H](Oc5cccnc5)CO4)C3)C2)cc1 ZINC001164916513 721805566 /nfs/dbraw/zinc/80/55/66/721805566.db2.gz PSGRHXHPMJBBOA-BKMJKUGQSA-N 1 1 443.551 3.247 20 0 IGADMO c1ccc(C[N@H+]2CCc3c(ncnc3N3CC[C@@]4(C[C@H](Oc5cccnc5)CO4)C3)C2)cc1 ZINC001164916513 721805567 /nfs/dbraw/zinc/80/55/67/721805567.db2.gz PSGRHXHPMJBBOA-BKMJKUGQSA-N 1 1 443.551 3.247 20 0 IGADMO C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@@H]2CN(c3nc(Cl)ncc3N3CCOCC3)C[C@H]21 ZINC001165028959 721813134 /nfs/dbraw/zinc/81/31/34/721813134.db2.gz YFDDFYAWPKLCGK-MISYRCLQSA-N 1 1 442.995 3.099 20 0 IGADMO CN1CCOc2c(Cl)nnc(N3C[C@@H]4CCC[C@@H]([N@@H+](C)Cc5ccccn5)[C@@H]4C3)c21 ZINC001165030167 721821392 /nfs/dbraw/zinc/82/13/92/721821392.db2.gz YDJZPNLCIUBPEF-CGTJXYLNSA-N 1 1 428.968 3.091 20 0 IGADMO CCOC(=O)c1ncnc(Cl)c1N1C[C@@H]2CCC[C@@H]([N@@H+](C)Cc3ccccn3)[C@H]2C1 ZINC001165023109 721821872 /nfs/dbraw/zinc/82/18/72/721821872.db2.gz HLFOAGASRMPSBW-RYQLBKOJSA-N 1 1 429.952 3.439 20 0 IGADMO COc1ccc2c[nH+]c(N3CCO[C@]4(C3)COCCN(Cc3csc(C)n3)C4)cc2c1 ZINC001164920455 721830521 /nfs/dbraw/zinc/83/05/21/721830521.db2.gz DTZHVZDFDDIFQO-HSZRJFAPSA-N 1 1 440.569 3.116 20 0 IGADMO CCNC(=O)c1cc(Cl)nc(N2C[C@@H]3CCC[C@H]([N@@H+](C)Cc4ccccn4)[C@@H]3C2)n1 ZINC001165029035 721832322 /nfs/dbraw/zinc/83/23/22/721832322.db2.gz WLMFRNZXXYMFIS-WDYCEAGBSA-N 1 1 428.968 3.012 20 0 IGADMO COc1cccc(OC)c1CN1CCC(N(C)c2cccc(N3CCOCC3)[nH+]2)CC1 ZINC001165020404 721842721 /nfs/dbraw/zinc/84/27/21/721842721.db2.gz DDYNIHJOSOBIKQ-UHFFFAOYSA-N 1 1 426.561 3.036 20 0 IGADMO COc1cccc(OC)c1C[NH+]1CCC(N(C)c2nc[nH]c3nc(=S)sc2-3)CC1 ZINC001165022042 721843092 /nfs/dbraw/zinc/84/30/92/721843092.db2.gz NUIGSOLYTBRDFR-UHFFFAOYSA-N 1 1 431.587 3.493 20 0 IGADMO Cc1ccc(C[N@H+]2CCOC3(CCN(c4nc(Cl)c(F)c5c4C(=O)NC5)CC3)C2)cc1 ZINC001164941039 721927163 /nfs/dbraw/zinc/92/71/63/721927163.db2.gz ZJRGZYOEVJLIJN-UHFFFAOYSA-N 1 1 444.938 3.297 20 0 IGADMO Cc1noc(C)c1CN1CCO[C@H]2CN(c3nc(Cl)ccc3C[NH+]3CCCC3)C[C@@H]21 ZINC001164940280 721948691 /nfs/dbraw/zinc/94/86/91/721948691.db2.gz AVQQKFOMEAORBH-PMACEKPBSA-N 1 1 431.968 3.025 20 0 IGADMO Cc1cc2nc(N3CC[NH+](CCOc4ccccc4)CC3)nc(N3CCOCC3)c2s1 ZINC001165044868 721957846 /nfs/dbraw/zinc/95/78/46/721957846.db2.gz POEIWDRKNLYFSZ-UHFFFAOYSA-N 1 1 439.585 3.037 20 0 IGADMO O=C1NCC[N@@H+](Cc2ccccc2)C12CCN(c1nc(Cl)nc3[nH]cc(Cl)c31)CC2 ZINC001164949327 721968740 /nfs/dbraw/zinc/96/87/40/721968740.db2.gz WUFVOEMRDYBILB-UHFFFAOYSA-N 1 1 445.354 3.236 20 0 IGADMO O=C1NCC[N@H+](Cc2ccccc2)C12CCN(c1nc(Cl)nc3[nH]cc(Cl)c31)CC2 ZINC001164949327 721968742 /nfs/dbraw/zinc/96/87/42/721968742.db2.gz WUFVOEMRDYBILB-UHFFFAOYSA-N 1 1 445.354 3.236 20 0 IGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2C[C@H](NC(=O)c3cscn3)[C@@H]3OCCC[C@H]32)nc1 ZINC001164950325 722001659 /nfs/dbraw/zinc/00/16/59/722001659.db2.gz HQVHTVQJTWCNMI-RYTRXMBJSA-N 1 1 441.601 3.251 20 0 IGADMO CC[NH+](CC)C1CCN(c2nccc(NC(=O)C(C)(C)C)c2CN2CC[C@@H](CO)C2)CC1 ZINC001165054127 722004650 /nfs/dbraw/zinc/00/46/50/722004650.db2.gz ZYBPLKFNLIDCHE-LJQANCHMSA-N 1 1 445.652 3.191 20 0 IGADMO CN(C)C(=O)N[C@@H]1CCO[C@@]2(CCN(c3ccc4c(n3)CC[N@H+](Cc3ccccc3)C4)C2)C1 ZINC001164954357 722008649 /nfs/dbraw/zinc/00/86/49/722008649.db2.gz LTDIALUJQJWGOP-GJZUVCINSA-N 1 1 449.599 3.039 20 0 IGADMO Clc1nc2c(c(N3CCC4(CC3)COCC[N@@H+](Cc3ccncc3)C4)n1)SCC2 ZINC001164964130 722054802 /nfs/dbraw/zinc/05/48/02/722054802.db2.gz RTDQXYLNCPTQAJ-UHFFFAOYSA-N 1 1 431.993 3.292 20 0 IGADMO CC(C)(C)NC(=O)c1ccc(N2CCC3(CC2)COCC[N@@H+](Cc2ccncc2)C3)nc1 ZINC001164963039 722056466 /nfs/dbraw/zinc/05/64/66/722056466.db2.gz GOHPXEPSIRFKLE-UHFFFAOYSA-N 1 1 437.588 3.124 20 0 IGADMO Nc1cc(C(F)(F)N2CCC3(CC2)COCC[N@@H+](Cc2ccncc2)C3)cnc1Cl ZINC001164959978 722059252 /nfs/dbraw/zinc/05/92/52/722059252.db2.gz BFQSZOJPYBKILU-UHFFFAOYSA-N 1 1 437.922 3.376 20 0 IGADMO CN(C)C(=O)N[C@@H]1c2ccccc2[C@H]2CN(c3cc(OC4CC[NH+](C)CC4)ccn3)C[C@@H]21 ZINC001164985730 722098219 /nfs/dbraw/zinc/09/82/19/722098219.db2.gz WJPWRAKKTDXXMB-AOHZBQACSA-N 1 1 435.572 3.101 20 0 IGADMO CCOC(=O)c1cc(Cl)nc(N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)c1 ZINC001164982844 722099524 /nfs/dbraw/zinc/09/95/24/722099524.db2.gz PJVARSORUXQIKZ-HKUYNNGSSA-N 1 1 430.936 3.034 20 0 IGADMO FC(F)(c1cnc(Cl)nc1Cl)N1CC[C@@H]2C[N@@H+](Cc3cccnc3)CCO[C@H]2C1 ZINC001164986408 722101347 /nfs/dbraw/zinc/10/13/47/722101347.db2.gz YXVROGVEOCTUSO-ZBFHGGJFSA-N 1 1 444.313 3.451 20 0 IGADMO FC(F)(c1nc(Cl)ncc1Cl)N1CC[C@@H]2C[N@@H+](Cc3cccnc3)CCO[C@@H]2C1 ZINC001164983879 722106956 /nfs/dbraw/zinc/10/69/56/722106956.db2.gz QVPICWBEIXZBQV-GDBMZVCRSA-N 1 1 444.313 3.451 20 0 IGADMO c1cncc(C[N@H+]2CCO[C@@H]3CN(c4nccnc4C4SCCCS4)CC[C@@H]3C2)c1 ZINC001164979771 722109115 /nfs/dbraw/zinc/10/91/15/722109115.db2.gz PVJBUINXICLJEC-RTBURBONSA-N 1 1 443.642 3.468 20 0 IGADMO COC(=O)c1ccc2c(ccnc2N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)c1 ZINC001164981128 722111004 /nfs/dbraw/zinc/11/10/04/722111004.db2.gz SXGURVZVSKBJSJ-GMAHTHKFSA-N 1 1 432.524 3.144 20 0 IGADMO COC(=O)c1ccc2c(ccnc2N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)c1 ZINC001164981130 722111270 /nfs/dbraw/zinc/11/12/70/722111270.db2.gz SXGURVZVSKBJSJ-JTHBVZDNSA-N 1 1 432.524 3.144 20 0 IGADMO COc1cc2nc(C)nc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)c2cc1OC ZINC001164982473 722119185 /nfs/dbraw/zinc/11/91/85/722119185.db2.gz WQADPYMMFBUGRH-CYFREDJKSA-N 1 1 449.555 3.078 20 0 IGADMO c1ccc(COc2cnnc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)c2)cc1 ZINC001164982666 722125710 /nfs/dbraw/zinc/12/57/10/722125710.db2.gz XREBYSKMEQQDAP-ISKFKSNPSA-N 1 1 431.540 3.178 20 0 IGADMO FC(F)(COc1cccc(Cl)n1)N1CC[C@@H]2C[N@@H+](Cc3cccnc3)CCO[C@H]2C1 ZINC001164983077 722128226 /nfs/dbraw/zinc/12/82/26/722128226.db2.gz YAQCVSMLGBUYHE-MSOLQXFVSA-N 1 1 438.906 3.325 20 0 IGADMO c1ccc(COc2cnc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)cn2)cc1 ZINC001164984930 722133307 /nfs/dbraw/zinc/13/33/07/722133307.db2.gz YLFWGWCCMKDCJO-PKTZIBPZSA-N 1 1 431.540 3.178 20 0 IGADMO c1ccc2c(c1)CCc1cnc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)nc1-2 ZINC001164982282 722133944 /nfs/dbraw/zinc/13/39/44/722133944.db2.gz RNVYZQOSMSFYAI-ISKFKSNPSA-N 1 1 427.552 3.365 20 0 IGADMO CCc1cc2c(nc(Cl)nc2N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)[nH]1 ZINC001164979649 722136662 /nfs/dbraw/zinc/13/66/62/722136662.db2.gz LQDMBZWZIOPKIR-VQIMIIECSA-N 1 1 426.952 3.296 20 0 IGADMO COc1cccc(-c2ccc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)nn2)c1 ZINC001164983314 722141626 /nfs/dbraw/zinc/14/16/26/722141626.db2.gz TYLBEAXEHZUASK-ZJSXRUAMSA-N 1 1 431.540 3.275 20 0 IGADMO c1cncc(C[N@H+]2CCO[C@H]3CN(c4cc(-c5nc(C6CC6)no5)ccn4)CC[C@@H]3C2)c1 ZINC001164973928 722151650 /nfs/dbraw/zinc/15/16/50/722151650.db2.gz NNMXDPSPYZTHAQ-RTWAWAEBSA-N 1 1 432.528 3.131 20 0 IGADMO Fc1ccc2c(c1)[nH]c1ncnc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)c21 ZINC001164971060 722157894 /nfs/dbraw/zinc/15/78/94/722157894.db2.gz ACBHSUXZBADJME-UWJYYQICSA-N 1 1 432.503 3.373 20 0 IGADMO Fc1cccc(CN2CC[C@@]23CCCN(c2ccc(OCC4CC[NH2+]CC4)nn2)C3)c1 ZINC001164998802 722211724 /nfs/dbraw/zinc/21/17/24/722211724.db2.gz XZSLSOJEYIHXIP-XMMPIXPASA-N 1 1 425.552 3.239 20 0 IGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2CC[C@H](OCCOC)[C@H]2Cc2cnn(C)c2)nc1 ZINC001164998398 722224973 /nfs/dbraw/zinc/22/49/73/722224973.db2.gz BHBXFRLUIGMKFM-ZLNRFVROSA-N 1 1 427.593 3.215 20 0 IGADMO Cc1nc(-c2ccccc2)nc(Cl)c1N1CCc2ncnc(N3CC[NH+](C)CC3)c2CC1 ZINC001165001907 722238029 /nfs/dbraw/zinc/23/80/29/722238029.db2.gz OTILMKQFLBALQF-UHFFFAOYSA-N 1 1 449.990 3.252 20 0 IGADMO O=C(c1ccco1)N1CCC[C@]2(C1)CN(c1nc(Cl)ccc1C[NH+]1CCCC1)CCO2 ZINC001165000183 722249227 /nfs/dbraw/zinc/24/92/27/722249227.db2.gz FONUXAISGQRUJM-HSZRJFAPSA-N 1 1 444.963 3.435 20 0 IGADMO C[C@@H]1CCc2c(sc3nc(CN4CCCCC4)nc(N4C[C@@H]5OCC[N@@H+](C)[C@H]5C4)c23)C1 ZINC001164667891 719443401 /nfs/dbraw/zinc/44/34/01/719443401.db2.gz IEABGVWDSJKXAJ-NEWSRXKRSA-N 1 1 441.645 3.321 20 0 IGADMO O=C([C@@H]1C[C@@H]2OCC[C@@H]2N(c2ccc3c(n2)CC[N@H+](Cc2ccccc2)C3)C1)N1CCCC1 ZINC001164679229 719537146 /nfs/dbraw/zinc/53/71/46/719537146.db2.gz VZRPZQMEOQLXMD-VJTSUQJLSA-N 1 1 446.595 3.246 20 0 IGADMO CCOC(=O)c1c(Cl)c2ccccc2nc1N1CCC2(CCC[N@H+]2CC(=O)NC)CC1 ZINC001164689852 719739410 /nfs/dbraw/zinc/73/94/10/719739410.db2.gz MANYPULNPBTKQX-UHFFFAOYSA-N 1 1 444.963 3.246 20 0 IGADMO COC(=O)[C@@]1(C)C[C@H]([NH+]2CCOCC2)CCN1c1nc(Cl)nc2ccc(Cl)cc21 ZINC001164697332 719838723 /nfs/dbraw/zinc/83/87/23/719838723.db2.gz CRFJQMHNZXNNBM-JLTOFOAXSA-N 1 1 439.343 3.169 20 0 IGADMO COC(=O)[C@]1(C)C[C@H]([NH+]2CCOCC2)CCN1c1ncnc2sc3c(c21)CC[C@H](C)C3 ZINC001164701450 719853505 /nfs/dbraw/zinc/85/35/05/719853505.db2.gz KNSIPFDIFWRTRZ-PXAQALGRSA-N 1 1 444.601 3.049 20 0 IGADMO COC(=O)[C@]1(C)C[C@@H]([NH+]2CCOCC2)CCN1c1cc(F)ccc1-c1ccc(Cl)nn1 ZINC001164699199 719872343 /nfs/dbraw/zinc/87/23/43/719872343.db2.gz AXLRKQVLCBNXOF-AOMKIAJQSA-N 1 1 448.926 3.169 20 0 IGADMO CN1CCc2nc(Cl)nc(N3CCC4(CC3)C[N@@H+](Cc3cccs3)CCO4)c2C1 ZINC001164706303 719907741 /nfs/dbraw/zinc/90/77/41/719907741.db2.gz HJXSCUNARBFDPV-UHFFFAOYSA-N 1 1 434.009 3.051 20 0 IGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1ncccc1C(=O)NC1CCCCC1)C2 ZINC001164805886 720078104 /nfs/dbraw/zinc/07/81/04/720078104.db2.gz AIZFDISIJIQZAZ-CPJSRVTESA-N 1 1 426.605 3.329 20 0 IGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1ncccc1C(=O)NCc1ccccc1)C2 ZINC001164808455 720079814 /nfs/dbraw/zinc/07/98/14/720079814.db2.gz HKSJWVIZDICBAU-GJZUVCINSA-N 1 1 434.584 3.196 20 0 IGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(C(F)(F)c1cnc(Cl)cc1C(=O)OC)C2 ZINC001164810076 720102716 /nfs/dbraw/zinc/10/27/16/720102716.db2.gz JPHKCOHQMKMWAC-QRWLVFNGSA-N 1 1 443.922 3.251 20 0 IGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(C(F)(F)c1ccc(Cl)nc1C(=O)OC)C2 ZINC001164814991 720109653 /nfs/dbraw/zinc/10/96/53/720109653.db2.gz VCAYXZNGYZXRJO-QRWLVFNGSA-N 1 1 443.922 3.251 20 0 IGADMO COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1[nH]c3cc(=O)[nH]c-3cc1Cl)CC2 ZINC001164718106 720120283 /nfs/dbraw/zinc/12/02/83/720120283.db2.gz RRVPFJHAZSKTBY-QGZVFWFLSA-N 1 1 441.963 3.132 20 0 IGADMO CCOC(=O)c1cc(N2CCC3(C[C@@H](COC)[N@@H+](Cc4ccccn4)C3)CC2)ncc1C ZINC001164717380 720121339 /nfs/dbraw/zinc/12/13/39/720121339.db2.gz OCSPDZXCVKWQPB-NRFANRHFSA-N 1 1 438.572 3.469 20 0 IGADMO COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1cncc(N3CCCCC3)n1)CC2 ZINC001164714565 720129972 /nfs/dbraw/zinc/12/99/72/720129972.db2.gz XHSOGFNGEDEDAJ-JOCHJYFZSA-N 1 1 436.604 3.369 20 0 IGADMO COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1ncccc1-c1nc(C)no1)CC2 ZINC001164714026 720142404 /nfs/dbraw/zinc/14/24/04/720142404.db2.gz VLIIOVPANSINKP-HXUWFJFHSA-N 1 1 434.544 3.343 20 0 IGADMO COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN([C@@H](F)Oc1ccc(Cl)nn1)CC2 ZINC001164711900 720158063 /nfs/dbraw/zinc/15/80/63/720158063.db2.gz DJGIXCNKAMQLAE-YLJYHZDGSA-N 1 1 435.931 3.160 20 0 IGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1ncccc1C(=O)N1CCC(C)CC1)C2 ZINC001164820268 720167612 /nfs/dbraw/zinc/16/76/12/720167612.db2.gz ZWBPIVUNYPJRPD-PXDATVDWSA-N 1 1 426.605 3.138 20 0 IGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1ccc(-c3ccc4c(c3)OCCO4)nn1)C2 ZINC001164814429 720171851 /nfs/dbraw/zinc/17/18/51/720171851.db2.gz GLEMDDXYFKSMGN-CJFMBICVSA-N 1 1 436.556 3.100 20 0 IGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1cc(C)nc(NC(=O)c3ccccc3)n1)C2 ZINC001164818395 720189082 /nfs/dbraw/zinc/18/90/82/720189082.db2.gz SLYXDXDXLZWPRP-OFVILXPXSA-N 1 1 435.572 3.222 20 0 IGADMO CCC[N@H+]1CCCC[C@@H]1c1ccc(N2CC[C@@H]3O[C@H](COCC(=O)N(C)C)CC[C@@H]32)nc1 ZINC001164727240 720324408 /nfs/dbraw/zinc/32/44/08/720324408.db2.gz RVYGVSBIMASUNU-BJESRGMDSA-N 1 1 444.620 3.250 20 0 IGADMO CC(C)(C)C(=O)OCn1ccc2c1ncnc2N1CC[C@@H]2[C@H]1CC[N@H+]2Cc1cccnc1 ZINC001164727796 720385275 /nfs/dbraw/zinc/38/52/75/720385275.db2.gz RLFPSRBDTOFCOH-WOJBJXKFSA-N 1 1 434.544 3.226 20 0 IGADMO CC(C)NC(=O)C[C@@H]1COC[C@H]2CN(c3ccc4c(n3)CC[N@H+](Cc3ccccc3)C4)C[C@H]21 ZINC001164827068 720417754 /nfs/dbraw/zinc/41/77/54/720417754.db2.gz QSQFJHKNAFEMSX-SMIHKQSGSA-N 1 1 448.611 3.253 20 0 IGADMO COc1cc2ncc(N3CC[C@@H]4[C@@H](C[C@@H](Cn5cccn5)[N@H+]4C(C)C)C3)nc2cc1OC ZINC001164841434 720537406 /nfs/dbraw/zinc/53/74/06/720537406.db2.gz VUBRADZCXYRKDM-BBTUJRGHSA-N 1 1 436.560 3.221 20 0 IGADMO C[NH+]1CCC(Oc2ccnc(N3CCO[C@@]4(CCC[C@@H]4COc4ccccn4)C3)c2)CC1 ZINC001164734312 720542064 /nfs/dbraw/zinc/54/20/64/720542064.db2.gz HSYIAHKMKHVPTN-NLFFAJNJSA-N 1 1 438.572 3.404 20 0 IGADMO COc1nc(Cl)ncc1C(F)(F)N1CC[C@@H]2[C@@H](C[C@@H](Cn3cccn3)[N@H+]2C(C)C)C1 ZINC001164838769 720588666 /nfs/dbraw/zinc/58/86/66/720588666.db2.gz LPYXLLGAYVADFS-YQQAZPJKSA-N 1 1 440.926 3.258 20 0 IGADMO COC(=O)c1cc(Cl)c(N2CC[C@@H]3[C@H](C[C@@H](Cn4cccn4)[N@H+]3C(C)C)C2)nc1C ZINC001164840234 720638442 /nfs/dbraw/zinc/63/84/42/720638442.db2.gz PFOKWATWBPGEJR-FUHIMQAGSA-N 1 1 431.968 3.404 20 0 IGADMO C[N@H+](Cc1ccccc1)[C@H]1COC2(C1)CCN(c1nc(Cl)nc3c1CNCC3)CC2 ZINC001164839956 720659917 /nfs/dbraw/zinc/65/99/17/720659917.db2.gz LHVZKGGEAYXBNF-GOSISDBHSA-N 1 1 427.980 3.036 20 0 IGADMO C[N@@H+](Cc1ccccc1)[C@H]1COC2(C1)CCN(c1nc(Cl)nc3c1CNCC3)CC2 ZINC001164839956 720659921 /nfs/dbraw/zinc/65/99/21/720659921.db2.gz LHVZKGGEAYXBNF-GOSISDBHSA-N 1 1 427.980 3.036 20 0 IGADMO Clc1cc(OCc2ccccc2)cnc1N1CC[N@H+]2C[C@H](Oc3cncnc3)C[C@@H]2C1 ZINC001164745924 720744835 /nfs/dbraw/zinc/74/48/35/720744835.db2.gz WUXBJTIDIJOOIU-UYAOXDASSA-N 1 1 437.931 3.446 20 0 IGADMO c1cc(-c2nc3ccccc3c(N3CC[N@@H+]4C[C@@H](Oc5cncnc5)C[C@@H]4C3)n2)cs1 ZINC001164745384 720766562 /nfs/dbraw/zinc/76/65/62/720766562.db2.gz VNUDMFMOJPSLMW-MSOLQXFVSA-N 1 1 430.537 3.490 20 0 IGADMO Fc1ccc(-c2ccc(Cl)nn2)cc1N1CC[N@H+]2C[C@@H](Oc3cncnc3)C[C@H]2C1 ZINC001164737523 720781202 /nfs/dbraw/zinc/78/12/02/720781202.db2.gz CDLADTVAJNBBFO-HOTGVXAUSA-N 1 1 426.883 3.068 20 0 IGADMO Cc1ccc(Oc2nc(Cl)ncc2N2CC[N@H+]3C[C@H](Oc4cncnc4)C[C@H]3C2)cc1 ZINC001164742291 720802726 /nfs/dbraw/zinc/80/27/26/720802726.db2.gz CTKNNFCPVXSFTI-FUHWJXTLSA-N 1 1 438.919 3.363 20 0 IGADMO Cc1ccc(Oc2nc(Cl)ncc2N2CC[N@H+]3C[C@@H](Oc4cncnc4)C[C@H]3C2)cc1 ZINC001164742295 720802945 /nfs/dbraw/zinc/80/29/45/720802945.db2.gz CTKNNFCPVXSFTI-WMZOPIPTSA-N 1 1 438.919 3.363 20 0 IGADMO Clc1nnc(N2CC[C@@H]3[C@@H](C[C@@H](Cn4cncn4)[N@H+]3CC3CC3)C2)c2sccc21 ZINC001164737712 720818614 /nfs/dbraw/zinc/81/86/14/720818614.db2.gz CFHDUENENYXPNN-YQQAZPJKSA-N 1 1 429.981 3.316 20 0 IGADMO COc1cc2ccc(N3CC[C@@H]4[C@@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)nc2cc1OC ZINC001164751121 720835207 /nfs/dbraw/zinc/83/52/07/720835207.db2.gz YNKDVOKXZQXUPQ-TUNNFDKTSA-N 1 1 448.571 3.223 20 0 IGADMO Fc1cccc(Oc2cncc(N3CC[C@@H]4[C@@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)n2)c1 ZINC001164743693 720839628 /nfs/dbraw/zinc/83/96/28/720839628.db2.gz JUCHSEASFJEGSJ-RCZSKKKRSA-N 1 1 449.534 3.379 20 0 IGADMO c1ncn(C[C@@H]2C[C@@H]3CN(c4cnc(OCc5ccccc5)cn4)CC[C@H]3[N@@H+]2CC2CC2)n1 ZINC001164741263 720841246 /nfs/dbraw/zinc/84/12/46/720841246.db2.gz DWERNKSWSQKXSD-XPWALMASSA-N 1 1 445.571 3.027 20 0 IGADMO CC(C)(C)c1nc2[nH]ccc2c(N2CC[C@@H]3[C@H](C[C@@H](Cn4cncn4)[N@H+]3CC3CC3)C2)n1 ZINC001164741739 720842502 /nfs/dbraw/zinc/84/25/02/720842502.db2.gz FODSEMPPCVREES-WSTZPKSXSA-N 1 1 434.592 3.226 20 0 IGADMO COCC[N@H+]1CCO[C@@H]2CN(C(F)(F)c3nc(Cl)c4cccc(F)c4n3)CC[C@@H]2C1 ZINC001164855927 720842779 /nfs/dbraw/zinc/84/27/79/720842779.db2.gz VONYTTZUJYEEGN-CZUORRHYSA-N 1 1 444.885 3.141 20 0 IGADMO Cc1nc(C2CC2)nc(Cl)c1N1CC[C@@H]2[C@H](C[C@@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164747887 720850336 /nfs/dbraw/zinc/85/03/36/720850336.db2.gz RYDMKRMXJQYVAM-CEXWTWQISA-N 1 1 427.984 3.287 20 0 IGADMO c1ncn(C[C@@H]2C[C@H]3CN(c4ccnc(Cc5ccccc5)n4)CC[C@H]3[N@H+]2CC2CC2)n1 ZINC001164753105 720851823 /nfs/dbraw/zinc/85/18/23/720851823.db2.gz WUCOBMGAVCESSG-RJGXRXQPSA-N 1 1 429.572 3.038 20 0 IGADMO Cc1nc(-c2ccccn2)nc(N2CC[C@@H]3[C@@H](C[C@@H](Cn4cncn4)[N@H+]3CC3CC3)C2)c1C ZINC001164752684 720852722 /nfs/dbraw/zinc/85/27/22/720852722.db2.gz UGIGPAWMQOUFFJ-QNWVGRARSA-N 1 1 444.587 3.126 20 0 IGADMO Cc1nc(-c2ccncc2)nc(N2CC[C@@H]3[C@H](C[C@@H](Cn4cncn4)[N@H+]3CC3CC3)C2)c1C ZINC001164745538 720852815 /nfs/dbraw/zinc/85/28/15/720852815.db2.gz DXDOJETWNPHVQX-XPWALMASSA-N 1 1 444.587 3.126 20 0 IGADMO c1ncn(C[C@@H]2C[C@H]3CN(c4nccnc4Oc4ccccc4)CC[C@H]3[N@H+]2CC2CC2)n1 ZINC001164751166 720853936 /nfs/dbraw/zinc/85/39/36/720853936.db2.gz QMWQWBZPBRWIOY-JAXLGGSGSA-N 1 1 431.544 3.240 20 0 IGADMO COc1cc2nc(N3CC[C@@H]4[C@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)ccc2c(OC)c1 ZINC001164752632 720856726 /nfs/dbraw/zinc/85/67/26/720856726.db2.gz TZKMJDSAWQBDKC-DNVFCKCGSA-N 1 1 448.571 3.223 20 0 IGADMO CSc1ccc2ncnc(N3CC[C@@H]4[C@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)c2c1 ZINC001164748094 720856772 /nfs/dbraw/zinc/85/67/72/720856772.db2.gz JTFFDIKNKXDPRT-JBYIUTFZSA-N 1 1 435.601 3.323 20 0 IGADMO Fc1ccc(-c2cncc(N3CC[C@@H]4[C@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)n2)cc1 ZINC001164750286 720857518 /nfs/dbraw/zinc/85/75/18/720857518.db2.gz PHFLSYJLDODYAB-UNWVZKJWSA-N 1 1 433.535 3.254 20 0 IGADMO Fc1ccc2c(Cl)ncnc2c1N1CC[C@@H]2[C@H](C[C@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164746150 720860319 /nfs/dbraw/zinc/86/03/19/720860319.db2.gz GCODIIGMIWAUPX-GPMSIDNRSA-N 1 1 441.942 3.393 20 0 IGADMO Fc1ccc2c(Cl)ncnc2c1N1CC[C@@H]2[C@H](C[C@@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164746153 720860420 /nfs/dbraw/zinc/86/04/20/720860420.db2.gz GCODIIGMIWAUPX-JTDSTZFVSA-N 1 1 441.942 3.393 20 0 IGADMO CSc1ccnc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@H]3COCc2cccnc2)n1 ZINC001164750542 720876470 /nfs/dbraw/zinc/87/64/70/720876470.db2.gz JGWHZOLSGBVHAB-REWPJTCUSA-N 1 1 425.602 3.349 20 0 IGADMO COc1cnnc(Cl)c1N1CC[C@@]2(C1)C[N@@H+](CC1CC1)C[C@@H]2COCc1cccnc1 ZINC001164757122 720888302 /nfs/dbraw/zinc/88/83/02/720888302.db2.gz SQDGKEGGOGBPQX-XXBNENTESA-N 1 1 443.979 3.289 20 0 IGADMO COCC[N@H+]1CCO[C@H]2CN(c3cnc(Cl)nc3Oc3cccc(OC)c3)CC[C@@H]2C1 ZINC001164862159 720889648 /nfs/dbraw/zinc/88/96/48/720889648.db2.gz QWPMXOHCXMFUOI-UZLBHIALSA-N 1 1 448.951 3.104 20 0 IGADMO Nc1cnc(N2CC[C@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COCc2cccnc2)c(Cl)c1 ZINC001164758491 720891304 /nfs/dbraw/zinc/89/13/04/720891304.db2.gz YOXBTPZHJRUZLC-AUSIDOKSSA-N 1 1 427.980 3.467 20 0 IGADMO c1cncc(COC[C@H]2C[N@H+](CC3CC3)C[C@@]23CCN(c2cc(OCC4CC4)ncn2)C3)c1 ZINC001164755714 720895327 /nfs/dbraw/zinc/89/53/27/720895327.db2.gz NBVWHMPNUFYNCC-ZEQKJWHPSA-N 1 1 449.599 3.416 20 0 IGADMO CSc1ccc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COCc2cccnc2)nn1 ZINC001164747251 720910849 /nfs/dbraw/zinc/91/08/49/720910849.db2.gz CJAAAACJEXWTPI-OFNKIYASSA-N 1 1 425.602 3.349 20 0 IGADMO CC(C)N1Cc2c(nc(Cl)nc2N2CCn3c(C[N@@H+](C)C(C)C)cnc3[C@@H]2C)C1=O ZINC001164863367 720993878 /nfs/dbraw/zinc/99/38/78/720993878.db2.gz UTGBPBWQMLGWPV-AWEZNQCLSA-N 1 1 431.972 3.112 20 0 IGADMO COC(=O)c1cc2c(nc(Cl)nc2N2CCn3c(C[N@@H+](C)C(C)C)cnc3[C@@H]2C)n1C ZINC001164861949 720996228 /nfs/dbraw/zinc/99/62/28/720996228.db2.gz ROTLKYABEQYYIN-ZDUSSCGKSA-N 1 1 445.955 3.026 20 0 IGADMO c1ccc(C[N@H+]2CCc3nc(N4C[C@H](OCc5cccnc5)[C@@H]5COC[C@H]54)ccc3C2)cc1 ZINC001164755540 721004286 /nfs/dbraw/zinc/00/42/86/721004286.db2.gz AFKWJOBLEFHKKE-ARMFNRFLSA-N 1 1 442.563 3.455 20 0 IGADMO CCOC(=O)c1ccnc(N2CCn3c(C[N@@H+](C)C(C)C)cnc3[C@H]2C)c1C(=O)OCC ZINC001164861426 721022111 /nfs/dbraw/zinc/02/21/11/721022111.db2.gz OLNKNMCXFWJHPN-MRXNPFEDSA-N 1 1 443.548 3.053 20 0 IGADMO CSc1nc(Cl)cc(C(F)(F)N2CC[N@H+]3C[C@H](OCc4cccnc4)C[C@@H]3C2)n1 ZINC001164866592 721051952 /nfs/dbraw/zinc/05/19/52/721051952.db2.gz FSYAPHDINUKXQX-HUUCEWRRSA-N 1 1 441.935 3.272 20 0 IGADMO c1cn(Cc2ccccc2)c2ncnc(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@H]4C3)c12 ZINC001164866333 721099671 /nfs/dbraw/zinc/09/96/71/721099671.db2.gz SFLQFUXTWBGADR-XZOQPEGZSA-N 1 1 440.551 3.354 20 0 IGADMO CCN(CC)C(=O)c1cc(Cl)nc(N2CC[N@H+]3C[C@H](OCc4cccnc4)C[C@H]3C2)c1 ZINC001164867222 721100863 /nfs/dbraw/zinc/10/08/63/721100863.db2.gz XAZYTGVYQRQDBJ-VQTJNVASSA-N 1 1 443.979 3.092 20 0 IGADMO CC(C)(C)OC(=O)Nc1ccc(N2CC[N@H+]3C[C@H](OCc4cccnc4)C[C@@H]3C2)nc1 ZINC001164873612 721134163 /nfs/dbraw/zinc/13/41/63/721134163.db2.gz IYVINUVDWGGSQR-WOJBJXKFSA-N 1 1 425.533 3.303 20 0 IGADMO CCOc1cc2ncnc(N3C[C@H]4CC[N@@H+](Cc5cnn(C)c5)C[C@@H]4C3)c2cc1OCC ZINC001164763394 721135093 /nfs/dbraw/zinc/13/50/93/721135093.db2.gz FLKCUZKMUOKLTO-RTBURBONSA-N 1 1 436.560 3.119 20 0 IGADMO Clc1nc2c(Cl)nccc2c(N2CC[N@H+]3C[C@H](OCc4cccnc4)C[C@@H]3C2)n1 ZINC001164871036 721135829 /nfs/dbraw/zinc/13/58/29/721135829.db2.gz DARPSMGLARGFJO-HUUCEWRRSA-N 1 1 431.327 3.206 20 0 IGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4nc(Cl)ncc4OCc4ccccc4)C[C@@H]3C2)cn1 ZINC001164765601 721140269 /nfs/dbraw/zinc/14/02/69/721140269.db2.gz JNNUIPNDBFSLOU-PMACEKPBSA-N 1 1 438.963 3.401 20 0 IGADMO Cc1ccc(-c2nc3c(ncnc3N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@@H]4C3)o2)cc1 ZINC001164871090 721153011 /nfs/dbraw/zinc/15/30/11/721153011.db2.gz DMUKKINMCNSPOD-NHCUHLMSSA-N 1 1 442.523 3.468 20 0 IGADMO Cc1cc(OCc2ccccc2)nc(N2CC[N@H+]3C[C@@H](OCc4cccnc4)C[C@H]3C2)n1 ZINC001164880427 721173088 /nfs/dbraw/zinc/17/30/88/721173088.db2.gz WNJQVRHKFATDBB-GOTSBHOMSA-N 1 1 431.540 3.239 20 0 IGADMO Cc1cc(N2CC[N@H+]3C[C@@H](OCc4cccnc4)C[C@@H]3C2)nc(-c2ccc(Cl)nc2)n1 ZINC001164877046 721175285 /nfs/dbraw/zinc/17/52/85/721175285.db2.gz OFWUGEKPKRWVMH-UXHICEINSA-N 1 1 436.947 3.375 20 0 IGADMO Cn1cc(C[N@H+]2CC[C@H]3CN(c4nc(-c5cccnc5)nc5ccccc54)C[C@@H]3C2)cn1 ZINC001164772333 721194661 /nfs/dbraw/zinc/19/46/61/721194661.db2.gz SGOMHSSNJWNIGO-SFTDATJTSA-N 1 1 425.540 3.384 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@]2(CCCN(c3ncc(C)c(NC(C)C)n3)C2)C1 ZINC001164777364 721330201 /nfs/dbraw/zinc/33/02/01/721330201.db2.gz MMFUWBJQYFPCFY-HSZRJFAPSA-N 1 1 428.581 3.329 20 0 IGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@]2(CCCN(c3ncc(C)c(NC(C)C)n3)C2)C1 ZINC001164777364 721330204 /nfs/dbraw/zinc/33/02/04/721330204.db2.gz MMFUWBJQYFPCFY-HSZRJFAPSA-N 1 1 428.581 3.329 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@]2(CCCN(c3nc(Cl)nc4cc[nH]c43)C2)C1 ZINC001164776590 721331119 /nfs/dbraw/zinc/33/11/19/721331119.db2.gz GQSWXJOALYAEDB-OAQYLSRUSA-N 1 1 430.940 3.335 20 0 IGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@]2(CCCN(C(F)(F)c3nccc(Cl)n3)C2)C1 ZINC001164777349 721337436 /nfs/dbraw/zinc/33/74/36/721337436.db2.gz MEYBRDLRJIZXTD-LJQANCHMSA-N 1 1 441.910 3.399 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@]2(CCCN(C(F)(F)c3nccc(Cl)n3)C2)C1 ZINC001164777349 721337437 /nfs/dbraw/zinc/33/74/37/721337437.db2.gz MEYBRDLRJIZXTD-LJQANCHMSA-N 1 1 441.910 3.399 20 0 IGADMO C=C(OCC)c1ccc(N2CCC[C@@]3(C2)COCC[N@H+](Cc2c(C)noc2C)C3)nn1 ZINC001164779362 721350226 /nfs/dbraw/zinc/35/02/26/721350226.db2.gz SORAXDTXNXNVGX-HSZRJFAPSA-N 1 1 427.549 3.208 20 0 IGADMO C=C(OCC)c1ccc(N2CCC[C@@]3(C2)COCC[N@@H+](Cc2c(C)noc2C)C3)nn1 ZINC001164779362 721350228 /nfs/dbraw/zinc/35/02/28/721350228.db2.gz SORAXDTXNXNVGX-HSZRJFAPSA-N 1 1 427.549 3.208 20 0 IGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@]2(CCCN(c3cncc(N4CCCCC4)n3)C2)C1 ZINC001164786052 721360648 /nfs/dbraw/zinc/36/06/48/721360648.db2.gz VDUNFWWSEYUCDV-XMMPIXPASA-N 1 1 440.592 3.191 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@]2(CCCN(c3cncc(N4CCCCC4)n3)C2)C1 ZINC001164786052 721360652 /nfs/dbraw/zinc/36/06/52/721360652.db2.gz VDUNFWWSEYUCDV-XMMPIXPASA-N 1 1 440.592 3.191 20 0 IGADMO COC(OC)c1cc(C)cnc1N1CCC[C@@]2(C1)COCC[N@H+](Cc1c(C)noc1C)C2 ZINC001164779981 721361630 /nfs/dbraw/zinc/36/16/30/721361630.db2.gz BSXSUCRIDMNJGN-XMMPIXPASA-N 1 1 444.576 3.405 20 0 IGADMO COC(OC)c1cc(C)cnc1N1CCC[C@@]2(C1)COCC[N@@H+](Cc1c(C)noc1C)C2 ZINC001164779981 721361631 /nfs/dbraw/zinc/36/16/31/721361631.db2.gz BSXSUCRIDMNJGN-XMMPIXPASA-N 1 1 444.576 3.405 20 0 IGADMO C[NH+]1CCN(C[C@@H]2CCC[C@@]3(CCN(c4nc(Cl)nc5cccc(F)c54)C3)O2)CC1 ZINC001164883499 721401306 /nfs/dbraw/zinc/40/13/06/721401306.db2.gz AFBOMUTXSUDCMI-AOMKIAJQSA-N 1 1 433.959 3.188 20 0 IGADMO C[NH+]1CCN(C[C@H]2CCC[C@@]3(CCN(c4nc(Cl)nc5c(F)cccc54)C3)O2)CC1 ZINC001164883631 721405710 /nfs/dbraw/zinc/40/57/10/721405710.db2.gz BJNPHYNGQNLNSP-ZHRRBRCNSA-N 1 1 433.959 3.188 20 0 IGADMO Cc1cccc2c(Cl)nnc(N3CC[C@@]4(C3)CCC[C@@H](CN3CC[NH+](C)CC3)O4)c12 ZINC001164885253 721408515 /nfs/dbraw/zinc/40/85/15/721408515.db2.gz GJDYFKSSNWKJMO-FDDCHVKYSA-N 1 1 429.996 3.357 20 0 IGADMO Cc1cccc2c(Cl)nnc(N3CC[C@]4(C3)CCC[C@H](CN3CC[NH+](C)CC3)O4)c12 ZINC001164885256 721409067 /nfs/dbraw/zinc/40/90/67/721409067.db2.gz GJDYFKSSNWKJMO-JPYJTQIMSA-N 1 1 429.996 3.357 20 0 IGADMO COc1cccc2c1nc(Cl)nc2N1CC[C@@]2(C1)CCC[C@@H](CN1CC[NH+](C)CC1)O2 ZINC001164889985 721410481 /nfs/dbraw/zinc/41/04/81/721410481.db2.gz RYXVHKRHQRQUPG-GAJHUEQPSA-N 1 1 445.995 3.057 20 0 IGADMO COc1cccc2c1nc(Cl)nc2N1CC[C@]2(C1)CCC[C@@H](CN1CC[NH+](C)CC1)O2 ZINC001164889996 721410508 /nfs/dbraw/zinc/41/05/08/721410508.db2.gz RYXVHKRHQRQUPG-SBUREZEXSA-N 1 1 445.995 3.057 20 0 IGADMO COc1cc2c(cc1Cl)ncnc2N1CC[C@]2(C1)CCC[C@@H](CN1CC[NH+](C)CC1)O2 ZINC001164886583 721413724 /nfs/dbraw/zinc/41/37/24/721413724.db2.gz KGOOIEZBTMZDFN-SBUREZEXSA-N 1 1 445.995 3.057 20 0 IGADMO Fc1ccc(Oc2nc(Cl)nc(N3C[C@H]4C[NH+](Cc5nccs5)C[C@@H]4C3)n2)cc1 ZINC001164787155 721416868 /nfs/dbraw/zinc/41/68/68/721416868.db2.gz PIEZHHTZJSKHTG-CHWSQXEVSA-N 1 1 432.912 3.481 20 0 IGADMO Fc1cccc(Oc2nc(Cl)nc(N3C[C@H]4C[NH+](Cc5nccs5)C[C@@H]4C3)n2)c1 ZINC001164781729 721417819 /nfs/dbraw/zinc/41/78/19/721417819.db2.gz DJUXGIBDGNGNMP-CHWSQXEVSA-N 1 1 432.912 3.481 20 0 IGADMO C[NH+]1CCN(C[C@@H]2CCC[C@]3(CCN(c4ncccc4OCc4ccccc4)C3)O2)CC1 ZINC001164892211 721432484 /nfs/dbraw/zinc/43/24/84/721432484.db2.gz HSLJVZBZYDWPEM-JYFHCDHNSA-N 1 1 436.600 3.426 20 0 IGADMO C[NH+]1CCN(C[C@H]2CCC[C@@]3(CCN(c4ncccc4OCc4ccccc4)C3)O2)CC1 ZINC001164892209 721432650 /nfs/dbraw/zinc/43/26/50/721432650.db2.gz HSLJVZBZYDWPEM-BVAGGSTKSA-N 1 1 436.600 3.426 20 0 IGADMO Cc1cc(N2CC[C@]3(C2)CCC[C@@H](CN2CC[NH+](C)CC2)O3)nc(-c2ccsc2)n1 ZINC001164899498 721440517 /nfs/dbraw/zinc/44/05/17/721440517.db2.gz YRDRFQLUBSGTQM-REWPJTCUSA-N 1 1 427.618 3.279 20 0 IGADMO Cc1c(Cl)nc(C2CCC2)nc1N1CC[C@@]2(C1)CCC[C@H](CN1CC[NH+](C)CC1)O2 ZINC001164891370 721448394 /nfs/dbraw/zinc/44/83/94/721448394.db2.gz UNBWTIWUXGYHKB-AUSIDOKSSA-N 1 1 434.028 3.471 20 0 IGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1nc(Cl)nc3c1CCC3)CC2 ZINC001164787896 721452491 /nfs/dbraw/zinc/45/24/91/721452491.db2.gz RFIVISZPMBXRKT-GOSISDBHSA-N 1 1 435.012 3.353 20 0 IGADMO C[NH+]1CCN(C[C@H]2CCC[C@]3(CCN(c4ncnc5[nH]c6cc(F)ccc6c54)C3)O2)CC1 ZINC001164887125 721452530 /nfs/dbraw/zinc/45/25/30/721452530.db2.gz IVOFKRXSAXCCJV-HOYKHHGWSA-N 1 1 438.551 3.016 20 0 IGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1c[nH]c3ncnc(Cl)c13)CC2 ZINC001164790194 721452803 /nfs/dbraw/zinc/45/28/03/721452803.db2.gz XHRVXFZSVBSZTQ-QGZVFWFLSA-N 1 1 433.984 3.297 20 0 IGADMO CCOC(=O)c1cc(C)cc(N2CCC3(C[C@H](COCC4CC4)[N@@H+](CCOC)C3)CC2)n1 ZINC001164785227 721453695 /nfs/dbraw/zinc/45/36/95/721453695.db2.gz HMHHSGDNQTUMGI-OAQYLSRUSA-N 1 1 445.604 3.301 20 0 IGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(C(F)(F)c1ccc(Cl)nn1)CC2 ZINC001164790292 721453743 /nfs/dbraw/zinc/45/37/43/721453743.db2.gz XXOTUTSAZVOXRG-KRWDZBQOSA-N 1 1 444.954 3.409 20 0 IGADMO CCOC(=O)c1cnc(N2CCC3(C[C@H](COCC4CC4)[N@@H+](CCOC)C3)CC2)c(C)c1 ZINC001164786916 721455124 /nfs/dbraw/zinc/45/51/24/721455124.db2.gz OQTUTNMTVBBXFB-JOCHJYFZSA-N 1 1 445.604 3.301 20 0 IGADMO CCOc1nc(Cl)cc(N2CCC3(C[C@H](COCC4CC4)[N@@H+](CCOC)C3)CC2)n1 ZINC001164784359 721455777 /nfs/dbraw/zinc/45/57/77/721455777.db2.gz FBHPCTVHFBTTGV-GOSISDBHSA-N 1 1 439.000 3.263 20 0 IGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1ncnc3cc(OC)ccc31)CC2 ZINC001164785690 721459954 /nfs/dbraw/zinc/45/99/54/721459954.db2.gz MRZQEKOTIOFTQI-FQEVSTJZSA-N 1 1 440.588 3.372 20 0 IGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1ncc3ncn(C(C)C)c3n1)CC2 ZINC001164786351 721467551 /nfs/dbraw/zinc/46/75/51/721467551.db2.gz AWTHPHYHJMNKKF-FQEVSTJZSA-N 1 1 442.608 3.141 20 0 IGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1ccc(-c3ccncc3)nn1)CC2 ZINC001164788125 721469090 /nfs/dbraw/zinc/46/90/90/721469090.db2.gz IFNCHLJCVQUQRB-QFIPXVFZSA-N 1 1 437.588 3.273 20 0 IGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1ncccc1C(=O)OC(C)C)CC2 ZINC001164789947 721471317 /nfs/dbraw/zinc/47/13/17/721471317.db2.gz PIETXLSBBXGPTD-NRFANRHFSA-N 1 1 445.604 3.381 20 0 IGADMO C[NH+]1CCC(Oc2ccnc(N3CCCC[C@@]34CC(=O)N(Cc3cccnc3)C4)c2)CC1 ZINC001164893944 721476097 /nfs/dbraw/zinc/47/60/97/721476097.db2.gz KLDLFVPDRZNVBQ-VWLOTQADSA-N 1 1 435.572 3.111 20 0 IGADMO CCC[N@H+]1CCCC[C@@H]1c1ccc(N2CC[C@@H]3OCC[C@H](C(=O)N4CCCO4)[C@@H]3C2)nc1 ZINC001164789173 721483308 /nfs/dbraw/zinc/48/33/08/721483308.db2.gz BPTUHFSZPQPNCC-GPJHCHHRSA-N 1 1 442.604 3.414 20 0 IGADMO CC(C)(C)OC(=O)Nc1cc(N2CC[N@H+]3C[C@H](Oc4cccc(F)c4)C[C@H]3C2)ncn1 ZINC001164902061 721519520 /nfs/dbraw/zinc/51/95/20/721519520.db2.gz YWNQXCXXDKIEMB-FUHWJXTLSA-N 1 1 429.496 3.305 20 0 IGADMO CN(C)c1nc(-c2ccccc2)nc(N2CC[N@H+]3C[C@@H](Oc4cccc(F)c4)C[C@@H]3C2)n1 ZINC001164911168 721541296 /nfs/dbraw/zinc/54/12/96/721541296.db2.gz VPPRUKSVCWTMPF-CTNGQTDRSA-N 1 1 434.519 3.086 20 0 IGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(c2nc(Cl)nc3c2COC3(C)C)[C@H]2CCCO[C@H]12 ZINC001164805517 721542709 /nfs/dbraw/zinc/54/27/09/721542709.db2.gz MANFTLHKFQEBRO-KSZLIROESA-N 1 1 429.952 3.159 20 0 IGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2nc(Cl)nc3c2COC3(C)C)[C@H]2CCCO[C@H]12 ZINC001164805517 721542710 /nfs/dbraw/zinc/54/27/10/721542710.db2.gz MANFTLHKFQEBRO-KSZLIROESA-N 1 1 429.952 3.159 20 0 IGADMO CCOC(=O)c1c(C)cc(Cl)nc1N1C[C@H]([N@H+](C)Cc2cccnc2)[C@H]2OCCC[C@@H]21 ZINC001164801538 721544245 /nfs/dbraw/zinc/54/42/45/721544245.db2.gz FOIWUCUBPQKYHG-WFXMLNOXSA-N 1 1 444.963 3.483 20 0 IGADMO CCOC(=O)c1c(C)cc(Cl)nc1N1C[C@H]([N@@H+](C)Cc2cccnc2)[C@H]2OCCC[C@@H]21 ZINC001164801538 721544250 /nfs/dbraw/zinc/54/42/50/721544250.db2.gz FOIWUCUBPQKYHG-WFXMLNOXSA-N 1 1 444.963 3.483 20 0 IGADMO COc1nc(Cl)ncc1C(F)(F)N1CC[N@H+]2C[C@H](Oc3cccc(F)c3)C[C@H]2C1 ZINC001164902672 721549186 /nfs/dbraw/zinc/54/91/86/721549186.db2.gz AWNSGBYMHMJIRZ-DZGCQCFKSA-N 1 1 428.842 3.165 20 0 IGADMO C[N@H+](Cc1cccnc1)[C@@H]1CN(C(F)(F)COc2ccnc(Cl)c2)[C@@H]2CCCO[C@@H]12 ZINC001164802995 721551706 /nfs/dbraw/zinc/55/17/06/721551706.db2.gz HCHHOIXRIZRVKH-QWFCFKBJSA-N 1 1 438.906 3.465 20 0 IGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(C(F)(F)COc2ccnc(Cl)c2)[C@@H]2CCCO[C@@H]12 ZINC001164802995 721551710 /nfs/dbraw/zinc/55/17/10/721551710.db2.gz HCHHOIXRIZRVKH-QWFCFKBJSA-N 1 1 438.906 3.465 20 0 IGADMO Fc1cccc(O[C@H]2C[C@@H]3CN(c4ccc(-c5ccc6c(c5)OCCO6)nn4)CC[N@H+]3C2)c1 ZINC001164910888 721554016 /nfs/dbraw/zinc/55/40/16/721554016.db2.gz XNFHWVRXTPIAKM-CTNGQTDRSA-N 1 1 448.498 3.396 20 0 IGADMO C[N@@H+](Cc1cccnc1)[C@@H]1CN(c2nc3ccccc3nc2N2CCCC2)[C@@H]2CCCO[C@@H]12 ZINC001164805797 721575425 /nfs/dbraw/zinc/57/54/25/721575425.db2.gz OVZPGUMDTXECIJ-WXFUMESZSA-N 1 1 444.583 3.493 20 0 IGADMO C[C@@H]1CCCN(C(=O)c2ccc(N3C[C@H]([N@@H+](C)Cc4cccnc4)[C@@H]4OCCC[C@H]43)nc2)C1 ZINC001164798193 721576691 /nfs/dbraw/zinc/57/66/91/721576691.db2.gz APMKEBXPCYOECS-CDLYNWKESA-N 1 1 449.599 3.217 20 0 IGADMO CC1CCN(C(=O)c2cccnc2N2C[C@H]([N@H+](C)Cc3cccnc3)[C@H]3OCCC[C@H]32)CC1 ZINC001164801769 721577163 /nfs/dbraw/zinc/57/71/63/721577163.db2.gz HESJDPYGXNTARI-SGNDLWITSA-N 1 1 449.599 3.217 20 0 IGADMO CC1CCN(C(=O)c2cccnc2N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@H]3OCCC[C@H]32)CC1 ZINC001164801769 721577164 /nfs/dbraw/zinc/57/71/64/721577164.db2.gz HESJDPYGXNTARI-SGNDLWITSA-N 1 1 449.599 3.217 20 0 IGADMO Cc1nc(-c2ccncc2)nc(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@@H]3OCCC[C@@H]32)c1C ZINC001164811986 721585001 /nfs/dbraw/zinc/58/50/01/721585001.db2.gz ZGNLKRQFFIHOPY-RJGXRXQPSA-N 1 1 430.556 3.419 20 0 IGADMO CC(C)OC(=O)c1ccc(N2CCC(F)(F)[C@]3(CC[N@@H+](Cc4ccccn4)C3)C2)nn1 ZINC001164903695 721693133 /nfs/dbraw/zinc/69/31/33/721693133.db2.gz BSIWBCWTMWHMCK-NRFANRHFSA-N 1 1 431.487 3.175 20 0 IGADMO CON(C)C(=O)c1cc(C)cnc1N1CCC(F)(F)[C@@]2(CC[N@@H+](Cc3ccccn3)C2)C1 ZINC001164908553 721719381 /nfs/dbraw/zinc/71/93/81/721719381.db2.gz XYXPMWQLLYDJAN-JOCHJYFZSA-N 1 1 445.514 3.156 20 0 IGADMO CCCNC(=O)c1cccnc1N1CCC(F)(F)[C@]2(CC[N@@H+](Cc3ccccn3)C2)C1 ZINC001164907399 721724520 /nfs/dbraw/zinc/72/45/20/721724520.db2.gz ROIMJONTGUBQLA-QFIPXVFZSA-N 1 1 429.515 3.354 20 0 IGADMO COC(=O)c1nc(Cl)cc(N2CCC(F)(F)[C@]3(CC[N@@H+](Cc4ccccn4)C3)C2)n1 ZINC001164912120 721730093 /nfs/dbraw/zinc/73/00/93/721730093.db2.gz LVLSGFBLXYTBDQ-IBGZPJMESA-N 1 1 437.878 3.049 20 0 IGADMO CN1CCc2nc(Cl)nc(N3CCC(F)(F)[C@]4(CC[N@@H+](Cc5ccccn5)C4)C3)c2C1 ZINC001164912571 721734966 /nfs/dbraw/zinc/73/49/66/721734966.db2.gz NUXDTZDTYWOSER-NRFANRHFSA-N 1 1 448.949 3.251 20 0 IGADMO C[N@H+](Cc1ccco1)Cc1cncc2c1CCN(c1nc(Cl)c(F)cc1C(N)=O)C2 ZINC001164909439 721750108 /nfs/dbraw/zinc/75/01/08/721750108.db2.gz UANYKFMJKDKQBJ-UHFFFAOYSA-N 1 1 429.883 3.156 20 0 IGADMO C[N@@H+](Cc1ccco1)Cc1cncc2c1CCN(c1nc(Cl)c(F)cc1C(N)=O)C2 ZINC001164909439 721750115 /nfs/dbraw/zinc/75/01/15/721750115.db2.gz UANYKFMJKDKQBJ-UHFFFAOYSA-N 1 1 429.883 3.156 20 0 IGADMO CON(C)C(=O)c1cc(C)cnc1N1CCc2c(C[N@H+](C)Cc3ccco3)cncc2C1 ZINC001164911864 721759366 /nfs/dbraw/zinc/75/93/66/721759366.db2.gz ZVERSDILEMSFNQ-UHFFFAOYSA-N 1 1 435.528 3.206 20 0 IGADMO CON(C)C(=O)c1cc(C)cnc1N1CCc2c(C[N@@H+](C)Cc3ccco3)cncc2C1 ZINC001164911864 721759367 /nfs/dbraw/zinc/75/93/67/721759367.db2.gz ZVERSDILEMSFNQ-UHFFFAOYSA-N 1 1 435.528 3.206 20 0 IGADMO CN1CCOc2c(Cl)nnc(N3CCc4c(C[N@H+](C)Cc5ccco5)cncc4C3)c21 ZINC001164909026 721760273 /nfs/dbraw/zinc/76/02/73/721760273.db2.gz CXGURVCPTPWWBS-UHFFFAOYSA-N 1 1 440.935 3.141 20 0 IGADMO CN1CCOc2c(Cl)nnc(N3CCc4c(C[N@@H+](C)Cc5ccco5)cncc4C3)c21 ZINC001164909026 721760274 /nfs/dbraw/zinc/76/02/74/721760274.db2.gz CXGURVCPTPWWBS-UHFFFAOYSA-N 1 1 440.935 3.141 20 0 IGADMO Cc1sc2nc(C)nc(N3CCO[C@@]4(C3)COCC[N@H+](Cc3cccnc3)C4)c2c1C ZINC001164914867 721781623 /nfs/dbraw/zinc/78/16/23/721781623.db2.gz GPKSGWMBCBTCJL-QHCPKHFHSA-N 1 1 439.585 3.119 20 0 IGADMO Cc1sc2nc(C)nc(N3CCO[C@@]4(C3)COCC[N@@H+](Cc3cccnc3)C4)c2c1C ZINC001164914867 721781625 /nfs/dbraw/zinc/78/16/25/721781625.db2.gz GPKSGWMBCBTCJL-QHCPKHFHSA-N 1 1 439.585 3.119 20 0 IGADMO C[NH+]1CCC(Oc2ccnc(N3CCO[C@@H]4[C@H](COCc5nccs5)CC[C@@H]43)c2)CC1 ZINC001164918642 721811406 /nfs/dbraw/zinc/81/14/06/721811406.db2.gz SKQLEPVJXVRSSB-KPDCDPCYSA-N 1 1 444.601 3.212 20 0 IGADMO C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@H]2CN(c3nc(Cl)c(F)c4c3C(=O)NC4)C[C@H]21 ZINC001165025352 721815499 /nfs/dbraw/zinc/81/54/99/721815499.db2.gz MUHCCHOLYFMPBJ-IAOVAPTHSA-N 1 1 429.927 3.249 20 0 IGADMO CCOC(=O)c1nc2ccn(C)c2c(N2C[C@@H]3CCC[C@H]([N@@H+](C)Cc4ccccn4)[C@H]3C2)n1 ZINC001165025477 721820865 /nfs/dbraw/zinc/82/08/65/721820865.db2.gz MXIQZGJZRXZBQU-CUWPLCDZSA-N 1 1 448.571 3.277 20 0 IGADMO Cc1nc2c(nc(Cl)nc2N2C[C@@H]3CCC[C@@H]([N@@H+](C)Cc4ccccn4)[C@H]3C2)n1C ZINC001165026025 721822692 /nfs/dbraw/zinc/82/26/92/721822692.db2.gz OBSGFTQWVBLHCY-RYQLBKOJSA-N 1 1 425.968 3.457 20 0 IGADMO CCNC(=O)c1cc(Cl)nc(N2C[C@@H]3CCC[C@@H]([N@@H+](C)Cc4ccccn4)[C@H]3C2)n1 ZINC001165029033 721832204 /nfs/dbraw/zinc/83/22/04/721832204.db2.gz WLMFRNZXXYMFIS-VDZJLULYSA-N 1 1 428.968 3.012 20 0 IGADMO CN(C)CC[N@H+]1CC[C@H]2[C@H]1CCN2c1nc(-c2cccnc2)nc2sc3c(c21)CCC3 ZINC001164929410 721879405 /nfs/dbraw/zinc/87/94/05/721879405.db2.gz BGSIJTADGUTBJL-MOPGFXCFSA-N 1 1 434.613 3.457 20 0 IGADMO C[NH+](C)CCN1CC[C@H]2[C@H]1CCN2c1nc(-c2cccnc2)nc2sc3c(c21)CCC3 ZINC001164929410 721879407 /nfs/dbraw/zinc/87/94/07/721879407.db2.gz BGSIJTADGUTBJL-MOPGFXCFSA-N 1 1 434.613 3.457 20 0 IGADMO Cc1sc2nc(CN3CCCC3)nc(N3CC[C@H]4[C@H]3CC[N@@H+]4CCN(C)C)c2c1C ZINC001164929516 721879618 /nfs/dbraw/zinc/87/96/18/721879618.db2.gz BNOSWEODVGURLP-RBUKOAKNSA-N 1 1 428.650 3.119 20 0 IGADMO Cc1sc2nc(CN3CCCC3)nc(N3CC[C@H]4[C@H]3CCN4CC[NH+](C)C)c2c1C ZINC001164929516 721879619 /nfs/dbraw/zinc/87/96/19/721879619.db2.gz BNOSWEODVGURLP-RBUKOAKNSA-N 1 1 428.650 3.119 20 0 IGADMO Cc1ccc(C[N@H+]2CCOC3(CCN(c4nc(Cl)cc(C)c4C(N)=O)CC3)C2)cc1 ZINC001164939064 721921340 /nfs/dbraw/zinc/92/13/40/721921340.db2.gz SBGLFKMUMQRKBE-UHFFFAOYSA-N 1 1 428.964 3.322 20 0 IGADMO COC(=O)c1ccc(N2CCC3(CC2)C[N@@H+](Cc2ccc(C)cc2)CCO3)nc1OC ZINC001164940473 721921944 /nfs/dbraw/zinc/92/19/44/721921944.db2.gz RGDXCESVDMVYEW-UHFFFAOYSA-N 1 1 425.529 3.057 20 0 IGADMO CCOC(=O)c1nnc(Cl)cc1N1CCC2(CC1)C[N@@H+](Cc1ccc(C)cc1)CCO2 ZINC001164939799 721924968 /nfs/dbraw/zinc/92/49/68/721924968.db2.gz NIFYZMCZJVHNNW-UHFFFAOYSA-N 1 1 444.963 3.487 20 0 IGADMO Cc1ccc(C[N@H+]2CCOC3(CCN(c4ccc(C(=O)NC5CCCC5)nn4)CC3)C2)cc1 ZINC001164939622 721931624 /nfs/dbraw/zinc/93/16/24/721931624.db2.gz NDXMGIIWYBODRC-UHFFFAOYSA-N 1 1 449.599 3.329 20 0 IGADMO Cc1ccc(C[N@H+]2CCOC3(CCN(c4nc(Cl)nc5c4CN(C)CC5)CC3)C2)cc1 ZINC001164943114 721933388 /nfs/dbraw/zinc/93/33/88/721933388.db2.gz NTUCFNRZRJZNGD-UHFFFAOYSA-N 1 1 442.007 3.298 20 0 IGADMO c1ccc(CN2CCc3ncnc(N4CC[NH+](CCOc5ccccc5)CC4)c3C2)cc1 ZINC001165042325 721953332 /nfs/dbraw/zinc/95/33/32/721953332.db2.gz JBWOYCBPEUVQAW-UHFFFAOYSA-N 1 1 429.568 3.236 20 0 IGADMO Clc1nc2c(c(N3CC[NH+](CCc4ccccn4)CC3)n1)CN(Cc1ccccc1)C2 ZINC001165053271 722010707 /nfs/dbraw/zinc/01/07/07/722010707.db2.gz DRQVDPFJHZAGNF-UHFFFAOYSA-N 1 1 434.975 3.406 20 0 IGADMO CC(C)N1Cc2c(nc(Cl)nc2N2CCC3(CC[N@@H+](Cc4cccnc4)C3)CC2)C1=O ZINC001164955914 722021180 /nfs/dbraw/zinc/02/11/80/722021180.db2.gz SJMYTIPSYHENQV-UHFFFAOYSA-N 1 1 440.979 3.382 20 0 IGADMO O=C(NCc1cccnc1)[C@@H]1C[C@]12CCN(c1nc(Cl)ccc1C[NH+]1CCCC1)C2 ZINC001164961464 722034067 /nfs/dbraw/zinc/03/40/67/722034067.db2.gz VVGGIEMDLKWHKO-CVDCTZTESA-N 1 1 425.964 3.259 20 0 IGADMO Clc1nc2ncsc2c(N2CCC3(CC2)COCC[N@@H+](Cc2ccncc2)C3)n1 ZINC001164964098 722056315 /nfs/dbraw/zinc/05/63/15/722056315.db2.gz RIGGJDWUNXHWHV-UHFFFAOYSA-N 1 1 430.965 3.254 20 0 IGADMO Nc1cc(Cl)ncc1C(F)(F)N1CCC2(CC1)COCC[N@@H+](Cc1ccncc1)C2 ZINC001164964297 722056669 /nfs/dbraw/zinc/05/66/69/722056669.db2.gz UMNLNSGFLWQVIE-UHFFFAOYSA-N 1 1 437.922 3.376 20 0 IGADMO O=C(NC1CCC1)[C@@H]1C[C@H]2CN(c3ncnc4c3CC[N@H+](Cc3ccccc3)C4)C[C@H]2C1 ZINC001164978332 722084906 /nfs/dbraw/zinc/08/49/06/722084906.db2.gz YSPBKVIEVFHXQN-WKCHPHFGSA-N 1 1 431.584 3.166 20 0 IGADMO O=C(NC1CCC1)[C@@H]1C[C@H]2CN(c3ncnc4c3CC[N@@H+](Cc3ccccc3)C4)C[C@H]2C1 ZINC001164978332 722084907 /nfs/dbraw/zinc/08/49/07/722084907.db2.gz YSPBKVIEVFHXQN-WKCHPHFGSA-N 1 1 431.584 3.166 20 0 IGADMO Clc1c[nH]c2nc(Cl)nc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)c12 ZINC001164986267 722100121 /nfs/dbraw/zinc/10/01/21/722100121.db2.gz YQBHIBLIDZPMEH-GDBMZVCRSA-N 1 1 433.343 3.387 20 0 IGADMO FC(F)(c1cc(Cl)nc(Cl)n1)N1CC[C@@H]2C[N@@H+](Cc3cccnc3)CCO[C@H]2C1 ZINC001164983997 722101513 /nfs/dbraw/zinc/10/15/13/722101513.db2.gz RMQGEWAMBMGMQP-CABCVRRESA-N 1 1 444.313 3.451 20 0 IGADMO CCOC(=O)c1cc(N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)ncc1Cl ZINC001164980810 722103005 /nfs/dbraw/zinc/10/30/05/722103005.db2.gz KLDPAGDFZYIKGF-PXNSSMCTSA-N 1 1 430.936 3.034 20 0 IGADMO Clc1nc2c(c(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)n1)CSCC2 ZINC001164979998 722104157 /nfs/dbraw/zinc/10/41/57/722104157.db2.gz IQNNPOPKMBPNFO-VQIMIIECSA-N 1 1 431.993 3.042 20 0 IGADMO CCOC(=O)c1c(C)nc(Cl)cc1N1CC[C@@H]2C[N@@H+](Cc3cccnc3)CCO[C@H]2C1 ZINC001164983104 722109301 /nfs/dbraw/zinc/10/93/01/722109301.db2.gz YHCFXUZTSKJBQY-QUCCMNQESA-N 1 1 444.963 3.342 20 0 IGADMO c1ccc(COc2ccnc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)n2)cc1 ZINC001164971364 722116350 /nfs/dbraw/zinc/11/63/50/722116350.db2.gz BITJKGSTIWNGHI-PKTZIBPZSA-N 1 1 431.540 3.178 20 0 IGADMO COc1cc2nc(C)nc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)c2cc1OC ZINC001164982479 722119190 /nfs/dbraw/zinc/11/91/90/722119190.db2.gz WQADPYMMFBUGRH-YADARESESA-N 1 1 449.555 3.078 20 0 IGADMO CCOC(=O)c1cnc(N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)c(Cl)c1 ZINC001164973070 722120830 /nfs/dbraw/zinc/12/08/30/722120830.db2.gz GHEQXCDNIQWTSE-YLJYHZDGSA-N 1 1 430.936 3.034 20 0 IGADMO CCOC(=O)c1cnc(Cl)c(C)c1N1CC[C@@H]2C[N@@H+](Cc3cccnc3)CCO[C@@H]2C1 ZINC001164973845 722124562 /nfs/dbraw/zinc/12/45/62/722124562.db2.gz HLWQNXRALPMNJY-UYAOXDASSA-N 1 1 444.963 3.342 20 0 IGADMO COc1cc2ccc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)nc2cc1OC ZINC001164974039 722126962 /nfs/dbraw/zinc/12/69/62/722126962.db2.gz IHKCNGJZYURZGF-GBXCKJPGSA-N 1 1 434.540 3.374 20 0 IGADMO CN(C)c1ccc(-c2ccnc(N3CC[C@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)n2)cc1 ZINC001164978023 722134241 /nfs/dbraw/zinc/13/42/41/722134241.db2.gz JDUPJUAAZYHQRJ-DHLKQENFSA-N 1 1 444.583 3.332 20 0 IGADMO CCc1cc2c(nc(Cl)nc2N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)[nH]1 ZINC001164979644 722136674 /nfs/dbraw/zinc/13/66/74/722136674.db2.gz LQDMBZWZIOPKIR-APWZRJJASA-N 1 1 426.952 3.296 20 0 IGADMO CC1CCN(C(=O)c2ccc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)nc2)CC1 ZINC001164972633 722140299 /nfs/dbraw/zinc/14/02/99/722140299.db2.gz AFUJHLQGHDJWOY-DNQXCXABSA-N 1 1 449.599 3.076 20 0 IGADMO C[NH+]1CCN(c2ncnc3c2CCN(C(F)(F)c2cc(Cl)ncc2Cl)CC3)CC1 ZINC001164998126 722229527 /nfs/dbraw/zinc/22/95/27/722229527.db2.gz XXXDOELTHPRRPF-UHFFFAOYSA-N 1 1 443.329 3.080 20 0 IGADMO Cc1noc([C@@H]2C[C@H]3CCN(c4ncnc5c4CC[N@H+](Cc4ccccc4)C5)C[C@@H]3O2)n1 ZINC001164647130 719298990 /nfs/dbraw/zinc/29/89/90/719298990.db2.gz CLLPDZCRQJULJO-COPCDDAFSA-N 1 1 432.528 3.083 20 0 IGADMO Cc1noc([C@@H]2C[C@H]3CCN(c4ncnc5c4CC[N@@H+](Cc4ccccc4)C5)C[C@@H]3O2)n1 ZINC001164647130 719298994 /nfs/dbraw/zinc/29/89/94/719298994.db2.gz CLLPDZCRQJULJO-COPCDDAFSA-N 1 1 432.528 3.083 20 0 IGADMO CN(C)c1nc(N2CCOC[C@@]3(CCCN([C@H](F)c4ccnc(Cl)c4)C3)C2)cc[nH+]1 ZINC001164663791 719357329 /nfs/dbraw/zinc/35/73/29/719357329.db2.gz HEKCVYBWNUSZCF-FPOVZHCZSA-N 1 1 434.947 3.178 20 0 IGADMO Cc1nc2c(cc(-c3nc(N4C[C@H]5OCC[N@@H+](C)[C@H]5C4)ncc3F)cc2F)n1C(C)C ZINC001164670240 719394316 /nfs/dbraw/zinc/39/43/16/719394316.db2.gz WIDSUCVLAKHECG-RBUKOAKNSA-N 1 1 428.487 3.180 20 0 IGADMO COC(=O)[C@@]1(C)C[C@@H]([NH+]2CCOCC2)CCN1c1nc(Cl)nc2ccc(Cl)cc21 ZINC001164697334 719838956 /nfs/dbraw/zinc/83/89/56/719838956.db2.gz CRFJQMHNZXNNBM-VBKZILBWSA-N 1 1 439.343 3.169 20 0 IGADMO COC(=O)[C@]1(C)C[C@H]([NH+]2CCOCC2)CCN1c1nc(Cl)nc2c(Cl)cccc21 ZINC001164703106 719851431 /nfs/dbraw/zinc/85/14/31/719851431.db2.gz OPOKWJXWFHDUGW-XCLFUZPHSA-N 1 1 439.343 3.169 20 0 IGADMO COC(=O)[C@]1(C)C[C@@H]([NH+]2CCOCC2)CCN1c1nc(Cl)nc2cccc(Cl)c21 ZINC001164702995 719854001 /nfs/dbraw/zinc/85/40/01/719854001.db2.gz OKYISXKXKABXEF-RBZFPXEDSA-N 1 1 439.343 3.169 20 0 IGADMO COC(=O)[C@]1(C)C[C@H]([NH+]2CCOCC2)CCN1c1nc(Cl)nc2cccc(Cl)c21 ZINC001164703003 719854174 /nfs/dbraw/zinc/85/41/74/719854174.db2.gz OKYISXKXKABXEF-XCLFUZPHSA-N 1 1 439.343 3.169 20 0 IGADMO CCC[N@H+]1CCCC[C@@H]1c1ccc(N2CC[C@@H](N3CCOCC3)C[C@@]2(C)C(=O)OC)nc1 ZINC001164703846 719876737 /nfs/dbraw/zinc/87/67/37/719876737.db2.gz KYRIBCAIHAIRBQ-RQTOMXEWSA-N 1 1 444.620 3.251 20 0 IGADMO COC(=O)[C@@]1(C)C[C@@H]([NH+]2CCOCC2)CCN1c1c(Cl)ccc2c(Cl)ncnc21 ZINC001164700819 719879742 /nfs/dbraw/zinc/87/97/42/719879742.db2.gz MFEUXGUWWVQQSX-RNODOKPDSA-N 1 1 439.343 3.169 20 0 IGADMO CCOC(=O)c1ccc(N2CCC3(C[C@H](COC)[N@@H+](Cc4ccccn4)C3)CC2)nc1C ZINC001164710211 720094373 /nfs/dbraw/zinc/09/43/73/720094373.db2.gz HGGGOTJOOAMLIG-OAQYLSRUSA-N 1 1 438.572 3.469 20 0 IGADMO COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1cc(Cl)cc(C(=O)OC)n1)CC2 ZINC001164712556 720104728 /nfs/dbraw/zinc/10/47/28/720104728.db2.gz XASPRVBWAZAUBT-LJQANCHMSA-N 1 1 444.963 3.424 20 0 IGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1nc(C)nc3cc(OC)c(OC)cc31)C2 ZINC001164808171 720117882 /nfs/dbraw/zinc/11/78/82/720117882.db2.gz DURJFPRZDCWLOY-KOSHJBKYSA-N 1 1 426.561 3.140 20 0 IGADMO COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1ccc(-c3ccncc3)nn1)CC2 ZINC001164713898 720148722 /nfs/dbraw/zinc/14/87/22/720148722.db2.gz UDGAYIQDKIDWLX-QFIPXVFZSA-N 1 1 430.556 3.441 20 0 IGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(C(F)(F)c1cnc3c(Cl)ncnc3c1)C2 ZINC001164818013 720153382 /nfs/dbraw/zinc/15/33/82/720153382.db2.gz REPNNYZTXQZADO-UZLBHIALSA-N 1 1 437.922 3.408 20 0 IGADMO COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(C(F)(F)c1cc(Cl)ncc1C(=O)OC)C2 ZINC001164812419 720165231 /nfs/dbraw/zinc/16/52/31/720165231.db2.gz AMSKCXBCXLMONE-QRWLVFNGSA-N 1 1 443.922 3.251 20 0 IGADMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN([C@](F)(COc1cncc(Cl)n1)C(F)F)C2 ZINC001164816349 720178956 /nfs/dbraw/zinc/17/89/56/720178956.db2.gz KZSCQAZOUMLCGS-CWFSZBLJSA-N 1 1 448.917 3.120 20 0 IGADMO CC(C)[N@@H+](C)Cc1cc(=O)n2c(n1)CN(C(F)(F)COc1ccnc(Cl)c1)CCC2 ZINC001164812945 720222869 /nfs/dbraw/zinc/22/28/69/720222869.db2.gz KVAWLKRIRZEEIW-UHFFFAOYSA-N 1 1 441.910 3.009 20 0 IGADMO Cc1nc(CN2C(=O)CC[C@H]3[C@H]2CCN3c2cc(OC3CC[NH+](C)CC3)ccn2)cs1 ZINC001164815136 720258867 /nfs/dbraw/zinc/25/88/67/720258867.db2.gz BBIVACZEUAHEJV-LEWJYISDSA-N 1 1 441.601 3.089 20 0 IGADMO O=C(Nc1nncs1)c1cnc(N2CC[C@@H]3[C@H]2CC[N@@H+]3Cc2cccnc2)c(Cl)c1 ZINC001164735920 720452495 /nfs/dbraw/zinc/45/24/95/720452495.db2.gz ZNFCUBTUXHUZRG-IAGOWNOFSA-N 1 1 441.948 3.087 20 0 IGADMO O=C(Nc1nncs1)c1cnc(N2CC[C@@H]3[C@H]2CC[N@H+]3Cc2cccnc2)c(Cl)c1 ZINC001164735920 720452501 /nfs/dbraw/zinc/45/25/01/720452501.db2.gz ZNFCUBTUXHUZRG-IAGOWNOFSA-N 1 1 441.948 3.087 20 0 IGADMO COc1ccc(CN(C)c2ccnc(N3CC[C@@H]4[C@H]3CC[N@H+]4Cc3cccnc3)n2)cc1 ZINC001164728952 720470518 /nfs/dbraw/zinc/47/05/18/720470518.db2.gz QAHMQCXJLFPVDM-DHIUTWEWSA-N 1 1 430.556 3.370 20 0 IGADMO CCOC(=O)c1cc(N2CC[C@@H]3[C@@H](C[C@H](Cn4cccn4)[N@H+]3C(C)C)C2)ncc1Cl ZINC001164839051 720513532 /nfs/dbraw/zinc/51/35/32/720513532.db2.gz SEXIBUDJBJFKRG-SQGPQFPESA-N 1 1 431.968 3.486 20 0 IGADMO CC(C)[N@@H+]1[C@@H]2CCN(c3cc(NC(=O)OC(C)(C)C)ncn3)C[C@@H]2C[C@H]1Cn1cccn1 ZINC001164834590 720518603 /nfs/dbraw/zinc/51/86/03/720518603.db2.gz GPGVQAGBWXKNST-GBESFXJTSA-N 1 1 441.580 3.398 20 0 IGADMO CC(C)[N@@H+]1[C@@H]2CCN(c3nc(Cl)nc4c3COC4(C)C)C[C@@H]2C[C@H]1Cn1cccn1 ZINC001164836050 720524759 /nfs/dbraw/zinc/52/47/59/720524759.db2.gz LXLRUTYMMFFLGV-XYJFISCASA-N 1 1 430.984 3.470 20 0 IGADMO CCOC(=O)c1c(C)cc(N2CC[C@@H]3[C@@H](C[C@H](Cn4cccn4)[N@H+]3C(C)C)C2)nc1C ZINC001164841404 720558558 /nfs/dbraw/zinc/55/85/58/720558558.db2.gz UYFGIQPXUSSKHK-PWRODBHTSA-N 1 1 425.577 3.449 20 0 IGADMO CC(C)[N@@H+]1[C@@H]2CCN(c3nc(-c4ccccc4)nc(N(C)C)n3)C[C@H]2C[C@H]1Cn1cccn1 ZINC001164842101 720561689 /nfs/dbraw/zinc/56/16/89/720561689.db2.gz WNIPCLNFBRVENL-BHIFYINESA-N 1 1 446.603 3.179 20 0 IGADMO COC(=O)c1c(Cl)cnc(N2CC[C@@H]3[C@@H](C[C@@H](Cn4cccn4)[N@H+]3C(C)C)C2)c1OC ZINC001164843108 720587317 /nfs/dbraw/zinc/58/73/17/720587317.db2.gz WJAXPIIAZGRQGW-XYJFISCASA-N 1 1 447.967 3.105 20 0 IGADMO CC(C)[N@@H+]1[C@@H]2CCN(c3nc(Cl)nc4c(Cl)ncnc43)C[C@@H]2C[C@H]1Cn1cccn1 ZINC001164844210 720629292 /nfs/dbraw/zinc/62/92/92/720629292.db2.gz ZYRUXIOPPLQQMH-SOUVJXGZSA-N 1 1 447.374 3.301 20 0 IGADMO COc1cc(OC)c2ncnc(N3CC[C@@H]4[C@@H](C[C@@H](Cn5cccn5)[N@H+]4C(C)C)C3)c2c1 ZINC001164842493 720645124 /nfs/dbraw/zinc/64/51/24/720645124.db2.gz RUDJCIMYSIEWSJ-BBTUJRGHSA-N 1 1 436.560 3.221 20 0 IGADMO COc1nnc(Cl)cc1C(F)(F)N1CC[C@@H]2[C@H](C[C@@H](Cn3cccn3)[N@H+]2C(C)C)C1 ZINC001164843180 720645596 /nfs/dbraw/zinc/64/55/96/720645596.db2.gz UORUFZSPNYGZPE-HLLBOEOZSA-N 1 1 440.926 3.258 20 0 IGADMO COC(=O)c1nc(Cl)cnc1N1CCC2(C[C@H]([N@@H+](C)Cc3ccccc3)CO2)CC1 ZINC001164843798 720692839 /nfs/dbraw/zinc/69/28/39/720692839.db2.gz QYGSOJXLCNAPEA-KRWDZBQOSA-N 1 1 430.936 3.177 20 0 IGADMO CCNC(=O)c1cc(Cl)nc(N2CCC3(C[C@@H]([N@@H+](C)Cc4ccccc4)CO3)CC2)n1 ZINC001164836873 720728803 /nfs/dbraw/zinc/72/88/03/720728803.db2.gz HAVOJDNVBRUBCV-GOSISDBHSA-N 1 1 443.979 3.140 20 0 IGADMO Clc1cc(OCc2ccccc2)cnc1N1CC[N@H+]2C[C@@H](Oc3cncnc3)C[C@H]2C1 ZINC001164745921 720746221 /nfs/dbraw/zinc/74/62/21/720746221.db2.gz WUXBJTIDIJOOIU-ICSRJNTNSA-N 1 1 437.931 3.446 20 0 IGADMO CSc1cnc(Cl)c(C(F)(F)N2CC[N@@H+]3C[C@@H](Oc4cncnc4)C[C@H]3C2)c1 ZINC001164744126 720749283 /nfs/dbraw/zinc/74/92/83/720749283.db2.gz REYHFDFWWFLQOL-STQMWFEESA-N 1 1 427.908 3.134 20 0 IGADMO CSc1cnc(Cl)c(C(F)(F)N2CC[N@H+]3C[C@@H](Oc4cncnc4)C[C@H]3C2)c1 ZINC001164744126 720749290 /nfs/dbraw/zinc/74/92/90/720749290.db2.gz REYHFDFWWFLQOL-STQMWFEESA-N 1 1 427.908 3.134 20 0 IGADMO C[C@@H]1CCCCN1c1nc2ccccc2nc1N1CC[N@H+]2C[C@@H](Oc3cncnc3)C[C@@H]2C1 ZINC001164740445 720759701 /nfs/dbraw/zinc/75/97/01/720759701.db2.gz LERCUOKJVHZKBG-AQNXPRMDSA-N 1 1 445.571 3.141 20 0 IGADMO FC(F)(c1cc(-c2ccco2)nnc1Cl)N1CC[N@@H+]2C[C@H](Oc3cncnc3)C[C@@H]2C1 ZINC001164741138 720769308 /nfs/dbraw/zinc/76/93/08/720769308.db2.gz MJBOBIXBWAIXPE-ZIAGYGMSSA-N 1 1 448.861 3.067 20 0 IGADMO FC(F)(c1cc(-c2ccco2)nnc1Cl)N1CC[N@H+]2C[C@H](Oc3cncnc3)C[C@@H]2C1 ZINC001164741138 720769316 /nfs/dbraw/zinc/76/93/16/720769316.db2.gz MJBOBIXBWAIXPE-ZIAGYGMSSA-N 1 1 448.861 3.067 20 0 IGADMO c1ncn(C[C@@H]2C[C@H]3CN(c4cncc(OCc5ccccc5)n4)CC[C@H]3[N@@H+]2CC2CC2)n1 ZINC001164737687 720817518 /nfs/dbraw/zinc/81/75/18/720817518.db2.gz BYPVYJHAGLBHBE-RJGXRXQPSA-N 1 1 445.571 3.027 20 0 IGADMO Clc1nnc(N2CC[C@@H]3[C@H](C[C@H](Cn4cncn4)[N@H+]3CC3CC3)C2)c2sccc21 ZINC001164737710 720818567 /nfs/dbraw/zinc/81/85/67/720818567.db2.gz CFHDUENENYXPNN-BFYDXBDKSA-N 1 1 429.981 3.316 20 0 IGADMO Clc1nnc(N2CC[C@@H]3[C@H](C[C@@H](Cn4cncn4)[N@H+]3CC3CC3)C2)c2sccc21 ZINC001164737711 720818756 /nfs/dbraw/zinc/81/87/56/720818756.db2.gz CFHDUENENYXPNN-HLLBOEOZSA-N 1 1 429.981 3.316 20 0 IGADMO FC(F)(Oc1ccc(Cl)nc1)N1CC[C@@H]2[C@H](C[C@H](Cn3cncn3)[N@H+]2CC2CC2)C1 ZINC001164745989 720820847 /nfs/dbraw/zinc/82/08/47/720820847.db2.gz XRFYIZRUUVCRGZ-JFIYKMOQSA-N 1 1 438.910 3.131 20 0 IGADMO CSc1nc2ccsc2c(N2CC[C@@H]3[C@@H](C[C@@H](Cn4cncn4)[N@H+]3CC3CC3)C2)n1 ZINC001164737729 720825828 /nfs/dbraw/zinc/82/58/28/720825828.db2.gz CGZKWWYJLBKMCQ-XYJFISCASA-N 1 1 441.630 3.384 20 0 IGADMO CSc1nc2c(c(N3CC[C@@H]4[C@H](C[C@@H](Cn5cncn5)[N@H+]4CC4CC4)C3)n1)CCCC2 ZINC001164739250 720825987 /nfs/dbraw/zinc/82/59/87/720825987.db2.gz HWEFMBUKKYVZGF-LVCYWYKZSA-N 1 1 439.633 3.048 20 0 IGADMO CC(C)(C)c1cc(Cl)nc(N2CC[C@@H]3[C@H](C[C@H](Cn4cncn4)[N@H+]3CC3CC3)C2)n1 ZINC001164742543 720842570 /nfs/dbraw/zinc/84/25/70/720842570.db2.gz HLAOZXWGFLQYSR-KZNAEPCWSA-N 1 1 430.000 3.398 20 0 IGADMO COCC[N@H+]1CCO[C@@H]2CN(C(F)(F)c3nc(Cl)c4cccc(F)c4n3)CC[C@H]2C1 ZINC001164855929 720842906 /nfs/dbraw/zinc/84/29/06/720842906.db2.gz VONYTTZUJYEEGN-XJKSGUPXSA-N 1 1 444.885 3.141 20 0 IGADMO c1ncn(C[C@H]2C[C@@H]3CN(c4ncnc5sc6c(c54)CCC6)CC[C@H]3[N@H+]2CC2CC2)n1 ZINC001164740533 720845907 /nfs/dbraw/zinc/84/59/07/720845907.db2.gz CHRWTJXHYAPTIM-ZHALLVOQSA-N 1 1 435.601 3.151 20 0 IGADMO COc1ccc(-c2ccc(N3CC[C@@H]4[C@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)nn2)cc1 ZINC001164745155 720846585 /nfs/dbraw/zinc/84/65/85/720846585.db2.gz LWFDSCZXVQFHRZ-PQNGQFLHSA-N 1 1 445.571 3.123 20 0 IGADMO Fc1ccc2c(Cl)nnc(N3CC[C@@H]4[C@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)c2c1 ZINC001164747608 720854201 /nfs/dbraw/zinc/85/42/01/720854201.db2.gz IGENLSRETUPOKP-WRWLIDTKSA-N 1 1 441.942 3.393 20 0 IGADMO COc1cc2nc(N3CC[C@@H]4[C@@H](C[C@H](Cn5cncn5)[N@H+]4CC4CC4)C3)ccc2c(OC)c1 ZINC001164752638 720856715 /nfs/dbraw/zinc/85/67/15/720856715.db2.gz TZKMJDSAWQBDKC-YCRNBWNJSA-N 1 1 448.571 3.223 20 0 IGADMO c1cc2c(nc(C3CCC3)nc2N2CC[C@H]3[C@H](C[C@@H](Cn4cncn4)[N@@H+]3CC3CC3)C2)[nH]1 ZINC001164744903 720861758 /nfs/dbraw/zinc/86/17/58/720861758.db2.gz CSYQTVURMQHIJN-DYXWJJEUSA-N 1 1 432.576 3.196 20 0 IGADMO Cc1c[nH]c2ncnc(N3CC[C@@]4(C3)C[N@@H+](CC3CC3)C[C@H]4COCc3cccnc3)c12 ZINC001164753430 720867987 /nfs/dbraw/zinc/86/79/87/720867987.db2.gz PMUOJZHWFVZNOO-OFVILXPXSA-N 1 1 432.572 3.416 20 0 IGADMO COC(=O)c1cccc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COCc2cccnc2)n1 ZINC001164754939 720871611 /nfs/dbraw/zinc/87/16/11/720871611.db2.gz UUIHVQWOKHYISX-BWKNWUBXSA-N 1 1 436.556 3.018 20 0 IGADMO COCC[N@H+]1CCO[C@H]2CN(c3ncnc4c3c(C)c(C)n4Cc3ccccc3)CC[C@H]2C1 ZINC001164858349 720875569 /nfs/dbraw/zinc/87/55/69/720875569.db2.gz KSIDLUKERCBJIO-GOTSBHOMSA-N 1 1 449.599 3.270 20 0 IGADMO COCC[N@H+]1CCO[C@@H]2CN(c3nc(-c4cccc(OC)c4)nc4ccccc43)CC[C@H]2C1 ZINC001164859822 720882666 /nfs/dbraw/zinc/88/26/66/720882666.db2.gz MVOMRVJDYUMWJR-GBXCKJPGSA-N 1 1 448.567 3.479 20 0 IGADMO c1cncc(COC[C@H]2C[N@@H+](CC3CC3)C[C@]23CCN(c2cnc4cccnc4n2)C3)c1 ZINC001164753469 720885762 /nfs/dbraw/zinc/88/57/62/720885762.db2.gz HBJSNGZKZIARSY-BWKNWUBXSA-N 1 1 430.556 3.175 20 0 IGADMO COCC[N@H+]1CCO[C@H]2CN(C(F)(F)c3ccc(Cl)nc3C(F)(F)F)CC[C@H]2C1 ZINC001164855838 720885917 /nfs/dbraw/zinc/88/59/17/720885917.db2.gz HZITWNDELJANFS-JSGCOSHPSA-N 1 1 443.844 3.472 20 0 IGADMO COCC[N@H+]1CCO[C@H]2CN(c3ncnc4cc(OCc5ccccc5)ccc43)CC[C@H]2C1 ZINC001164863797 720888230 /nfs/dbraw/zinc/88/82/30/720888230.db2.gz UICRVPMMCTZADK-OFVILXPXSA-N 1 1 448.567 3.382 20 0 IGADMO Cc1nc2ccc(N3CC[C@@]4(C3)C[N@@H+](CC3CC3)C[C@H]4COCc3cccnc3)nc2n1C ZINC001164755086 720890609 /nfs/dbraw/zinc/89/06/09/720890609.db2.gz KPYBZPKMMCFCRH-NVQXNPDNSA-N 1 1 446.599 3.427 20 0 IGADMO FC(F)Oc1cnc(N2CC[C@@]3(C2)C[N@@H+](CC2CC2)C[C@@H]3COCc2cccnc2)nc1 ZINC001164754509 720896834 /nfs/dbraw/zinc/89/68/34/720896834.db2.gz JCOPTCNFTKFMAQ-XXBNENTESA-N 1 1 445.514 3.228 20 0 IGADMO CC(=O)Nc1c(C)ccnc1N1CC[C@]2(C1)C[N@@H+](CC1CC1)C[C@@H]2COCc1cccnc1 ZINC001164758178 720903319 /nfs/dbraw/zinc/90/33/19/720903319.db2.gz XKJOAINHZIDURE-ZEQKJWHPSA-N 1 1 449.599 3.499 20 0 IGADMO Nc1cc(Cl)cnc1N1CC[C@]2(C1)C[N@@H+](CC1CC1)C[C@H]2COCc1cccnc1 ZINC001164754201 720905057 /nfs/dbraw/zinc/90/50/57/720905057.db2.gz UGVZJLKPBHIVTA-WMZHIEFXSA-N 1 1 427.980 3.467 20 0 IGADMO [O-][n+]1cc(Cl)ccc1N1CC[C@@]2(C1)C[N@@H+](CC1CC1)C[C@@H]2COCc1cccnc1 ZINC001164750608 720906143 /nfs/dbraw/zinc/90/61/43/720906143.db2.gz JXOXNFCVFXUVJM-OFNKIYASSA-N 1 1 428.964 3.124 20 0 IGADMO c1ccc2nc(N3CC[C@@]4(C3)C[N@H+](CC3CC3)C[C@H]4COCc3cccnc3)nnc2c1 ZINC001164754626 720918678 /nfs/dbraw/zinc/91/86/78/720918678.db2.gz WKUFAHHTFRQKRI-OFVILXPXSA-N 1 1 430.556 3.175 20 0 IGADMO c1ncn2c1CN(c1ncnc3c1CC[N@H+](Cc1ccccc1)C3)C[C@H](COCC1CC1)C2 ZINC001164757252 720977018 /nfs/dbraw/zinc/97/70/18/720977018.db2.gz NOTFWUFYYRNNGQ-QFIPXVFZSA-N 1 1 444.583 3.294 20 0 IGADMO c1ncn2c1CN(c1ncnc3c1CC[N@@H+](Cc1ccccc1)C3)C[C@H](COCC1CC1)C2 ZINC001164757252 720977028 /nfs/dbraw/zinc/97/70/28/720977028.db2.gz NOTFWUFYYRNNGQ-QFIPXVFZSA-N 1 1 444.583 3.294 20 0 IGADMO CCC[N@H+]1CCCC[C@@H]1c1ccc(N2CC[C@@H]3CO[C@@H](CNC(=O)N(C)C)[C@H]3C2)nc1 ZINC001164757352 721000679 /nfs/dbraw/zinc/00/06/79/721000679.db2.gz OMBPJWPRANFFRE-MBDNFAEBSA-N 1 1 429.609 3.131 20 0 IGADMO CCC(CC)NS(=O)(=O)c1ccc(N2CCn3c(C[N@@H+](C)C(C)C)cnc3[C@@H]2C)nc1 ZINC001164860469 721007297 /nfs/dbraw/zinc/00/72/97/721007297.db2.gz OKODOUVIJZHSJL-KRWDZBQOSA-N 1 1 448.637 3.166 20 0 IGADMO COc1ccc2nc(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@H]4C3)c(Cl)nc2c1 ZINC001164866408 721076825 /nfs/dbraw/zinc/07/68/25/721076825.db2.gz TZTUXJGCKKYALN-FUHWJXTLSA-N 1 1 425.920 3.167 20 0 IGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4cc(C(=O)N5CCCCC5)cc(Cl)n4)C[C@@H]3C2)cn1 ZINC001164774186 721092934 /nfs/dbraw/zinc/09/29/34/721092934.db2.gz YZHZJOSSHHHONI-QUCCMNQESA-N 1 1 442.995 3.053 20 0 IGADMO O=C(Nc1ccccc1)c1ccnc(N2CC[N@H+]3C[C@H](OCc4cccnc4)C[C@H]3C2)c1 ZINC001164865033 721093390 /nfs/dbraw/zinc/09/33/90/721093390.db2.gz IBYCSXMKJWDQMV-XZOQPEGZSA-N 1 1 429.524 3.209 20 0 IGADMO CC(C)(C)NC(=O)c1ccc(Cl)nc1N1CC[N@H+]2C[C@H](OCc3cccnc3)C[C@H]2C1 ZINC001164865212 721100314 /nfs/dbraw/zinc/10/03/14/721100314.db2.gz JMUAJKDVTSKVLA-ZWKOTPCHSA-N 1 1 443.979 3.138 20 0 IGADMO Cn1cc(C[N@@H+]2CC[C@@H]3CN(c4ccc5c(n4)CCN(Cc4ccccc4)C5)C[C@H]3C2)cn1 ZINC001164769924 721105127 /nfs/dbraw/zinc/10/51/27/721105127.db2.gz QHBLZCMZGCLGTG-ILBGXUMGSA-N 1 1 442.611 3.332 20 0 IGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(c4ccc5c(n4)CCN(Cc4ccccc4)C5)C[C@H]3C2)cn1 ZINC001164769924 721105135 /nfs/dbraw/zinc/10/51/35/721105135.db2.gz QHBLZCMZGCLGTG-ILBGXUMGSA-N 1 1 442.611 3.332 20 0 IGADMO c1ccc2nc(N3CC[N@H+]4C[C@H](OCc5cccnc5)C[C@@H]4C3)c(N3CCCC3)nc2c1 ZINC001164878344 721136420 /nfs/dbraw/zinc/13/64/20/721136420.db2.gz PXKQGPQQSFBERQ-NHCUHLMSSA-N 1 1 430.556 3.105 20 0 IGADMO FC(F)(c1c2c(nnc1Cl)CCC2)N1CC[N@H+]2C[C@H](OCc3cccnc3)C[C@@H]2C1 ZINC001164881193 721149291 /nfs/dbraw/zinc/14/92/91/721149291.db2.gz ZRENJIWJKVWUGD-HZPDHXFCSA-N 1 1 435.906 3.038 20 0 IGADMO CCOC(=O)c1cc2c(N3C[C@@H]4C[N@H+](Cc5cnn(C)c5)CC[C@@H]4C3)[nH]c(C)c(C)c-2n1 ZINC001164773536 721159053 /nfs/dbraw/zinc/15/90/53/721159053.db2.gz YIPYZFWXMQGRNR-MOPGFXCFSA-N 1 1 436.560 3.048 20 0 IGADMO CCOc1ccc(-c2ccc(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@H]4C3)nn2)cc1 ZINC001164872797 721162827 /nfs/dbraw/zinc/16/28/27/721162827.db2.gz IJXLSFKCRPTUHK-GMAHTHKFSA-N 1 1 431.540 3.417 20 0 IGADMO COc1ccc(OC)c(-c2ccc(N3CC[N@H+]4C[C@@H](OCc5cccnc5)C[C@H]4C3)nn2)c1 ZINC001164880369 721164091 /nfs/dbraw/zinc/16/40/91/721164091.db2.gz WAKRWJQOCWOBTE-FPOVZHCZSA-N 1 1 447.539 3.036 20 0 IGADMO Cc1ccc(-c2nc3c(ncnc3N3C[C@@H]4CC[N@H+](Cc5cnn(C)c5)C[C@H]4C3)o2)cc1 ZINC001164771842 721206503 /nfs/dbraw/zinc/20/65/03/721206503.db2.gz REJLZNOWLDLNMZ-PMACEKPBSA-N 1 1 429.528 3.285 20 0 IGADMO COc1ccc(Cc2c(C)nc(N3C[C@@H]4CC[N@@H+](Cc5cnn(C)c5)C[C@H]4C3)nc2C)cc1 ZINC001164763895 721235534 /nfs/dbraw/zinc/23/55/34/721235534.db2.gz NXABHXSIDUSKEM-GOTSBHOMSA-N 1 1 446.599 3.385 20 0 IGADMO Cn1cc(C[N@H+]2CC[C@@H]3CN(C(Cl)(Cl)Oc4ccc(Cl)nc4)C[C@H]3C2)cn1 ZINC001164766888 721245707 /nfs/dbraw/zinc/24/57/07/721245707.db2.gz VSXGATDYVDOTEE-HUUCEWRRSA-N 1 1 430.767 3.390 20 0 IGADMO CN(C)C(=O)C[N@H+]1CCOCC2(CCN(c3c(Cl)cc(Cl)nc3Cl)CC2)C1 ZINC001164868604 721267441 /nfs/dbraw/zinc/26/74/41/721267441.db2.gz DXHRYLRJDNISKH-UHFFFAOYSA-N 1 1 435.783 3.049 20 0 IGADMO COc1ccc2nc(C(F)(F)N3CCC4(CC(N(C)C)=[NH+]O4)CC3)nc(Cl)c2c1 ZINC001164874745 721326768 /nfs/dbraw/zinc/32/67/68/721326768.db2.gz IUDZWLBMUSOJQV-UHFFFAOYSA-N 1 1 425.867 3.471 20 0 IGADMO C[NH+]1CCC(Oc2ccnc(N3CCC4(C[C@@H](Oc5ncccc5F)CO4)CC3)c2)CC1 ZINC001164775939 721327652 /nfs/dbraw/zinc/32/76/52/721327652.db2.gz AVCLXWVIIQZPMU-HXUWFJFHSA-N 1 1 442.535 3.296 20 0 IGADMO COC(=O)c1cc(N2CCC[C@]3(C2)COCC[N@H+](Cc2c(C)noc2C)C3)ncc1Cl ZINC001164778044 721335584 /nfs/dbraw/zinc/33/55/84/721335584.db2.gz TVLYPMSLPJGEEM-QFIPXVFZSA-N 1 1 448.951 3.245 20 0 IGADMO COC(=O)c1cc(N2CCC[C@]3(C2)COCC[N@@H+](Cc2c(C)noc2C)C3)ncc1Cl ZINC001164778044 721335585 /nfs/dbraw/zinc/33/55/85/721335585.db2.gz TVLYPMSLPJGEEM-QFIPXVFZSA-N 1 1 448.951 3.245 20 0 IGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@@]2(CCCN(C(F)(F)c3nccc(Cl)n3)C2)C1 ZINC001164777347 721337032 /nfs/dbraw/zinc/33/70/32/721337032.db2.gz MEYBRDLRJIZXTD-IBGZPJMESA-N 1 1 441.910 3.399 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@@]2(CCCN(C(F)(F)c3nccc(Cl)n3)C2)C1 ZINC001164777347 721337035 /nfs/dbraw/zinc/33/70/35/721337035.db2.gz MEYBRDLRJIZXTD-IBGZPJMESA-N 1 1 441.910 3.399 20 0 IGADMO COc1ccc2ncnc(N3CCC[C@]4(C3)COCC[N@@H+](Cc3c(C)noc3C)C4)c2c1 ZINC001164778210 721340770 /nfs/dbraw/zinc/34/07/70/721340770.db2.gz LDSWGWLFCRQHQU-DEOSSOPVSA-N 1 1 437.544 3.362 20 0 IGADMO COC(=O)c1cc(Cl)cc(N2CCC[C@@]3(C2)COCC[N@H+](Cc2c(C)noc2C)C3)n1 ZINC001164777315 721341004 /nfs/dbraw/zinc/34/10/04/721341004.db2.gz FZZVJZBCWUFYTP-JOCHJYFZSA-N 1 1 448.951 3.245 20 0 IGADMO COC(=O)c1cc(Cl)cc(N2CCC[C@@]3(C2)COCC[N@@H+](Cc2c(C)noc2C)C3)n1 ZINC001164777315 721341011 /nfs/dbraw/zinc/34/10/11/721341011.db2.gz FZZVJZBCWUFYTP-JOCHJYFZSA-N 1 1 448.951 3.245 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@]2(CCCN(c3nc(Cl)nc4cnccc43)C2)C1 ZINC001164779731 721344300 /nfs/dbraw/zinc/34/43/00/721344300.db2.gz VBLFPVLKSLDDSA-JOCHJYFZSA-N 1 1 442.951 3.402 20 0 IGADMO COc1c(Cl)nc(C)nc1N1CCC[C@]2(C1)COCC[N@H+](Cc1c(C)noc1C)C2 ZINC001164779964 721350696 /nfs/dbraw/zinc/35/06/96/721350696.db2.gz XFMSOEVWZSNYNJ-NRFANRHFSA-N 1 1 435.956 3.171 20 0 IGADMO COc1c(Cl)nc(C)nc1N1CCC[C@]2(C1)COCC[N@@H+](Cc1c(C)noc1C)C2 ZINC001164779964 721350699 /nfs/dbraw/zinc/35/06/99/721350699.db2.gz XFMSOEVWZSNYNJ-NRFANRHFSA-N 1 1 435.956 3.171 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@]2(CCCN(c3ncnc4cc(Cl)cnc43)C2)C1 ZINC001164780036 721355271 /nfs/dbraw/zinc/35/52/71/721355271.db2.gz CNJVOBWHCXGGTC-JOCHJYFZSA-N 1 1 442.951 3.402 20 0 IGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@@]2(CCCN(c3nccc(N4CCCCC4)n3)C2)C1 ZINC001164780315 721357239 /nfs/dbraw/zinc/35/72/39/721357239.db2.gz GAWBZURKAMBYBR-DEOSSOPVSA-N 1 1 440.592 3.191 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@@]2(CCCN(c3nccc(N4CCCCC4)n3)C2)C1 ZINC001164780315 721357241 /nfs/dbraw/zinc/35/72/41/721357241.db2.gz GAWBZURKAMBYBR-DEOSSOPVSA-N 1 1 440.592 3.191 20 0 IGADMO CCOCc1cnc(Cl)nc1N1CCC[C@]2(C1)COCC[N@H+](Cc1c(C)noc1C)C2 ZINC001164782304 721362824 /nfs/dbraw/zinc/36/28/24/721362824.db2.gz MSQYVHNXWRUYTM-QFIPXVFZSA-N 1 1 449.983 3.390 20 0 IGADMO CCOCc1cnc(Cl)nc1N1CCC[C@]2(C1)COCC[N@@H+](Cc1c(C)noc1C)C2 ZINC001164782304 721362827 /nfs/dbraw/zinc/36/28/27/721362827.db2.gz MSQYVHNXWRUYTM-QFIPXVFZSA-N 1 1 449.983 3.390 20 0 IGADMO Cc1noc(-c2ccnc(N3CCC[C@]4(C3)COCC[N@H+](Cc3c(C)noc3C)C4)c2)n1 ZINC001164782938 721367458 /nfs/dbraw/zinc/36/74/58/721367458.db2.gz NVCWODYWBHQADE-QHCPKHFHSA-N 1 1 438.532 3.164 20 0 IGADMO Cc1noc(-c2ccnc(N3CCC[C@]4(C3)COCC[N@@H+](Cc3c(C)noc3C)C4)c2)n1 ZINC001164782938 721367462 /nfs/dbraw/zinc/36/74/62/721367462.db2.gz NVCWODYWBHQADE-QHCPKHFHSA-N 1 1 438.532 3.164 20 0 IGADMO Cc1noc(C)c1C[N@H+]1CCOC[C@@]2(CCCN(c3nccnc3OCC(C)C)C2)C1 ZINC001164781320 721371171 /nfs/dbraw/zinc/37/11/71/721371171.db2.gz ISJMZHWHCICSCN-QHCPKHFHSA-N 1 1 429.565 3.235 20 0 IGADMO Cc1noc(C)c1C[N@@H+]1CCOC[C@@]2(CCCN(c3nccnc3OCC(C)C)C2)C1 ZINC001164781320 721371176 /nfs/dbraw/zinc/37/11/76/721371176.db2.gz ISJMZHWHCICSCN-QHCPKHFHSA-N 1 1 429.565 3.235 20 0 IGADMO CC[N@H+]1CCCC[C@@H]1c1ccc(N2C[C@@H]3CCCO[C@@H]3[C@@H](NC(=O)c3cccnc3)C2)nc1 ZINC001164788541 721381859 /nfs/dbraw/zinc/38/18/59/721381859.db2.gz ZPFJMPHDJSXXSX-UCKMRUJXSA-N 1 1 449.599 3.437 20 0 IGADMO C[NH+]1CCN(C[C@H]2CCC[C@@]3(CCN(C(F)(F)c4ccc(F)c(Cl)n4)C3)O2)CC1 ZINC001164886753 721389454 /nfs/dbraw/zinc/38/94/54/721389454.db2.gz GDTMQFCWYAGNSQ-BEFAXECRSA-N 1 1 432.918 3.184 20 0 IGADMO Clc1nc(Cl)c2nc(Cl)nc(N3C[C@H]4C[NH+](Cc5nccs5)C[C@@H]4C3)c2n1 ZINC001164782851 721399925 /nfs/dbraw/zinc/39/99/25/721399925.db2.gz GBCZMKUZNPGUPW-RKDXNWHRSA-N 1 1 442.763 3.405 20 0 IGADMO C[NH+]1CCN(C[C@@H]2CCC[C@@]3(CCN(C(F)(F)c4cnc(Cl)c(F)c4)C3)O2)CC1 ZINC001164885631 721406694 /nfs/dbraw/zinc/40/66/94/721406694.db2.gz GWGBKCSWFWIPPO-LPHOPBHVSA-N 1 1 432.918 3.184 20 0 IGADMO C[NH+]1CCN(C[C@H]2CCC[C@@]3(CCN(c4nccc(-c5c[nH]c6ccccc56)n4)C3)O2)CC1 ZINC001164888955 721408403 /nfs/dbraw/zinc/40/84/03/721408403.db2.gz PUVWHGDTTMWMDE-IBVKSMDESA-N 1 1 446.599 3.390 20 0 IGADMO CC(C)(C)C(=O)OCn1ccc2c1ncnc2N1C[C@H]2C[NH+](Cc3nccs3)C[C@@H]2C1 ZINC001164789554 721410621 /nfs/dbraw/zinc/41/06/21/721410621.db2.gz VCCGLEPEZFWSHH-HZPDHXFCSA-N 1 1 440.573 3.003 20 0 IGADMO C[NH+]1CCN(C[C@H]2CCC[C@]3(CCN(c4ncccc4OCc4ccccc4)C3)O2)CC1 ZINC001164892214 721432581 /nfs/dbraw/zinc/43/25/81/721432581.db2.gz HSLJVZBZYDWPEM-ZEQKJWHPSA-N 1 1 436.600 3.426 20 0 IGADMO Cc1cc(N2CC[C@]3(C2)CCC[C@@H](CN2CC[NH+](C)CC2)O3)nc(-c2cccs2)n1 ZINC001164899510 721440727 /nfs/dbraw/zinc/44/07/27/721440727.db2.gz YSNJLXWGWJSVJX-CVDCTZTESA-N 1 1 427.618 3.279 20 0 IGADMO C[NH+]1CCN(C[C@@H]2CCC[C@]3(CCN(c4nccc(Oc5ccc(F)cc5)n4)C3)O2)CC1 ZINC001164892222 721440758 /nfs/dbraw/zinc/44/07/58/721440758.db2.gz HTUVIXKXSRRAJV-XUZZJYLKSA-N 1 1 441.551 3.173 20 0 IGADMO CSc1ccc2ncnc(N3CC[C@]4(C3)CCC[C@H](CN3CC[NH+](C)CC3)O4)c2c1 ZINC001164886524 721447823 /nfs/dbraw/zinc/44/78/23/721447823.db2.gz GYJSWKWUEBLNJP-JPYJTQIMSA-N 1 1 427.618 3.117 20 0 IGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1ncc(C)c(N3CCCC3)n1)CC2 ZINC001164790554 721448001 /nfs/dbraw/zinc/44/80/01/721448001.db2.gz ZCWHELSFXDETAZ-JOCHJYFZSA-N 1 1 443.636 3.119 20 0 IGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1c[nH]c3ncnc(Cl)c13)CC2 ZINC001164790192 721452569 /nfs/dbraw/zinc/45/25/69/721452569.db2.gz XHRVXFZSVBSZTQ-KRWDZBQOSA-N 1 1 433.984 3.297 20 0 IGADMO CCOC(=O)c1cc(C)cc(N2CCC3(C[C@@H](COCC4CC4)[N@@H+](CCOC)C3)CC2)n1 ZINC001164785226 721454001 /nfs/dbraw/zinc/45/40/01/721454001.db2.gz HMHHSGDNQTUMGI-NRFANRHFSA-N 1 1 445.604 3.301 20 0 IGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1ncc3ccc(OC)cc3n1)CC2 ZINC001164787621 721455815 /nfs/dbraw/zinc/45/58/15/721455815.db2.gz OWKKUHUFSRILSO-NRFANRHFSA-N 1 1 440.588 3.372 20 0 IGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1nc(C)nc(Cl)c1OC)CC2 ZINC001164788642 721459635 /nfs/dbraw/zinc/45/96/35/721459635.db2.gz VBNNKBGGWGHLFX-GOSISDBHSA-N 1 1 439.000 3.181 20 0 IGADMO CCOC(=O)c1cc(C)cnc1N1CCC2(C[C@H](COCC3CC3)[N@@H+](CCOC)C2)CC1 ZINC001164789216 721460053 /nfs/dbraw/zinc/46/00/53/721460053.db2.gz VWGXHSOEPOLWEK-OAQYLSRUSA-N 1 1 445.604 3.301 20 0 IGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1ncnc3[nH]c(C)c(C)c31)CC2 ZINC001164785013 721460576 /nfs/dbraw/zinc/46/05/76/721460576.db2.gz LFIMBUPTCIHGPK-HXUWFJFHSA-N 1 1 427.593 3.309 20 0 IGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1ccnc(N3CCCCC3)n1)CC2 ZINC001164790667 721466903 /nfs/dbraw/zinc/46/69/03/721466903.db2.gz UHVMNYKUFSYLHV-QFIPXVFZSA-N 1 1 443.636 3.201 20 0 IGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1cc(N3CCCCC3)ncn1)CC2 ZINC001164787987 721467025 /nfs/dbraw/zinc/46/70/25/721467025.db2.gz HIZRRQFFVLEIKZ-QFIPXVFZSA-N 1 1 443.636 3.201 20 0 IGADMO COCC[N@H+]1CC2(C[C@H]1COCC1CC1)CCN(c1cc(-c3ccncc3)ncn1)CC2 ZINC001164791676 721467820 /nfs/dbraw/zinc/46/78/20/721467820.db2.gz XNGBZDIYJKKTOP-QFIPXVFZSA-N 1 1 437.588 3.273 20 0 IGADMO COCC[N@H+]1CC2(C[C@@H]1COCC1CC1)CCN(c1ccc(-c3nc(C)no3)cn1)CC2 ZINC001164788773 721467881 /nfs/dbraw/zinc/46/78/81/721467881.db2.gz KGXAJQCQQBIAJP-OAQYLSRUSA-N 1 1 441.576 3.174 20 0 IGADMO C[NH+]1CCC(Oc2ccnc(N3CCCC[C@]34CC(=O)N(Cc3cccnc3)C4)c2)CC1 ZINC001164893943 721476070 /nfs/dbraw/zinc/47/60/70/721476070.db2.gz KLDLFVPDRZNVBQ-RUZDIDTESA-N 1 1 435.572 3.111 20 0 IGADMO CCOC(=O)c1nc2ccccc2c(N2CC[N@H+]3C[C@H](Oc4cccc(F)c4)C[C@@H]3C2)n1 ZINC001164900064 721514532 /nfs/dbraw/zinc/51/45/32/721514532.db2.gz NRPHPFZUFYMFTO-IEBWSBKVSA-N 1 1 436.487 3.288 20 0 IGADMO O=C(NCc1ccccc1)c1cccnc1N1CC[N@H+]2C[C@@H](Oc3cccc(F)c3)C[C@@H]2C1 ZINC001164899976 721515231 /nfs/dbraw/zinc/51/52/31/721515231.db2.gz MWROAUDICTVMCC-GGAORHGYSA-N 1 1 446.526 3.493 20 0 IGADMO CN(C)c1cc(Cl)nc(C(F)(F)N2CC[N@H+]3C[C@H](Oc4cccc(F)c4)C[C@@H]3C2)n1 ZINC001164901452 721518914 /nfs/dbraw/zinc/51/89/14/721518914.db2.gz XPALCKOYFMMGOB-GDBMZVCRSA-N 1 1 441.885 3.222 20 0 IGADMO CCOC(=O)c1c(Cl)cc(C)nc1N1C[C@H]([N@H+](C)Cc2cccnc2)[C@@H]2OCCC[C@H]21 ZINC001164806081 721528964 /nfs/dbraw/zinc/52/89/64/721528964.db2.gz NROGUKUPWFDMBW-SVFBPWRDSA-N 1 1 444.963 3.483 20 0 IGADMO CCOC(=O)c1c(Cl)cc(C)nc1N1C[C@H]([N@@H+](C)Cc2cccnc2)[C@@H]2OCCC[C@H]21 ZINC001164806081 721528967 /nfs/dbraw/zinc/52/89/67/721528967.db2.gz NROGUKUPWFDMBW-SVFBPWRDSA-N 1 1 444.963 3.483 20 0 IGADMO CCOC(=O)c1cc(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@H]3OCCC[C@H]32)ncc1Cl ZINC001164805503 721530569 /nfs/dbraw/zinc/53/05/69/721530569.db2.gz LYMMUGOBXKNGPX-DYXWJJEUSA-N 1 1 430.936 3.175 20 0 IGADMO CCOC(=O)c1cc2ncnc(N3CC[N@H+]4C[C@@H](Oc5cccc(F)c5)C[C@H]4C3)c2s1 ZINC001164907292 721545519 /nfs/dbraw/zinc/54/55/19/721545519.db2.gz MVARGZDGCPPVAJ-RDJZCZTQSA-N 1 1 442.516 3.349 20 0 IGADMO CCOC(=O)c1cc2ccnc(N3C[C@H]([N@@H+](C)Cc4cccnc4)[C@H]4OCCC[C@H]43)c2[nH]1 ZINC001164803066 721547858 /nfs/dbraw/zinc/54/78/58/721547858.db2.gz HQFDKIOYRDHLNY-URVUXULASA-N 1 1 435.528 3.003 20 0 IGADMO CCOC(=O)c1ccc2ncnc(N3C[C@H]([N@H+](C)Cc4cccnc4)[C@@H]4OCCC[C@@H]43)c2c1 ZINC001164805712 721555093 /nfs/dbraw/zinc/55/50/93/721555093.db2.gz OOYYFZHMUJZOEX-RJGXRXQPSA-N 1 1 447.539 3.070 20 0 IGADMO CCOC(=O)c1ccc2ncnc(N3C[C@H]([N@@H+](C)Cc4cccnc4)[C@@H]4OCCC[C@@H]43)c2c1 ZINC001164805712 721555096 /nfs/dbraw/zinc/55/50/96/721555096.db2.gz OOYYFZHMUJZOEX-RJGXRXQPSA-N 1 1 447.539 3.070 20 0 IGADMO Fc1cccc(O[C@H]2C[C@H]3CN(c4ncnc5c4ncn5-c4ccccc4)CC[N@H+]3C2)c1 ZINC001164905891 721562412 /nfs/dbraw/zinc/56/24/12/721562412.db2.gz HUGQULFEPAYMFU-FPOVZHCZSA-N 1 1 430.487 3.297 20 0 IGADMO CN(C)c1ccc(-c2ccnc(N3C[C@H]([N@H+](C)Cc4cccnc4)[C@@H]4OCCC[C@H]43)n2)cc1 ZINC001164806651 721570524 /nfs/dbraw/zinc/57/05/24/721570524.db2.gz QKGMWQHVERIKON-DSNGMDLFSA-N 1 1 444.583 3.473 20 0 IGADMO CN(C)c1ccc(-c2ccnc(N3C[C@H]([N@@H+](C)Cc4cccnc4)[C@@H]4OCCC[C@H]43)n2)cc1 ZINC001164806651 721570528 /nfs/dbraw/zinc/57/05/28/721570528.db2.gz QKGMWQHVERIKON-DSNGMDLFSA-N 1 1 444.583 3.473 20 0 IGADMO COc1ccccc1-c1cc(N2C[C@H]([N@H+](C)Cc3cccnc3)[C@H]3OCCC[C@H]32)ncn1 ZINC001164809446 721581428 /nfs/dbraw/zinc/58/14/28/721581428.db2.gz SAOWCSXFKNTATL-SLSDLSHTSA-N 1 1 431.540 3.415 20 0 IGADMO COc1ccccc1-c1cc(N2C[C@H]([N@@H+](C)Cc3cccnc3)[C@H]3OCCC[C@H]32)ncn1 ZINC001164809446 721581430 /nfs/dbraw/zinc/58/14/30/721581430.db2.gz SAOWCSXFKNTATL-SLSDLSHTSA-N 1 1 431.540 3.415 20 0 IGADMO C[C@@H]1CN(c2ccc(C[N@@H+](C)C3CC3)cn2)CC[C@@]12CC[C@@H](C(=O)Nc1cccnc1)O2 ZINC001165010740 721692033 /nfs/dbraw/zinc/69/20/33/721692033.db2.gz WUMZIWRITIXZCK-MOADCYBESA-N 1 1 435.572 3.474 20 0 IGADMO CC(C)N(C)Cc1nnc2n1CCCN(c1[nH+]cnc3c1ccn3Cc1ccc(F)cc1)C2 ZINC001165011694 721706373 /nfs/dbraw/zinc/70/63/73/721706373.db2.gz WDKFQRHMJXGXOD-UHFFFAOYSA-N 1 1 448.550 3.461 20 0 IGADMO CC(C)c1nc(N(C)C)nc(N2CCC(F)(F)[C@@]3(CC[N@@H+](Cc4ccccn4)C3)C2)n1 ZINC001164908550 721710912 /nfs/dbraw/zinc/71/09/12/721710912.db2.gz XWIMCQRYTJZJBK-OAQYLSRUSA-N 1 1 431.535 3.194 20 0 IGADMO FC1(F)CCN(c2ncc3ncnc(Cl)c3n2)C[C@]12CC[N@@H+](Cc1ccccn1)C2 ZINC001164906635 721715463 /nfs/dbraw/zinc/71/54/63/721715463.db2.gz NJYYOPVKQJGLHJ-LJQANCHMSA-N 1 1 431.878 3.206 20 0 IGADMO CN(C)C(=O)C[NH+]1CCC2(CCCN2C(F)(F)c2nc3ccsc3c(Cl)n2)CC1 ZINC001165011898 721732673 /nfs/dbraw/zinc/73/26/73/721732673.db2.gz WISNJILEXQDUQF-UHFFFAOYSA-N 1 1 443.951 3.413 20 0 IGADMO COCCOC(=O)c1ccnc(N2CCC(F)(F)[C@@]3(CC[N@@H+](Cc4ccccn4)C3)C2)c1 ZINC001164909771 721733955 /nfs/dbraw/zinc/73/39/55/721733955.db2.gz DPRGDBVLOPBPGO-JOCHJYFZSA-N 1 1 446.498 3.018 20 0 IGADMO COC(=O)c1cc(Cl)nc(N2CCc3c(C[N@H+](C)Cc4ccco4)cncc3C2)n1 ZINC001164910003 721744195 /nfs/dbraw/zinc/74/41/95/721744195.db2.gz XILPLTRPXSXZQF-UHFFFAOYSA-N 1 1 427.892 3.099 20 0 IGADMO COC(=O)c1cc(Cl)nc(N2CCc3c(C[N@@H+](C)Cc4ccco4)cncc3C2)n1 ZINC001164910003 721744198 /nfs/dbraw/zinc/74/41/98/721744198.db2.gz XILPLTRPXSXZQF-UHFFFAOYSA-N 1 1 427.892 3.099 20 0 IGADMO Cc1cc(Cl)nc(N2CCc3c(C[N@H+](C)Cc4ccco4)cncc3C2)c1C(N)=O ZINC001164908901 721746296 /nfs/dbraw/zinc/74/62/96/721746296.db2.gz OBEZGATWFKNEFH-UHFFFAOYSA-N 1 1 425.920 3.325 20 0 IGADMO Cc1cc(Cl)nc(N2CCc3c(C[N@@H+](C)Cc4ccco4)cncc3C2)c1C(N)=O ZINC001164908901 721746298 /nfs/dbraw/zinc/74/62/98/721746298.db2.gz OBEZGATWFKNEFH-UHFFFAOYSA-N 1 1 425.920 3.325 20 0 IGADMO CCOC(=O)c1cnc(Cl)nc1N1C[C@@H]2CCC[C@H]([N@@H+](C)Cc3ccccn3)[C@@H]2C1 ZINC001165025412 721800408 /nfs/dbraw/zinc/80/04/08/721800408.db2.gz NZPKHJXKUOMJBO-IPELMVKDSA-N 1 1 429.952 3.439 20 0 IGADMO CCOC(=O)c1cc(Cl)nnc1N1C[C@@H]2CCC[C@@H]([N@@H+](C)Cc3ccccn3)[C@@H]2C1 ZINC001165027329 721806305 /nfs/dbraw/zinc/80/63/05/721806305.db2.gz VNJMPTJNILSLKR-KFKAGJAMSA-N 1 1 429.952 3.439 20 0 IGADMO C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@H]2CN(c3nc(Cl)c(F)c4c3C(=O)NC4)C[C@@H]21 ZINC001165025357 721815408 /nfs/dbraw/zinc/81/54/08/721815408.db2.gz MUHCCHOLYFMPBJ-RRQGHBQHSA-N 1 1 429.927 3.249 20 0 IGADMO COC(=O)c1cc(Cl)nc(N2CCC3(CC2)C[N@@H+](Cc2ccc(C)cc2)CCO3)n1 ZINC001164937611 721920853 /nfs/dbraw/zinc/92/08/53/721920853.db2.gz FCOYLQKNZURKNU-UHFFFAOYSA-N 1 1 430.936 3.096 20 0 IGADMO CCOC(=O)c1cnc(N2CCC3(CC2)C[N@@H+](Cc2ccc(C)cc2)CCO3)c(OC)c1 ZINC001164940740 721928376 /nfs/dbraw/zinc/92/83/76/721928376.db2.gz ZPULTRIYFOKAEX-UHFFFAOYSA-N 1 1 439.556 3.447 20 0 IGADMO Cc1noc(C)c1CN1CCO[C@H]2CN(c3nc(Cl)ccc3C[NH+]3CCCC3)C[C@H]21 ZINC001164940281 721948767 /nfs/dbraw/zinc/94/87/67/721948767.db2.gz AVQQKFOMEAORBH-UXHICEINSA-N 1 1 431.968 3.025 20 0 IGADMO COC[C@]12COC[C@@H]1CN(c1nc(C[NH+]3CCCC3)nc3sc4c(c31)CCCC4)C2 ZINC001164946956 721994936 /nfs/dbraw/zinc/99/49/36/721994936.db2.gz BGHYSDIZZSLIPE-QMHKHESXSA-N 1 1 428.602 3.265 20 0 IGADMO CCOC(=O)Cc1c(Cl)ncnc1N1CCC2(CC[N@@H+](Cc3cccnc3)C2)CC1 ZINC001164952962 722018232 /nfs/dbraw/zinc/01/82/32/722018232.db2.gz PVNHVXFSIHQDCX-UHFFFAOYSA-N 1 1 429.952 3.123 20 0 IGADMO COc1cc(OC)c2ncnc(N3CCC4(CC3)COCC[N@@H+](Cc3ccncc3)C4)c2c1 ZINC001164966498 722062536 /nfs/dbraw/zinc/06/25/36/722062536.db2.gz VBPBWOSQQQGVSC-UHFFFAOYSA-N 1 1 449.555 3.161 20 0 IGADMO CC(=O)N1CCC[C@@]2(C1)CN(c1nc(C[NH+]3CCCC3)nc3sc(C)c(C)c31)CCO2 ZINC001164968543 722083864 /nfs/dbraw/zinc/08/38/64/722083864.db2.gz DMTVXUJZHNQNPU-HSZRJFAPSA-N 1 1 443.617 3.122 20 0 IGADMO COC(=O)c1ccc2ccnc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)c2c1 ZINC001164979223 722111093 /nfs/dbraw/zinc/11/10/93/722111093.db2.gz PQWABNJBLSFCFN-FYYLOGMGSA-N 1 1 432.524 3.144 20 0 IGADMO CSc1nc2c(c(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@H]4C3)n1)CCCC2 ZINC001164981844 722114006 /nfs/dbraw/zinc/11/40/06/722114006.db2.gz VIJOXCFJQBTWQP-NQIIRXRSSA-N 1 1 425.602 3.200 20 0 IGADMO COc1ccc(C(F)(F)N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@@H]3C2)c(Cl)n1 ZINC001164973888 722115382 /nfs/dbraw/zinc/11/53/82/722115382.db2.gz HVEKDBQXWGFKSO-FUHWJXTLSA-N 1 1 438.906 3.411 20 0 IGADMO CCOC(=O)c1cnc(Cl)c(C)c1N1CC[C@@H]2C[N@@H+](Cc3cccnc3)CCO[C@H]2C1 ZINC001164973844 722124376 /nfs/dbraw/zinc/12/43/76/722124376.db2.gz HLWQNXRALPMNJY-QUCCMNQESA-N 1 1 444.963 3.342 20 0 IGADMO Cc1nc(C(F)(F)N2CC[C@@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)nc(Cl)c1C ZINC001164981017 722128464 /nfs/dbraw/zinc/12/84/64/722128464.db2.gz SAZYRORUYQZEPN-MSOLQXFVSA-N 1 1 437.922 3.414 20 0 IGADMO CN(C)c1ccc(-c2ccnc(N3CC[C@@H]4C[N@@H+](Cc5cccnc5)CCO[C@@H]4C3)n2)cc1 ZINC001164978025 722133857 /nfs/dbraw/zinc/13/38/57/722133857.db2.gz JDUPJUAAZYHQRJ-RCZVLFRGSA-N 1 1 444.583 3.332 20 0 IGADMO FC(F)(c1c2c(nnc1Cl)CCC2)N1CC[C@H]2C[N@@H+](Cc3cccnc3)CCO[C@H]2C1 ZINC001164982711 722143203 /nfs/dbraw/zinc/14/32/03/722143203.db2.gz SETMZUXMSALMOM-LPHOPBHVSA-N 1 1 449.933 3.286 20 0 IGADMO CCCSc1ncnc(N2CC[C@H]3C[N@@H+](Cc4cccnc4)CCO[C@H]3C2)c1OC ZINC001164971684 722155975 /nfs/dbraw/zinc/15/59/75/722155975.db2.gz CYQNMYVLXWQYHN-OALUTQOASA-N 1 1 429.590 3.110 20 0 IGADMO Cc1nc(CN2CCO[C@@H]3CCN(c4cc(N5CCCC5)nc(C)[nH+]4)CC[C@H]32)cs1 ZINC001164987088 722176003 /nfs/dbraw/zinc/17/60/03/722176003.db2.gz MJJNLRKOLJBHOS-WOJBJXKFSA-N 1 1 428.606 3.020 20 0 IGADMO Cc1nc(CN2CCO[C@@H]3CCN(c4ccc(C[N@H+](C)C5CC5)cn4)CC[C@@H]32)cs1 ZINC001164992985 722185672 /nfs/dbraw/zinc/18/56/72/722185672.db2.gz YMUIUHIXOQGNQH-FCHUYYIVSA-N 1 1 427.618 3.311 20 0 IGADMO Fc1cccc(C[N@H+]2CC[C@@]23CCCN(c2nc(Cl)ncc2N2CCOCC2)C3)c1 ZINC001164994453 722200323 /nfs/dbraw/zinc/20/03/23/722200323.db2.gz HFTZPDHTSUISQC-JOCHJYFZSA-N 1 1 431.943 3.351 20 0 IGADMO C[NH+]1CCN(c2ncnc3c2CCN(c2nc(Cl)nc4c(Cl)cccc42)CC3)CC1 ZINC001164997546 722232587 /nfs/dbraw/zinc/23/25/87/722232587.db2.gz PERXPDLRJCPTPW-UHFFFAOYSA-N 1 1 444.370 3.084 20 0 IGADMO C[NH+]1CCN(c2ncnc3c2CCN(c2nc(Cl)cc(C4CCCCC4)n2)CC3)CC1 ZINC001165001827 722239703 /nfs/dbraw/zinc/23/97/03/722239703.db2.gz MTDGLVKVXBODEZ-UHFFFAOYSA-N 1 1 442.011 3.325 20 0 IGADMO