smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name O=C(CN1CCO[C@]2(CCc3ccccc32)C1)Nc1cc(Cl)ccc1F ZINC000159605354 206225364 /nfs/dbraw/zinc/22/53/64/206225364.db2.gz CRKGUTUYDMSDAX-HXUWFJFHSA-N 0 0 374.843 3.592 50 70 FHIARN O=C(N[C@H]1CCOC2(CCOCC2)C1)c1ccccc1-c1ccc(F)cc1 ZINC000217039716 206362116 /nfs/dbraw/zinc/36/21/16/206362116.db2.gz YOJMDNWWHMIBEI-SFHVURJKSA-N 0 0 369.436 3.951 50 70 FHIARN O=C(c1ccc2c(c1)CCO2)N1CCC[C@@H]1c1nc2cc(F)ccc2[nH]1 ZINC000217374990 206362377 /nfs/dbraw/zinc/36/23/77/206362377.db2.gz NVJJOAOVYNAJAI-QGZVFWFLSA-N 0 0 351.381 3.614 50 70 FHIARN O=C([C@H]1Cc2cc(Cl)ccc2N1)N1CCC(Oc2ccccc2F)CC1 ZINC000217449014 206362494 /nfs/dbraw/zinc/36/24/94/206362494.db2.gz HVMTYHGQYNQBCZ-GOSISDBHSA-N 0 0 374.843 3.886 50 70 FHIARN COc1cccc([C@@H]2SCCN2C(=O)c2ccc(Br)o2)c1 ZINC000217638189 206364399 /nfs/dbraw/zinc/36/43/99/206364399.db2.gz IRRBRMWJLCXYSC-HNNXBMFYSA-N 0 0 368.252 3.939 50 70 FHIARN COc1cccc([C@H]2SCCN2C(=O)Nc2ccc3c(c2)OCO3)c1 ZINC000217640103 206364816 /nfs/dbraw/zinc/36/48/16/206364816.db2.gz OVSBFBMFLFYKBB-QGZVFWFLSA-N 0 0 358.419 3.703 50 70 FHIARN COCCn1cc(CC(=O)Nc2ccc3c(ccn3C)c2)c2ccccc21 ZINC000217837399 206366281 /nfs/dbraw/zinc/36/62/81/206366281.db2.gz DPOQMYHJRPMECB-UHFFFAOYSA-N 0 0 361.445 3.961 50 70 FHIARN COc1ccc2c(c1)CCC[C@@]2(O)CNC(=O)Nc1ccccc1Cl ZINC000218013405 206367034 /nfs/dbraw/zinc/36/70/34/206367034.db2.gz CLZUTYKZEHJYGT-LJQANCHMSA-N 0 0 360.841 3.694 50 70 FHIARN Cc1nn(C(C)C)c(C)c1NC(=O)c1n[nH]c2c1COc1ccccc1-2 ZINC000218155293 206367138 /nfs/dbraw/zinc/36/71/38/206367138.db2.gz KNGNFFRXMMNWAL-UHFFFAOYSA-N 0 0 351.410 3.616 50 70 FHIARN O=C(NCc1ccccn1)c1sc(Br)nc1-c1ccccc1 ZINC000218485346 206370360 /nfs/dbraw/zinc/37/03/60/206370360.db2.gz YXOUNRMTVVACCF-UHFFFAOYSA-N 0 0 374.263 3.898 50 70 FHIARN Cc1n[nH]c(C)c1CCNC(=O)c1cc(N2CCCCC2)ccc1Cl ZINC000217131370 132272068 /nfs/dbraw/zinc/27/20/68/132272068.db2.gz PSOZHGLRQKQOQC-UHFFFAOYSA-N 0 0 360.889 3.643 50 70 FHIARN CCNc1nc(C)c(C(=O)N(C)Cc2cc(-c3ccccc3)on2)s1 ZINC000217825345 520353655 /nfs/dbraw/zinc/35/36/55/520353655.db2.gz QOEJMJXAMLRPMZ-UHFFFAOYSA-N 0 0 356.451 3.811 50 70 FHIARN Cc1cc2c(ncnc2SCC(=O)N2CCC[C@@H]2c2ccccn2)s1 ZINC000217777948 525623766 /nfs/dbraw/zinc/62/37/66/525623766.db2.gz HINHTMUDCZEAMQ-OAHLLOKOSA-N 0 0 370.503 3.851 50 70 FHIARN Cc1cc(-c2ccncc2)nn1CCNC(=O)c1cccc2ccccc21 ZINC000217868441 526043624 /nfs/dbraw/zinc/04/36/24/526043624.db2.gz MZUMJHFFLZZLQI-UHFFFAOYSA-N 0 0 356.429 3.837 50 70 FHIARN Cc1nc([C@@H](C)NC(=O)Cc2c(C)nn(-c3ccccc3)c2C)c(C)s1 ZINC000218311731 527027469 /nfs/dbraw/zinc/02/74/69/527027469.db2.gz YTPRRLKGVRRQBM-CYBMUJFWSA-N 0 0 368.506 3.982 50 70 FHIARN Cn1nc(CN(Cc2ccco2)C(=O)/C=C/c2cccs2)c2c1CCC2 ZINC000217902275 527554144 /nfs/dbraw/zinc/55/41/44/527554144.db2.gz PKTAZPPERWSEQR-MDZDMXLPSA-N 0 0 367.474 3.806 50 70 FHIARN O=C(NCc1csc(-c2ccccc2)n1)N1CCC(c2cc[nH]n2)CC1 ZINC000160080638 206226723 /nfs/dbraw/zinc/22/67/23/206226723.db2.gz YFVXDAHVCAUGFF-UHFFFAOYSA-N 0 0 367.478 3.622 50 70 FHIARN O=C(Nc1scnc1-c1ccccc1)[C@@H]1Cc2ccccc2C(=O)O1 ZINC000161416919 206228745 /nfs/dbraw/zinc/22/87/45/206228745.db2.gz LJOLIXYQFPYBPE-HNNXBMFYSA-N 0 0 350.399 3.530 50 70 FHIARN Cc1nc(-c2ccccc2NC(=O)c2cnn(-c3ccccc3)n2)cs1 ZINC000217650416 206364842 /nfs/dbraw/zinc/36/48/42/206364842.db2.gz JXZVCVMDASOSSL-UHFFFAOYSA-N 0 0 361.430 3.952 50 70 FHIARN O=C(N1CCO[C@@H](c2cccnc2)C1)C1(c2ccc(Cl)cc2)CCC1 ZINC000218239775 206368778 /nfs/dbraw/zinc/36/87/78/206368778.db2.gz CTXKJFUFULKYAY-GOSISDBHSA-N 0 0 356.853 3.757 50 70 FHIARN O=C(c1ccccc1OC(F)(F)C(F)F)N1CCC(c2cc[nH]n2)CC1 ZINC000218297315 206368811 /nfs/dbraw/zinc/36/88/11/206368811.db2.gz MTQBIXJQJSPDFF-UHFFFAOYSA-N 0 0 371.334 3.666 50 70 FHIARN O=C1C[C@H](c2ccc(OC(F)(F)F)cc2)c2cc3c(cc2O1)OCO3 ZINC000218316437 206368930 /nfs/dbraw/zinc/36/89/30/206368930.db2.gz GNWKEFBQNQDISG-LLVKDONJSA-N 0 0 352.264 3.755 50 70 FHIARN Cc1nc2sc([C@@H](c3cccc(F)c3)[NH+]3CCCCCC3)c([O-])n2n1 ZINC000218308358 206369078 /nfs/dbraw/zinc/36/90/78/206369078.db2.gz TVXPZRNUPKUJHG-OAHLLOKOSA-N 0 0 360.458 3.909 50 70 FHIARN CC(=O)Nc1ccc(C(=O)N[C@@H](c2ccncc2)c2ccc(F)cc2)cc1 ZINC000218323588 206369266 /nfs/dbraw/zinc/36/92/66/206369266.db2.gz GFCDQGOYGCTPKA-HXUWFJFHSA-N 0 0 363.392 3.699 50 70 FHIARN CSc1nc(C(=O)N[C@@H](C)c2ccc3c(c2)OCCCO3)cs1 ZINC000218410314 206370849 /nfs/dbraw/zinc/37/08/49/206370849.db2.gz VBJJSUAULGRWIM-JTQLQIEISA-N 0 0 350.465 3.517 50 70 FHIARN COCCn1c2ccccc2nc1[C@H](C)NC(=O)CCCc1ccccc1 ZINC000218316862 522077130 /nfs/dbraw/zinc/07/71/30/522077130.db2.gz LZODWTVHRMZBLO-KRWDZBQOSA-N 0 0 365.477 3.883 50 70 FHIARN Cc1cc2c(ncnc2SCC(=O)N[C@@H](C)c2csc(C)n2)s1 ZINC000217179484 525625092 /nfs/dbraw/zinc/62/50/92/525625092.db2.gz WQSWVUPURYNKBA-VIFPVBQESA-N 0 0 364.521 3.734 50 70 FHIARN Cc1cc2c(ncnc2SCC(=O)N2CCC[C@H]2c2ccccn2)s1 ZINC000217778017 525625252 /nfs/dbraw/zinc/62/52/52/525625252.db2.gz HINHTMUDCZEAMQ-HNNXBMFYSA-N 0 0 370.503 3.851 50 70 FHIARN Cc1cc(NC(=O)c2ccc(N(C)C)cc2F)n(Cc2ccccc2)n1 ZINC000160534862 571161525 /nfs/dbraw/zinc/16/15/25/571161525.db2.gz PIIXYMWVLISCBX-UHFFFAOYSA-N 0 0 352.413 3.697 50 70 FHIARN Cc1cc2c(c(=O)n1CCc1ccc(O)cc1)[C@@H](CC(C)C)CC(=O)O2 ZINC000218118726 571352443 /nfs/dbraw/zinc/35/24/43/571352443.db2.gz XJQAGZCDZLIXIQ-INIZCTEOSA-N 0 0 355.434 3.544 50 70 FHIARN O=C(Nc1ccn(CC(F)(F)F)n1)N1CCC[C@H](Nc2ccccc2)C1 ZINC000160849253 206228104 /nfs/dbraw/zinc/22/81/04/206228104.db2.gz NJQGFZDFUGBRJU-AWEZNQCLSA-N 0 0 367.375 3.554 50 70 FHIARN O=C(Nc1ccn(CC(F)(F)F)n1)N1CCC[C@@H](Nc2ccccc2)C1 ZINC000160849111 206228154 /nfs/dbraw/zinc/22/81/54/206228154.db2.gz NJQGFZDFUGBRJU-CQSZACIVSA-N 0 0 367.375 3.554 50 70 FHIARN COc1ccc(Cl)cc1NC(=O)c1c2c(nc3c1c(C)nn3C)CCC2 ZINC000218569284 206371425 /nfs/dbraw/zinc/37/14/25/206371425.db2.gz QLGHSVARANYCTJ-UHFFFAOYSA-N 0 0 370.840 3.680 50 70 FHIARN CC[C@@]1(C(N)=O)CCCN(C(=O)c2ccccc2-c2ccc(F)cc2)C1 ZINC000216967859 206360642 /nfs/dbraw/zinc/36/06/42/206360642.db2.gz UBDMTQINFVQMSP-OAQYLSRUSA-N 0 0 354.425 3.610 50 70 FHIARN CC[C@]1(C(N)=O)CCCN(C(=O)c2ccccc2-c2ccc(F)cc2)C1 ZINC000216967874 206361488 /nfs/dbraw/zinc/36/14/88/206361488.db2.gz UBDMTQINFVQMSP-NRFANRHFSA-N 0 0 354.425 3.610 50 70 FHIARN Cc1ccc(CN2CCCn3nc([C@@H](O)c4ccccc4)cc3C2)s1 ZINC000217784417 206366260 /nfs/dbraw/zinc/36/62/60/206366260.db2.gz VBDYQZMDVLZYDP-FQEVSTJZSA-N 0 0 353.491 3.741 50 70 FHIARN COc1ccc2c(c1)ncc(C(=O)N1CCC(c3ccccc3)CC1)c2O ZINC000218131940 206367093 /nfs/dbraw/zinc/36/70/93/206367093.db2.gz ZRHCMUDPHRUNRQ-UHFFFAOYSA-N 0 0 362.429 3.969 50 70 FHIARN COc1ccc2cc(NC(=O)CC3(n4cccc4)CCOCC3)cnc2c1 ZINC000218340778 206371055 /nfs/dbraw/zinc/37/10/55/206371055.db2.gz FGUSOBSEWFBHHQ-UHFFFAOYSA-N 0 0 365.433 3.579 50 70 FHIARN CC(C)n1c(CNC(=O)c2cc(-c3ccsc3)n[nH]2)nc2ccccc21 ZINC000216951382 519920921 /nfs/dbraw/zinc/92/09/21/519920921.db2.gz FDDOHYKHWNQIHW-UHFFFAOYSA-N 0 0 365.462 3.999 50 70 FHIARN Cc1cccc([C@@H]2CCCN(C(=O)c3cccc(N4CCOCC4)c3)C2)c1 ZINC000218296577 524842318 /nfs/dbraw/zinc/84/23/18/524842318.db2.gz QSAJPYUAGROYOG-OAQYLSRUSA-N 0 0 364.489 3.851 50 70 FHIARN O=C(Cc1cccc2ccccc21)N1CCC(OCc2ccccn2)CC1 ZINC000218025943 527271832 /nfs/dbraw/zinc/27/18/32/527271832.db2.gz BYGCKPONEZABTR-UHFFFAOYSA-N 0 0 360.457 3.985 50 70 FHIARN OC[C@@H](Nc1ncnc2sc3c(c21)CCC3)c1cc(F)c(F)c(F)c1 ZINC000160166868 206227065 /nfs/dbraw/zinc/22/70/65/206227065.db2.gz LGPOEBVZWGQRAQ-GFCCVEGCSA-N 0 0 365.380 3.743 50 70 FHIARN Cn1c(=O)cc(C(=O)Nc2nc(-c3cccs3)cs2)c2ccccc21 ZINC000218614483 206372474 /nfs/dbraw/zinc/37/24/74/206372474.db2.gz PLCTXGOBANOQTM-UHFFFAOYSA-N 0 0 367.455 3.976 50 70 FHIARN COc1ccc(C2(C(=O)N(C)Cc3cnc4ccccn34)CCCC2)cc1 ZINC000218716709 206373028 /nfs/dbraw/zinc/37/30/28/206373028.db2.gz FMFMRXPGWFUNEM-UHFFFAOYSA-N 0 0 363.461 3.813 50 70 FHIARN COc1cccc([C@H]2SCCN2C(=O)c2ccc3nsnc3c2)c1 ZINC000217637507 206363691 /nfs/dbraw/zinc/36/36/91/206363691.db2.gz AKMURHCPJPMOBK-QGZVFWFLSA-N 0 0 357.460 3.588 50 70 FHIARN O=C(c1nc2ccccc2s1)N1CCC[C@]2(C1)OC(=O)c1ccccc12 ZINC000217561919 206364383 /nfs/dbraw/zinc/36/43/83/206364383.db2.gz FRZIWOSXMFCTJI-HXUWFJFHSA-N 0 0 364.426 3.598 50 70 FHIARN O=C(c1ccc(F)cc1Cl)N1CC[C@@H](n2cc(-c3ccccc3)nn2)C1 ZINC000217655776 206364596 /nfs/dbraw/zinc/36/45/96/206364596.db2.gz OHMNNWPRSZQCKP-OAHLLOKOSA-N 0 0 370.815 3.825 50 70 FHIARN O=C(c1cnc(-c2cccs2)nc1)N1CCCC[C@@H]1c1ccccn1 ZINC000218343863 206370923 /nfs/dbraw/zinc/37/09/23/206370923.db2.gz XZDMOUOCWYJREJ-MRXNPFEDSA-N 0 0 350.447 3.968 50 70 FHIARN O=C(N[C@@H]1COCC[C@@H]1OCc1ccccc1)c1sccc1Cl ZINC000218380661 206370942 /nfs/dbraw/zinc/37/09/42/206370942.db2.gz BMZWGOQNCPHIBN-CABCVRRESA-N 0 0 351.855 3.506 50 70 FHIARN Cc1nnc(CN(C)C(=O)c2ccccc2Cc2ccc(C)c(F)c2)o1 ZINC000217953504 526331225 /nfs/dbraw/zinc/33/12/25/526331225.db2.gz XCOHXRJPFWKMGK-UHFFFAOYSA-N 0 0 353.397 3.689 50 70 FHIARN O=C(CCSc1ccccc1)N1CCC[C@H](Cc2nc(C3CC3)no2)C1 ZINC000217812900 526542463 /nfs/dbraw/zinc/54/24/63/526542463.db2.gz BZNNBNHLXWBXJP-OAHLLOKOSA-N 0 0 371.506 3.911 50 70 FHIARN O=C(/C=C/c1ccco1)NCCn1nc(-c2ccsc2)cc1C1CC1 ZINC000217876963 527640534 /nfs/dbraw/zinc/64/05/34/527640534.db2.gz YWHGZGYIWXUWHH-AATRIKPKSA-N 0 0 353.447 3.912 50 70 FHIARN O=C(Cc1cccc(C(F)(F)F)c1)Nc1cnn(CC2CCOCC2)c1 ZINC000218231257 571352903 /nfs/dbraw/zinc/35/29/03/571352903.db2.gz PYVGXSDXGMGAEV-UHFFFAOYSA-N 0 0 367.371 3.510 50 70 FHIARN COc1ccc([C@H]2CC(=O)Oc3ccc4c(c32)OC(C)(C)CC4=O)cc1 ZINC000217609153 206364508 /nfs/dbraw/zinc/36/45/08/206364508.db2.gz STECWHGPRFVUOV-OAHLLOKOSA-N 0 0 352.386 3.880 50 70 FHIARN Cc1ccsc1CN1CCCn2nc([C@H](O)c3ccccc3)cc2C1 ZINC000217813598 206365398 /nfs/dbraw/zinc/36/53/98/206365398.db2.gz CYIXYNQNNBLROS-HXUWFJFHSA-N 0 0 353.491 3.741 50 70 FHIARN O=C(c1cnc2c(Cl)cccc2c1O)N1CCO[C@@H](c2ccccc2)C1 ZINC000218417063 206369855 /nfs/dbraw/zinc/36/98/55/206369855.db2.gz OWUUORYSIRBCOU-QGZVFWFLSA-N 0 0 368.820 3.808 50 70 FHIARN O=C(c1cc(-n2cccc2)ccc1Cl)N1CC[C@@]2(O)CCCC[C@H]2C1 ZINC000218438839 206370474 /nfs/dbraw/zinc/37/04/74/206370474.db2.gz HRJSUPXISLJCIF-YWZLYKJASA-N 0 0 358.869 3.898 50 70 FHIARN COc1ccc(CNC(=O)NC[C@](C)(O)c2cc3ccccc3s2)cc1 ZINC000217522814 524060312 /nfs/dbraw/zinc/06/03/12/524060312.db2.gz KDXTWFCEAPUZTR-FQEVSTJZSA-N 0 0 370.474 3.617 50 70 FHIARN Cc1nc(CN(C)C(=O)[C@]2(C)CCc3c(C)c(O)c(C)c(C)c3O2)cs1 ZINC000217733929 526836900 /nfs/dbraw/zinc/83/69/00/526836900.db2.gz AWAPSWBMUNBFKI-FQEVSTJZSA-N 0 0 374.506 3.825 50 70 FHIARN O=C(c1nnc2n1CCCCC2)N1CCC[C@@H](c2ccc(Cl)cc2)C1 ZINC000217186133 206363393 /nfs/dbraw/zinc/36/33/93/206363393.db2.gz CBSCJVRJCZXILP-OAHLLOKOSA-N 0 0 358.873 3.678 50 70 FHIARN COc1ccc([C@@H]2CC(=O)Oc3ccc4c(=O)c(Cl)coc4c32)cc1 ZINC000217627784 206364082 /nfs/dbraw/zinc/36/40/82/206364082.db2.gz BZIUATCOUNDRHS-ZDUSSCGKSA-N 0 0 356.761 3.896 50 70 FHIARN CC1(C)CC(=O)c2ccc3c(c2O1)[C@@H](c1ccc2c(c1)OCO2)CC(=O)O3 ZINC000217714824 206365083 /nfs/dbraw/zinc/36/50/83/206365083.db2.gz LOOHXUVLEWEBCV-CYBMUJFWSA-N 0 0 366.369 3.600 50 70 FHIARN COc1cc([C@@H]2CC(=O)Oc3cc4c(cc32)OCO4)ccc1OC(C)C ZINC000217873014 206365161 /nfs/dbraw/zinc/36/51/61/206365161.db2.gz ZRZHEQXZGGQZGS-ZDUSSCGKSA-N 0 0 356.374 3.652 50 70 FHIARN O=C(c1cnc2cc(Cl)ccc2c1O)N1CCO[C@@H](c2ccccc2)C1 ZINC000218127206 206366739 /nfs/dbraw/zinc/36/67/39/206366739.db2.gz FTLTVZHHUVEAHY-GOSISDBHSA-N 0 0 368.820 3.808 50 70 FHIARN COc1ccc(C2(C(=O)N[C@H](C)c3c(C)n[nH]c3C)CCCC2)cc1OC ZINC000217995130 206367264 /nfs/dbraw/zinc/36/72/64/206367264.db2.gz KFZORPUHAOIGAW-CYBMUJFWSA-N 0 0 371.481 3.733 50 70 FHIARN Cc1nnc([C@H]2CCCN2C(=O)c2c(C)onc2-c2ccccc2Cl)[nH]1 ZINC000218392093 206369930 /nfs/dbraw/zinc/36/99/30/206369930.db2.gz XWJIEESWOJZDSY-CQSZACIVSA-N 0 0 371.828 3.707 50 70 FHIARN CC(=O)c1ccc2c(c1O)[C@H](c1ccc(OC(F)(F)F)cc1)CC(=O)O2 ZINC000218427564 206370061 /nfs/dbraw/zinc/37/00/61/206370061.db2.gz LLYPFGDLFYQODW-ZDUSSCGKSA-N 0 0 366.291 3.934 50 70 FHIARN CC(C)c1nccn1CCCNC(=O)c1ccc(N2CCCCC2)cc1 ZINC000218405772 519879355 /nfs/dbraw/zinc/87/93/55/519879355.db2.gz DEEVPJIOWAJFCS-UHFFFAOYSA-N 0 0 354.498 3.817 50 70 FHIARN COc1ccc(CNC(=O)NC[C@@](C)(O)c2cc3ccccc3s2)cc1 ZINC000217522729 524059559 /nfs/dbraw/zinc/05/95/59/524059559.db2.gz KDXTWFCEAPUZTR-HXUWFJFHSA-N 0 0 370.474 3.617 50 70 FHIARN COc1cccc2c1ccn2CCNC(=O)CCc1c[nH]c2ccccc12 ZINC000217861360 524252462 /nfs/dbraw/zinc/25/24/62/524252462.db2.gz JQSNBBRMSSDBAL-UHFFFAOYSA-N 0 0 361.445 3.880 50 70 FHIARN Cc1ccc2[nH]c(CCC(=O)NC[C@@H]3OCCc4ccccc43)nc2c1C ZINC000217140298 568151208 /nfs/dbraw/zinc/15/12/08/568151208.db2.gz GDZYIJVHWJHDDR-IBGZPJMESA-N 0 0 363.461 3.543 50 70 FHIARN Cc1ccc(NC(=O)c2ncn(-c3ccccc3)n2)c(Br)c1 ZINC000160390794 206227962 /nfs/dbraw/zinc/22/79/62/206227962.db2.gz RTAAOLHJHMCSST-UHFFFAOYSA-N 0 0 357.211 3.591 50 70 FHIARN CCN1Cc2ccccc2C[C@H]1C(=O)NCc1ccc(C)c2ncccc12 ZINC000217426252 206362695 /nfs/dbraw/zinc/36/26/95/206362695.db2.gz ZHDDXXWEJAZVGG-NRFANRHFSA-N 0 0 359.473 3.606 50 70 FHIARN COC(=O)c1nc(NC(=O)c2ccc3[nH]c4c(c3c2)CCCC4)sc1C ZINC000218315286 206369313 /nfs/dbraw/zinc/36/93/13/206369313.db2.gz OPVZQDKBOFHOHC-UHFFFAOYSA-N 0 0 369.446 3.851 50 70 FHIARN CC(C)c1nc(NC(=O)c2ccc(-c3cc4ccccc4oc3=O)cc2)n[nH]1 ZINC000218449646 206369765 /nfs/dbraw/zinc/36/97/65/206369765.db2.gz ATYPFBRIIXJYLT-UHFFFAOYSA-N 0 0 374.400 3.954 50 70 FHIARN CC(C)c1cc([C@@H]2CCCN2C(=O)c2cc(=O)c3ccccc3o2)no1 ZINC000218511410 206370143 /nfs/dbraw/zinc/37/01/43/206370143.db2.gz OGKDXARCOJKOTC-HNNXBMFYSA-N 0 0 352.390 3.882 50 70 FHIARN CCCc1ccc(-c2ccc(C(=O)N[C@@H]3CCOC[C@H]3OC)cc2)cc1 ZINC000218371151 206370162 /nfs/dbraw/zinc/37/01/62/206370162.db2.gz QRPSLVURFWDFJY-NHCUHLMSSA-N 0 0 353.462 3.840 50 70 FHIARN CN(Cc1noc(C2CCCC2)n1)C(=O)CCc1c[nH]c2ccccc12 ZINC000218161220 523617029 /nfs/dbraw/zinc/61/70/29/523617029.db2.gz NXUDGCKURUKNEX-UHFFFAOYSA-N 0 0 352.438 3.800 50 70 FHIARN Cc1ccccc1-c1noc(C[C@@H]2CCCN(C(=O)c3ccco3)C2)n1 ZINC000217828793 525021463 /nfs/dbraw/zinc/02/14/63/525021463.db2.gz LWSQTBXKRSMCBA-HNNXBMFYSA-N 0 0 351.406 3.733 50 70 FHIARN COc1cccc(-c2ccc(C(=O)N(C)Cc3[nH]nc4c3CCC4)cc2)c1 ZINC000218286369 525713314 /nfs/dbraw/zinc/71/33/14/525713314.db2.gz NBZWHWPXGYOBKY-UHFFFAOYSA-N 0 0 361.445 3.846 50 70 FHIARN C[C@@](O)(CNC(=O)c1ccc2nsnc2c1)c1cc2ccccc2s1 ZINC000217502627 525774989 /nfs/dbraw/zinc/77/49/89/525774989.db2.gz JTZSDTMPNZIYAY-GOSISDBHSA-N 0 0 369.471 3.544 50 70 FHIARN O=C(NCCn1ccc(-c2ccsc2)n1)NCc1ccc(Cl)cc1 ZINC000217890523 526469535 /nfs/dbraw/zinc/46/95/35/526469535.db2.gz ZWSDMEMZZQRZGQ-UHFFFAOYSA-N 0 0 360.870 3.764 50 70 FHIARN O=C(c1ccco1)N1CCC[C@@H](Cc2nc(-c3ccccc3F)no2)C1 ZINC000217797336 526827150 /nfs/dbraw/zinc/82/71/50/526827150.db2.gz WWNLVPCFZDEWNN-ZDUSSCGKSA-N 0 0 355.369 3.564 50 70 FHIARN O=C(C[C@@H](Cn1cccc1)c1ccc(Cl)cc1)Nc1nnc(C2CC2)[nH]1 ZINC000218279345 527097217 /nfs/dbraw/zinc/09/72/17/527097217.db2.gz CJNHXXWPQPZYMT-HNNXBMFYSA-N 0 0 369.856 3.950 50 70 FHIARN Cn1nc(CN(Cc2ccco2)C(=O)c2ccc(F)c(F)c2)c2c1CCC2 ZINC000217902934 527554860 /nfs/dbraw/zinc/55/48/60/527554860.db2.gz ALCZQPVRYGWHFY-UHFFFAOYSA-N 0 0 371.387 3.623 50 70 FHIARN O=C(Cc1csc(-n2cccc2)n1)N1CCCC[C@H]1c1cccnc1 ZINC000218106350 203878489 /nfs/dbraw/zinc/87/84/89/203878489.db2.gz XBQYLUQNUADULS-KRWDZBQOSA-N 0 0 352.463 3.625 50 70 FHIARN CC(C)(C)c1cc(CNC(=O)c2cc(-c3ccc(Cl)cc3)n[nH]2)[nH]n1 ZINC000218609801 206371293 /nfs/dbraw/zinc/37/12/93/206371293.db2.gz DBUHXFSINTVGBC-UHFFFAOYSA-N 0 0 357.845 3.681 50 70 FHIARN Cc1ncsc1CCN(C)C(=O)c1ccc(-c2cccc(F)c2)nc1 ZINC000218670582 206373305 /nfs/dbraw/zinc/37/33/05/206373305.db2.gz AWSCCMIQNSKAML-UHFFFAOYSA-N 0 0 355.438 3.967 50 70 FHIARN CC(=O)c1ccccc1C(=O)N[C@H](c1cnc2ccccc2c1)C1CC(O)C1 ZINC000218030342 206366805 /nfs/dbraw/zinc/36/68/05/206366805.db2.gz MPBNLDDAYOSOAR-QRFVXNFXSA-N 0 0 374.440 3.679 50 70 FHIARN O=C(N[C@H](c1ccncc1)c1ccc(F)cc1)c1cccc2c1OCCO2 ZINC000218341992 206370498 /nfs/dbraw/zinc/37/04/98/206370498.db2.gz COUPVWXJYHAGOA-IBGZPJMESA-N 0 0 364.376 3.511 50 70 FHIARN O=C(N[C@@H](c1ccncc1)c1ccc(F)cc1)c1cccc2c1OCCO2 ZINC000218341910 206370803 /nfs/dbraw/zinc/37/08/03/206370803.db2.gz COUPVWXJYHAGOA-LJQANCHMSA-N 0 0 364.376 3.511 50 70 FHIARN COCCn1ccc2c1cccc2C(=O)NCCn1ccc2ccccc21 ZINC000218069573 522135815 /nfs/dbraw/zinc/13/58/15/522135815.db2.gz YVMPDSRTRKJPBH-UHFFFAOYSA-N 0 0 361.445 3.672 50 70 FHIARN COc1ccc(C(=O)NC[C@@](C)(O)c2cc3ccccc3s2)cc1F ZINC000217507811 523708887 /nfs/dbraw/zinc/70/88/87/523708887.db2.gz HUPPRGJRAVRHTE-LJQANCHMSA-N 0 0 359.422 3.687 50 70 FHIARN Cc1cc(-c2ccncc2)nn1CCNC(=O)c1cccc(C(F)(F)F)c1 ZINC000217868358 526043263 /nfs/dbraw/zinc/04/32/63/526043263.db2.gz OUDMUZFILQTMNZ-UHFFFAOYSA-N 0 0 374.366 3.702 50 70 FHIARN O=C(NC[C@](O)(c1ccccc1)C1CC1)c1csc(-c2ccccc2)n1 ZINC000217577181 526630725 /nfs/dbraw/zinc/63/07/25/526630725.db2.gz OAIUVAQFLPZOIN-NRFANRHFSA-N 0 0 364.470 3.838 50 70 FHIARN COc1cc2c(c(OC)c1OC)[C@H](c1ccc3ncccc3c1)CC(=O)O2 ZINC000218061516 571352245 /nfs/dbraw/zinc/35/22/45/571352245.db2.gz CRIHIVVYGRKVIB-AWEZNQCLSA-N 0 0 365.385 3.702 50 70 FHIARN COc1ccc2c(c1)CCC[C@]2(O)CNC(=O)c1cccc2ccccc21 ZINC000218007227 209662705 /nfs/dbraw/zinc/66/27/05/209662705.db2.gz IVDOVSGMMSXHIA-QHCPKHFHSA-N 0 0 361.441 3.802 50 70 FHIARN Cc1cc(C)n(CCC(=O)N[C@H](c2ccc(Cl)cc2)c2cccnc2)n1 ZINC000218123254 524516889 /nfs/dbraw/zinc/51/68/89/524516889.db2.gz FIZVWGNSQQUWPZ-HXUWFJFHSA-N 0 0 368.868 3.844 50 70 FHIARN Cc1cc2c(ncnc2SCC(=O)N[C@H](C)c2csc(C)n2)s1 ZINC000217179491 525625332 /nfs/dbraw/zinc/62/53/32/525625332.db2.gz WQSWVUPURYNKBA-SECBINFHSA-N 0 0 364.521 3.734 50 70 FHIARN C[C@H](Oc1ccccc1)C(=O)N(Cc1nn(C)c2c1CCC2)C1CCCC1 ZINC000217909231 525953226 /nfs/dbraw/zinc/95/32/26/525953226.db2.gz FBPDPBSMVLOCAZ-INIZCTEOSA-N 0 0 367.493 3.648 50 70 FHIARN O=C(NCc1cc(-c2ccccc2Cl)on1)[C@H]1Cc2ccccc2O1 ZINC000218313751 526637822 /nfs/dbraw/zinc/63/78/22/526637822.db2.gz MKOMICJXEYHECX-GOSISDBHSA-N 0 0 354.793 3.615 50 70 FHIARN O=C(c1ccc(Cl)s1)N1CCC[C@H](Cc2nc(C3CC3)no2)C1 ZINC000217813626 526683204 /nfs/dbraw/zinc/68/32/04/526683204.db2.gz JVMNAQDKGBRMKC-SNVBAGLBSA-N 0 0 351.859 3.757 50 70 FHIARN Cc1nc(C2CCN(C(=O)CCCc3ccc(Cl)cc3)CC2)cc(=O)[nH]1 ZINC000218297471 527006658 /nfs/dbraw/zinc/00/66/58/527006658.db2.gz OQBYPJAMYMJJOB-UHFFFAOYSA-N 0 0 373.884 3.873 50 70 FHIARN C[C@@H](O)c1cc2n(n1)CCCN(Cc1cccc(OC3CCCC3)c1)C2 ZINC000217119259 568148109 /nfs/dbraw/zinc/14/81/09/568148109.db2.gz DGNDXSQNODYIKM-MRXNPFEDSA-N 0 0 355.482 3.664 50 70 FHIARN CC(C)(NC(=O)c1ccc(-c2ccccc2Cl)o1)c1nnc(N)s1 ZINC000217535143 568190496 /nfs/dbraw/zinc/19/04/96/568190496.db2.gz FVDXYGKALWOLTA-UHFFFAOYSA-N 0 0 362.842 3.699 50 70 FHIARN Cc1cncnc1C1CCN(C(=O)c2csc(-c3cccs3)n2)CC1 ZINC000217641790 568196459 /nfs/dbraw/zinc/19/64/59/568196459.db2.gz KRCSKZUGYVRRPN-UHFFFAOYSA-N 0 0 370.503 3.990 50 70 FHIARN CC(=O)Nc1ccc(C(=O)N[C@H](c2ccncc2)c2ccc(F)cc2)cc1 ZINC000218323680 568228407 /nfs/dbraw/zinc/22/84/07/568228407.db2.gz GFCDQGOYGCTPKA-FQEVSTJZSA-N 0 0 363.392 3.699 50 70 FHIARN COc1ccc(Cl)cc1C(=O)N1CCC[C@@]2(C1)OC(=O)c1ccccc12 ZINC000217565471 571348773 /nfs/dbraw/zinc/34/87/73/571348773.db2.gz JMEOLJSOGZPIBU-FQEVSTJZSA-N 0 0 371.820 3.651 50 70 FHIARN COc1cccc([C@H]2SCCN2C(=O)c2ccc(Br)o2)c1 ZINC000217638107 571349497 /nfs/dbraw/zinc/34/94/97/571349497.db2.gz IRRBRMWJLCXYSC-OAHLLOKOSA-N 0 0 368.252 3.939 50 70 FHIARN O=C(c1ccc(F)cc1Cl)N1CC[C@H](n2cc(-c3ccccc3)nn2)C1 ZINC000217655864 571349735 /nfs/dbraw/zinc/34/97/35/571349735.db2.gz OHMNNWPRSZQCKP-HNNXBMFYSA-N 0 0 370.815 3.825 50 70 FHIARN COC(=O)C[C@H](c1ccc(OC)c2ccccc21)c1c(O)cc(C)oc1=O ZINC000218025196 571352094 /nfs/dbraw/zinc/35/20/94/571352094.db2.gz KPHATRVHXADABG-MRXNPFEDSA-N 0 0 368.385 3.511 50 70 FHIARN CC(C)c1nccn1CCCNC(=O)Cc1ccccc1C(F)(F)F ZINC000218199041 519879804 /nfs/dbraw/zinc/87/98/04/519879804.db2.gz CVUXZVWVNMYPPA-UHFFFAOYSA-N 0 0 353.388 3.774 50 70 FHIARN CN(C)c1cccc(C(=O)NC[C@@](C)(O)c2cc3ccccc3s2)c1 ZINC000217501686 522259444 /nfs/dbraw/zinc/25/94/44/522259444.db2.gz UGKDAXFAFQTTDQ-HXUWFJFHSA-N 0 0 354.475 3.605 50 70 FHIARN COc1ccc(C(=O)NC[C@](C)(O)c2cc3ccccc3s2)cc1F ZINC000217507887 523709677 /nfs/dbraw/zinc/70/96/77/523709677.db2.gz HUPPRGJRAVRHTE-IBGZPJMESA-N 0 0 359.422 3.687 50 70 FHIARN Cc1ccccc1-c1cccc(C(=O)N2CCN(C3CCCC3)C(=O)C2)c1 ZINC000218288525 525006827 /nfs/dbraw/zinc/00/68/27/525006827.db2.gz RXEGOCJTFDWJHI-UHFFFAOYSA-N 0 0 362.473 3.889 50 70 FHIARN CC(C)[C@H](NC(=O)c1n[nH]c2c1CCCCC2)c1nc2ccccc2n1C ZINC000218249225 568224473 /nfs/dbraw/zinc/22/44/73/568224473.db2.gz ZHLPXKKWVNAQDI-SFHVURJKSA-N 0 0 365.481 3.692 50 70 FHIARN Cc1nn(C)c2nc3c(c(C(=O)Nc4ccc(F)c(Cl)c4)c12)CCC3 ZINC000218495957 568236664 /nfs/dbraw/zinc/23/66/64/568236664.db2.gz DPKVFQUCLCMUGH-UHFFFAOYSA-N 0 0 358.804 3.810 50 70 FHIARN Cc1nc(N2CCCC2)ccc1NC(=O)c1ccn(-c2ccc(F)cc2)n1 ZINC000159519423 571123997 /nfs/dbraw/zinc/12/39/97/571123997.db2.gz ONHKXSDUTKPRHO-UHFFFAOYSA-N 0 0 365.412 3.567 50 70 FHIARN CC(C)C[C@H](NC(=O)Cc1ccc2c(c1)OCC2)c1nc2ccccc2[nH]1 ZINC000218152238 571352580 /nfs/dbraw/zinc/35/25/80/571352580.db2.gz HKCVDKFRNVEWQV-IBGZPJMESA-N 0 0 363.461 3.944 50 70 FHIARN CCc1cc(C(=O)N2CC[C@@](O)(c3ccccc3)[C@H]3CCCC[C@@H]32)ccn1 ZINC000218559785 209667074 /nfs/dbraw/zinc/66/70/74/209667074.db2.gz LKBBVHQSAQBLIL-QNWVGRARSA-N 0 0 364.489 3.937 50 70 FHIARN COc1cccc(CCC(=O)N2CCC3(CNc4ccccc43)CC2)c1 ZINC000217175273 209657575 /nfs/dbraw/zinc/65/75/75/209657575.db2.gz YUDZOTUGTBVUON-UHFFFAOYSA-N 0 0 350.462 3.614 50 70 FHIARN CCOC(=O)C1CCN(C(=O)Cc2cc3c(ccc4ccccc34)o2)CC1 ZINC000159885428 209487858 /nfs/dbraw/zinc/48/78/58/209487858.db2.gz QDIIBKZYXXDZLJ-UHFFFAOYSA-N 0 0 365.429 3.930 50 70 FHIARN O=C(CCC1CCCC1)N1CCN(C(=O)c2nc3ccccc3s2)CC1 ZINC000161421635 209386004 /nfs/dbraw/zinc/38/60/04/209386004.db2.gz XOPPZUSAVRBZKL-UHFFFAOYSA-N 0 0 371.506 3.551 50 70 FHIARN C[C@](O)(CNC(=O)c1cc(-c2ccco2)on1)c1cc2ccccc2s1 ZINC000217502335 525175185 /nfs/dbraw/zinc/17/51/85/525175185.db2.gz DQZMISPVUVEQJA-IBGZPJMESA-N 0 0 368.414 3.787 50 70 FHIARN C[C@@H](Oc1ccccc1)C(=O)N(Cc1nn(C)c2c1CCC2)C1CCCC1 ZINC000217909315 525947157 /nfs/dbraw/zinc/94/71/57/525947157.db2.gz FBPDPBSMVLOCAZ-MRXNPFEDSA-N 0 0 367.493 3.648 50 70 FHIARN CSc1ccc(/C=C/C(=O)NC[C@](O)(c2ccccc2)C2CC2)cc1 ZINC000217579331 525949155 /nfs/dbraw/zinc/94/91/55/525949155.db2.gz IQNPZFGVQQGHSN-PBAKHKOTSA-N 0 0 353.487 3.836 50 70 FHIARN O=C(CCCc1c[nH]c2ccccc12)NCc1nnc(-c2ccccc2)[nH]1 ZINC000216931462 526454075 /nfs/dbraw/zinc/45/40/75/526454075.db2.gz YJBPHPWTOHDZJI-UHFFFAOYSA-N 0 0 359.433 3.592 50 70 FHIARN O=C(c1ccco1)N1CCC[C@H](Cc2nc(-c3ccccc3F)no2)C1 ZINC000217797427 526828017 /nfs/dbraw/zinc/82/80/17/526828017.db2.gz WWNLVPCFZDEWNN-CYBMUJFWSA-N 0 0 355.369 3.564 50 70 FHIARN O=C(Cc1ccc(F)cc1)NCCn1nc(-c2ccsc2)cc1C1CC1 ZINC000217877736 527231208 /nfs/dbraw/zinc/23/12/08/527231208.db2.gz VBBSDZSOZNUQTL-UHFFFAOYSA-N 0 0 369.465 3.987 50 70 FHIARN COc1ccc2[nH]c(C(=O)N(C)Cc3c[nH]nc3-c3ccccc3)cc2c1 ZINC000218661567 568244570 /nfs/dbraw/zinc/24/45/70/568244570.db2.gz FQVSURLCGIBQDN-UHFFFAOYSA-N 0 0 360.417 3.839 50 70 FHIARN Cc1nn(-c2ccccc2)c(C)c1NC(=O)c1cncc(OC(C)C)c1 ZINC000160435225 571160289 /nfs/dbraw/zinc/16/02/89/571160289.db2.gz JBMPKCBELLXKNY-UHFFFAOYSA-N 0 0 350.422 3.924 50 70 FHIARN COc1cc([C@H]2CC(=O)Oc3cc4c(cc32)OCO4)ccc1OC(C)C ZINC000217873110 571351285 /nfs/dbraw/zinc/35/12/85/571351285.db2.gz ZRZHEQXZGGQZGS-CYBMUJFWSA-N 0 0 356.374 3.652 50 70 FHIARN C[C@@](O)(CNC(=O)c1nc2ccccc2s1)c1cc2ccccc2o1 ZINC000217988603 571351911 /nfs/dbraw/zinc/35/19/11/571351911.db2.gz ZKEHBDUWOWSUQQ-LJQANCHMSA-N 0 0 352.415 3.680 50 70 FHIARN O=C(c1ccccc1OCCc1ccccc1)N1CCO[C@@H](C2CC2)C1 ZINC000218755798 209670847 /nfs/dbraw/zinc/67/08/47/209670847.db2.gz KURMOKXCDZJSGS-OAQYLSRUSA-N 0 0 351.446 3.559 50 70 FHIARN CC1=CC[C@@H]2CN(C(=O)c3ccc4sc5c(c4c3)CCNC5=O)C[C@@H]2C1 ZINC000218106159 209662832 /nfs/dbraw/zinc/66/28/32/209662832.db2.gz DYYBXAROVTUBHP-CABCVRRESA-N 0 0 366.486 3.616 50 70 FHIARN CC(C)Sc1ccc(CC(=O)NCCSC2CCOCC2)cc1 ZINC000217702390 519787981 /nfs/dbraw/zinc/78/79/81/519787981.db2.gz UCYRTVGECSYEIL-UHFFFAOYSA-N 0 0 353.553 3.758 50 70 FHIARN CN(C)c1ccc(CC(=O)NCc2cc(-c3ccccc3Cl)no2)cc1 ZINC000218212909 522160098 /nfs/dbraw/zinc/16/00/98/522160098.db2.gz WCJVFXLKHOUUIT-UHFFFAOYSA-N 0 0 369.852 3.920 50 70 FHIARN COC(=O)C[C@@H](c1ccc(OC(C)C)cc1)c1cc2c(cc1O)OCO2 ZINC000218062673 523280136 /nfs/dbraw/zinc/28/01/36/523280136.db2.gz AQMXQPTXXATXAC-HNNXBMFYSA-N 0 0 358.390 3.603 50 70 FHIARN COc1ccccc1[C@@H]1CCCN1C(=O)CCC(=O)N1CCCCCC1 ZINC000217212147 524748747 /nfs/dbraw/zinc/74/87/47/524748747.db2.gz LEVCALKBLDPPML-SFHVURJKSA-N 0 0 358.482 3.542 50 70 FHIARN O=C(CC1(n2cccc2)CCOCC1)Nc1ccc(OC(F)(F)F)cc1 ZINC000218235872 526335804 /nfs/dbraw/zinc/33/58/04/526335804.db2.gz BCTHVTVZDLUKJX-UHFFFAOYSA-N 0 0 368.355 3.921 50 70 FHIARN O=C(CCSc1ccc2c(c1)OCCO2)N1CCC[C@@H]1c1ccccn1 ZINC000217817642 526541790 /nfs/dbraw/zinc/54/17/90/526541790.db2.gz XYBFHLZULYCPRM-QGZVFWFLSA-N 0 0 370.474 3.699 50 70 FHIARN Cc1nn(C)c(C)c1CN(Cc1cnn(-c2cccc(F)c2)c1)C1CC1 ZINC000218052019 527627848 /nfs/dbraw/zinc/62/78/48/527627848.db2.gz YBQGDSRBCDLHHS-UHFFFAOYSA-N 0 0 353.445 3.526 50 70 FHIARN Cc1cccc2[nH]c(COCC(=O)N3CCC[C@@H]3c3ccc(F)cc3)nc21 ZINC000217164096 568155043 /nfs/dbraw/zinc/15/50/43/568155043.db2.gz NWIQIKPGFDRAPF-GOSISDBHSA-N 0 0 367.424 3.891 50 70 FHIARN O=C(c1nc2cc(F)ccc2[nH]1)N1CCC(Oc2ccccc2F)CC1 ZINC000216926846 568155356 /nfs/dbraw/zinc/15/53/56/568155356.db2.gz ZFPSTGXMEPIQIZ-UHFFFAOYSA-N 0 0 357.360 3.525 50 70 FHIARN O=C(Cc1cc2c(cc1Cl)OCCO2)N1CCCC[C@@H]1c1ccccn1 ZINC000217617706 568195272 /nfs/dbraw/zinc/19/52/72/568195272.db2.gz BLQMAMGAQKOHQP-QGZVFWFLSA-N 0 0 372.852 3.803 50 70 FHIARN Cc1ccc(C2(C(=O)N[C@@H]3COCC[C@@H]3OCc3ccccc3)CC2)cc1 ZINC000218666585 568244877 /nfs/dbraw/zinc/24/48/77/568244877.db2.gz JCUOUMXFMAFOFX-RTWAWAEBSA-N 0 0 365.473 3.517 50 70 FHIARN OC[C@H](Nc1ncnc2sc3c(c21)CCC3)c1cc(F)c(F)c(F)c1 ZINC000160167002 571059767 /nfs/dbraw/zinc/05/97/67/571059767.db2.gz LGPOEBVZWGQRAQ-LBPRGKRZSA-N 0 0 365.380 3.743 50 70 FHIARN O=C(CSc1ccc(F)cc1)N1CCC[C@@]2(C1)OC(=O)c1ccccc12 ZINC000217565068 209659500 /nfs/dbraw/zinc/65/95/00/209659500.db2.gz JQYKLQPYSFFNCQ-FQEVSTJZSA-N 0 0 371.433 3.606 50 70 FHIARN CC(C)Sc1ccc(CC(=O)Nc2cnn(CC3CCOCC3)c2)cc1 ZINC000218222296 519787987 /nfs/dbraw/zinc/78/79/87/519787987.db2.gz PWSMKFLGAGWKGA-UHFFFAOYSA-N 0 0 373.522 3.991 50 70 FHIARN Cc1cc(-c2cccs2)nn1CCNC(=O)[C@H](C)Oc1ccccc1 ZINC000217873376 526043808 /nfs/dbraw/zinc/04/38/08/526043808.db2.gz INWLBRXFPPAFGI-HNNXBMFYSA-N 0 0 355.463 3.504 50 70 FHIARN Cc1ccc2[nH]c(CCC(=O)NC[C@H]3OCCc4ccccc43)nc2c1C ZINC000217140310 568151215 /nfs/dbraw/zinc/15/12/15/568151215.db2.gz GDZYIJVHWJHDDR-LJQANCHMSA-N 0 0 363.461 3.543 50 70 FHIARN O=C(Cc1cc2c(cc1Cl)OCCO2)N1CCCC[C@H]1c1ccccn1 ZINC000217617776 568195259 /nfs/dbraw/zinc/19/52/59/568195259.db2.gz BLQMAMGAQKOHQP-KRWDZBQOSA-N 0 0 372.852 3.803 50 70 FHIARN CC(C)c1noc(C2CCN(C(=O)c3cc(-c4ccsc4)n[nH]3)CC2)n1 ZINC000218261389 568225140 /nfs/dbraw/zinc/22/51/40/568225140.db2.gz OICVFHJRURKODD-UHFFFAOYSA-N 0 0 371.466 3.664 50 70 FHIARN O=C(Nc1cnn(CC2CCOCC2)c1)c1ccccc1SC(F)F ZINC000218229618 571352892 /nfs/dbraw/zinc/35/28/92/571352892.db2.gz UAKHVOYIXSCOOQ-UHFFFAOYSA-N 0 0 367.421 3.877 50 70 FHIARN CC(C)(C)c1ccc2oc(CNC(=O)c3scc4c3OCCO4)nc2c1 ZINC000218300739 209665402 /nfs/dbraw/zinc/66/54/02/209665402.db2.gz YMGJJXQOZLXUCH-UHFFFAOYSA-N 0 0 372.446 3.888 50 70 FHIARN CC1=C(C(=O)N2CCC[C@@H](c3ccc(Cl)cc3)C2)SC2=NCCN12 ZINC000218149091 209663837 /nfs/dbraw/zinc/66/38/37/209663837.db2.gz FGNMEGOUJZBURW-CQSZACIVSA-N 0 0 361.898 3.696 50 70 FHIARN CC1(C)CC(=O)c2ccc3c(c2O1)[C@H](c1ccc2c(c1)OCO2)CC(=O)O3 ZINC000217714749 209660144 /nfs/dbraw/zinc/66/01/44/209660144.db2.gz LOOHXUVLEWEBCV-ZDUSSCGKSA-N 0 0 366.369 3.600 50 70 FHIARN O=C(NCc1cc(-c2ccccc2Cl)on1)[C@@H]1Cc2ccccc2O1 ZINC000218313677 526637451 /nfs/dbraw/zinc/63/74/51/526637451.db2.gz MKOMICJXEYHECX-SFHVURJKSA-N 0 0 354.793 3.615 50 70 FHIARN O=C(c1ccc2ncsc2c1)N1CCC[C@H](Cc2nc(C3CC3)no2)C1 ZINC000217806001 526740217 /nfs/dbraw/zinc/74/02/17/526740217.db2.gz ZWODMGFEUVWPLA-GFCCVEGCSA-N 0 0 368.462 3.652 50 70 FHIARN O=S(=O)(NCC1(c2ccsc2)CCCC1)c1cc(F)ccc1F ZINC000217483821 527211621 /nfs/dbraw/zinc/21/16/21/527211621.db2.gz XIZFOTWXISVZEP-UHFFFAOYSA-N 0 0 357.447 3.817 50 70 FHIARN O=C(Cc1ccccc1Cl)N1CCC[C@@H](Cc2nc(C3CC3)no2)C1 ZINC000217811292 527286186 /nfs/dbraw/zinc/28/61/86/527286186.db2.gz DKUSRQGQYLUTHP-ZDUSSCGKSA-N 0 0 359.857 3.624 50 70 FHIARN C[C@@H](NC(=O)c1ccccc1N1CCCC1)c1ccc2c(c1)OCCO2 ZINC000217095582 538859738 /nfs/dbraw/zinc/85/97/38/538859738.db2.gz ALMVQVUALFCDMQ-OAHLLOKOSA-N 0 0 352.434 3.549 50 70 FHIARN O=C(Cc1ccc(F)c(F)c1)NC[C@H](c1ccccc1)[NH+]1CCCCC1 ZINC000217075224 568142875 /nfs/dbraw/zinc/14/28/75/568142875.db2.gz ANJMYRZWRXQDNH-HXUWFJFHSA-N 0 0 358.432 3.851 50 70 FHIARN O=C(c1cc2c(s1)CCCCC2)N1CCOc2ccc(CO)cc2C1 ZINC000216997046 568163388 /nfs/dbraw/zinc/16/33/88/568163388.db2.gz YJMJIZGERHTILR-UHFFFAOYSA-N 0 0 357.475 3.544 50 70 FHIARN CCOc1ccc2c(C)c(C(=O)NCc3cc(C)no3)oc2c1OCC ZINC000217433809 568183628 /nfs/dbraw/zinc/18/36/28/568183628.db2.gz HNABBANXBDVKCV-UHFFFAOYSA-N 0 0 358.394 3.765 50 70 FHIARN CC1=C(c2ccccc2)[C@H]1C(=O)NCCc1nc(C)cc(C(F)(F)F)n1 ZINC000218744247 568249485 /nfs/dbraw/zinc/24/94/85/568249485.db2.gz AUJABLLNWIKAKL-KRWDZBQOSA-N 0 0 361.367 3.566 50 70 FHIARN Cc1cc(=O)oc2c1ccc1c2[C@@H](c2coc3ccccc3c2=O)CC(=O)O1 ZINC000217591812 571349038 /nfs/dbraw/zinc/34/90/38/571349038.db2.gz WSECUAKZZZAVET-CQSZACIVSA-N 0 0 374.348 3.649 50 70 FHIARN Cc1cc2c(c(=O)n1CCc1ccc(O)cc1)[C@H](CC(C)C)CC(=O)O2 ZINC000218118646 571352446 /nfs/dbraw/zinc/35/24/46/571352446.db2.gz XJQAGZCDZLIXIQ-MRXNPFEDSA-N 0 0 355.434 3.544 50 70 FHIARN O=C(CC1(n2cccc2)CCOCC1)Nc1nc(-c2ccccn2)cs1 ZINC000218311829 209664862 /nfs/dbraw/zinc/66/48/62/209664862.db2.gz JHRKZKNRKVMQCB-UHFFFAOYSA-N 0 0 368.462 3.541 50 70 FHIARN COc1cc2c(c(OC)c1OC)[C@H](C1=Cc3ccccc3OC1)CC(=O)O2 ZINC000218109786 206758279 /nfs/dbraw/zinc/75/82/79/206758279.db2.gz PCDRVKVTHPHTSW-AWEZNQCLSA-N 0 0 368.385 3.581 50 70 FHIARN c1ccc(Oc2ccc([SiH](c3ccccc3)c3ccccc3)cc2)cc1 ZINC000169817113 206760927 /nfs/dbraw/zinc/76/09/27/206760927.db2.gz CAHZQRRBPYMONM-UHFFFAOYSA-N 0 0 352.509 3.727 50 70 FHIARN CC(C)c1cc(C(=O)NCc2ccc3c(c2)OCO3)n(-c2ccccc2)n1 ZINC000218334502 519832278 /nfs/dbraw/zinc/83/22/78/519832278.db2.gz OZRRRETUYMDVGI-UHFFFAOYSA-N 0 0 363.417 3.654 50 70 FHIARN CC[C@H](Sc1nc2ccccc2o1)C(=O)N1CC(n2nc(C)cc2C)C1 ZINC000218502873 522923672 /nfs/dbraw/zinc/92/36/72/522923672.db2.gz SVYBNPWCBKOQSA-KRWDZBQOSA-N 0 0 370.478 3.595 50 70 FHIARN Cc1ccc(C2(C(=O)NCCc3nccc(-c4ccccc4)n3)CC2)cc1 ZINC000218006515 524226380 /nfs/dbraw/zinc/22/63/80/524226380.db2.gz BPRKWQBYMAFLAU-UHFFFAOYSA-N 0 0 357.457 3.843 50 70 FHIARN COc1ccccc1CC(=O)N[C@H](c1nc2ccccc2n1C)C(C)C ZINC000218135446 524386401 /nfs/dbraw/zinc/38/64/01/524386401.db2.gz XDXFXMNFXHJNEA-FQEVSTJZSA-N 0 0 351.450 3.638 50 70 FHIARN O=C(CCSc1ccc2c(c1)OCCO2)N1CCC[C@H]1c1ccccn1 ZINC000217817732 526541014 /nfs/dbraw/zinc/54/10/14/526541014.db2.gz XYBFHLZULYCPRM-KRWDZBQOSA-N 0 0 370.474 3.699 50 70 FHIARN O=C(CSCc1ccccc1)N1CCC[C@H](Cc2nc(C3CC3)no2)C1 ZINC000217809429 527025060 /nfs/dbraw/zinc/02/50/60/527025060.db2.gz NBWDEEFJLDFLKX-MRXNPFEDSA-N 0 0 371.506 3.662 50 70 FHIARN O=C(c1cc(C(F)(F)F)ccc1Cl)N1CCC2(COC(=O)O2)CC1 ZINC000218012112 568214622 /nfs/dbraw/zinc/21/46/22/568214622.db2.gz CVWHRFQUKLJNPT-UHFFFAOYSA-N 0 0 363.719 3.500 50 70 FHIARN CSc1nc(C(=O)N[C@H](C)c2ccc3c(c2)OCCCO3)cs1 ZINC000218410400 568232691 /nfs/dbraw/zinc/23/26/91/568232691.db2.gz VBJJSUAULGRWIM-SNVBAGLBSA-N 0 0 350.465 3.517 50 70 FHIARN COc1ccc(-c2sc(C)nc2C(=O)Nc2ccc(OC)nc2)cc1 ZINC000218565979 568240221 /nfs/dbraw/zinc/24/02/21/568240221.db2.gz VEZWKCAZFMOIPS-UHFFFAOYSA-N 0 0 355.419 3.783 50 70 FHIARN O=C(Nc1ccc(C(F)(F)F)cc1)N[C@@H]1CCN(c2ccccn2)C1 ZINC000159936378 571163940 /nfs/dbraw/zinc/16/39/40/571163940.db2.gz MLBYHMPRXCAMHH-CQSZACIVSA-N 0 0 350.344 3.501 50 70 FHIARN O=C(c1cc(-c2ccc3c(c2)CCO3)n[nH]1)N1CCCC[C@H]1c1cccnc1 ZINC000218061999 571173572 /nfs/dbraw/zinc/17/35/72/571173572.db2.gz YIYKIDDOLDGLTA-FQEVSTJZSA-N 0 0 374.444 3.774 50 70 FHIARN COC(=O)CS[C@@H]1CCN(C(=O)c2ccc(-c3ccsc3)cc2)C1 ZINC000217559055 571348741 /nfs/dbraw/zinc/34/87/41/571348741.db2.gz FBQGWJWALMTFGT-MRXNPFEDSA-N 0 0 361.488 3.536 50 70 FHIARN O=C(CCc1c(Cl)cccc1Cl)N1CC(Oc2nccs2)C1 ZINC000217685423 571349922 /nfs/dbraw/zinc/34/99/22/571349922.db2.gz XXEKCCVSTXLWKI-UHFFFAOYSA-N 0 0 357.262 3.672 50 70 FHIARN C[C@H](O)c1cc2n(n1)CCCN(Cc1cccc(OC3CCCC3)c1)C2 ZINC000217119274 263459384 /nfs/dbraw/zinc/45/93/84/263459384.db2.gz DGNDXSQNODYIKM-INIZCTEOSA-N 0 0 355.482 3.664 50 70 FHIARN CC[C@@H](Sc1nc2ccccc2o1)C(=O)N1CC(n2nc(C)cc2C)C1 ZINC000218502788 523085225 /nfs/dbraw/zinc/08/52/25/523085225.db2.gz SVYBNPWCBKOQSA-QGZVFWFLSA-N 0 0 370.478 3.595 50 70 FHIARN C[C@@](O)(CNC(=O)CCc1ccccc1F)c1cc2ccccc2s1 ZINC000217508185 525767201 /nfs/dbraw/zinc/76/72/01/525767201.db2.gz WOOQTSKKTGESLT-HXUWFJFHSA-N 0 0 357.450 3.997 50 70 FHIARN C[C@@](O)(CNC(=O)CSc1ccc(F)cc1)c1cc2ccccc2o1 ZINC000217989334 525768551 /nfs/dbraw/zinc/76/85/51/525768551.db2.gz ACJRRGXEWOXNED-LJQANCHMSA-N 0 0 359.422 3.688 50 70 FHIARN Cc1cc(-c2ccncc2)nn1CCNC(=O)/C=C/c1ccccc1Cl ZINC000217867733 526043832 /nfs/dbraw/zinc/04/38/32/526043832.db2.gz LXZVXAKGWSNOJQ-VOTSOKGWSA-N 0 0 366.852 3.737 50 70 FHIARN O=C(CCSCc1ccc(F)cc1)N1CCC(Cn2ccnc2)CC1 ZINC000218053224 526538663 /nfs/dbraw/zinc/53/86/63/526538663.db2.gz LRUXZYTYCPFDNY-UHFFFAOYSA-N 0 0 361.486 3.584 50 70 FHIARN O=C(CSc1ccc(F)cc1)NCCn1ccc(-c2ccsc2)n1 ZINC000217886637 527035236 /nfs/dbraw/zinc/03/52/36/527035236.db2.gz NCNIFIOTCXEFBO-UHFFFAOYSA-N 0 0 361.467 3.659 50 70 FHIARN O=C(c1ccc2c(c1)CCO2)N1CCC[C@H]1c1nc2cc(F)ccc2[nH]1 ZINC000217375063 568180444 /nfs/dbraw/zinc/18/04/44/568180444.db2.gz NVJJOAOVYNAJAI-KRWDZBQOSA-N 0 0 351.381 3.614 50 70 FHIARN CCN1Cc2ccccc2C[C@@H]1C(=O)NCc1ccc(C)c2ncccc12 ZINC000217426160 568183201 /nfs/dbraw/zinc/18/32/01/568183201.db2.gz ZHDDXXWEJAZVGG-OAQYLSRUSA-N 0 0 359.473 3.606 50 70 FHIARN COc1cccc([C@H]2CCCCN2C(=O)CCN2CCCCCC2=O)c1 ZINC000218729530 568248536 /nfs/dbraw/zinc/24/85/36/568248536.db2.gz NIZKEKQIOALNKN-LJQANCHMSA-N 0 0 358.482 3.542 50 70 FHIARN COc1ccccc1N1CC[C@H](Sc2nncc3ccccc32)C1=O ZINC000160256085 571113820 /nfs/dbraw/zinc/11/38/20/571113820.db2.gz PTQACSNZFDDLGC-KRWDZBQOSA-N 0 0 351.431 3.536 50 70 FHIARN O=C(CSCc1ccccc1)N1CCC2(CC1)OC(=O)c1ccccc12 ZINC000217515811 571348302 /nfs/dbraw/zinc/34/83/02/571348302.db2.gz GCYWZPMFJGEBPF-UHFFFAOYSA-N 0 0 367.470 3.608 50 70 FHIARN CC(C)n1cncc1CN(Cc1ccncc1)Cc1ccc2c(c1)OCO2 ZINC000218378306 520055729 /nfs/dbraw/zinc/05/57/29/520055729.db2.gz COPJXXQHNGCSGJ-UHFFFAOYSA-N 0 0 364.449 3.790 50 70 FHIARN CC[C@H](C)[C@H](NC(=O)c1cc(-c2cccnc2)n[nH]1)c1nc2ccccc2[nH]1 ZINC000218291017 521969141 /nfs/dbraw/zinc/96/91/41/521969141.db2.gz GTAMDUNMVNGYOC-DJJJIMSYSA-N 0 0 374.448 3.865 50 70 FHIARN CCc1noc(CN(C)C(=O)c2ccc(OCc3ccccc3F)cc2)n1 ZINC000218315743 522896717 /nfs/dbraw/zinc/89/67/17/522896717.db2.gz ZQPNFHKYCZRUQM-UHFFFAOYSA-N 0 0 369.396 3.622 50 70 FHIARN Cc1ccccc1-c1noc(C[C@H]2CCCN(C(=O)c3ccco3)C2)n1 ZINC000217828878 525021185 /nfs/dbraw/zinc/02/11/85/525021185.db2.gz LWSQTBXKRSMCBA-OAHLLOKOSA-N 0 0 351.406 3.733 50 70 FHIARN COc1ccc(S(=O)(=O)NCC2(c3ccsc3)CCCC2)cc1C ZINC000217483927 525055825 /nfs/dbraw/zinc/05/58/25/525055825.db2.gz XYIYWURRGUVEIL-UHFFFAOYSA-N 0 0 365.520 3.855 50 70 FHIARN COc1ccc(S(=O)(=O)NCC2(c3ccsc3)CCCC2)cc1F ZINC000217484029 525055999 /nfs/dbraw/zinc/05/59/99/525055999.db2.gz YYMMDAOJDSQNKK-UHFFFAOYSA-N 0 0 369.483 3.686 50 70 FHIARN O=C(CCSc1ccccc1)N1CCC[C@@H](Cc2nc(C3CC3)no2)C1 ZINC000217812973 526541511 /nfs/dbraw/zinc/54/15/11/526541511.db2.gz BZNNBNHLXWBXJP-HNNXBMFYSA-N 0 0 371.506 3.911 50 70 FHIARN Cn1nc(CN(Cc2ccco2)C(=O)NCc2cccs2)cc1C1CC1 ZINC000217897047 527554723 /nfs/dbraw/zinc/55/47/23/527554723.db2.gz DMNSCABUSSKEND-UHFFFAOYSA-N 0 0 370.478 3.864 50 70 FHIARN C[C@H](NC(=O)c1ccccc1N1CCCC1)c1ccc2c(c1)OCCO2 ZINC000217095609 568145301 /nfs/dbraw/zinc/14/53/01/568145301.db2.gz ALMVQVUALFCDMQ-HNNXBMFYSA-N 0 0 352.434 3.549 50 70 FHIARN CC1=C(C(=O)N2CCC[C@H](c3ccc(Cl)cc3)C2)SC2=NCCN12 ZINC000218149172 568218976 /nfs/dbraw/zinc/21/89/76/568218976.db2.gz FGNMEGOUJZBURW-AWEZNQCLSA-N 0 0 361.898 3.696 50 70 FHIARN CC(C)[C@H](NC(=O)c1n[nH]c2c1CCC2)c1nc2ccccc2n1C(C)C ZINC000218162440 568219539 /nfs/dbraw/zinc/21/95/39/568219539.db2.gz LWDNGAZLGROGOY-SFHVURJKSA-N 0 0 365.481 3.956 50 70 FHIARN CC(C)[C@H](NC(=O)c1nn(C)c2ccccc12)c1nc2ccccc2n1C ZINC000218307732 568227442 /nfs/dbraw/zinc/22/74/42/568227442.db2.gz OVOPHCQXNWRCAK-SFHVURJKSA-N 0 0 361.449 3.587 50 70 FHIARN Cc1nc2sc([C@H](c3cccc(F)c3)[NH+]3CCCCCC3)c([O-])n2n1 ZINC000218308300 568227498 /nfs/dbraw/zinc/22/74/98/568227498.db2.gz TVXPZRNUPKUJHG-HNNXBMFYSA-N 0 0 360.458 3.909 50 70 FHIARN O=C(Cc1cccc(C(F)(F)F)c1)N1CCC(CCn2cccn2)CC1 ZINC000218597092 568241736 /nfs/dbraw/zinc/24/17/36/568241736.db2.gz YKYAZZYSUYVVNG-UHFFFAOYSA-N 0 0 365.399 3.773 50 70 FHIARN O=C(c1ccccc1OCCc1ccccc1)N1CCO[C@H](C2CC2)C1 ZINC000218755843 568250193 /nfs/dbraw/zinc/25/01/93/568250193.db2.gz KURMOKXCDZJSGS-NRFANRHFSA-N 0 0 351.446 3.559 50 70 FHIARN COc1cc(Cl)cc(CN2CCC(O)(c3ccccc3)CC2)c1OC ZINC000218777151 568251214 /nfs/dbraw/zinc/25/12/14/568251214.db2.gz FDQHYJTVTQUNIU-UHFFFAOYSA-N 0 0 361.869 3.841 50 70 FHIARN COc1ccc([C@H]2CC(=O)Oc3ccc4c(=O)c(Cl)coc4c32)cc1 ZINC000217627868 571349433 /nfs/dbraw/zinc/34/94/33/571349433.db2.gz BZIUATCOUNDRHS-CYBMUJFWSA-N 0 0 356.761 3.896 50 70 FHIARN COc1ccc2c(c1)CCC[C@]2(O)CNC(=O)Nc1ccccc1Cl ZINC000218013322 571352032 /nfs/dbraw/zinc/35/20/32/571352032.db2.gz CLZUTYKZEHJYGT-IBGZPJMESA-N 0 0 360.841 3.694 50 70 FHIARN CC1(C)OC(=O)C[C@H]1C(=O)NCCC(c1ccccc1)c1ccccc1 ZINC000218471237 520605802 /nfs/dbraw/zinc/60/58/02/520605802.db2.gz ZLHIJVKOADPOAN-IBGZPJMESA-N 0 0 351.446 3.667 50 70 FHIARN CN(C)c1cccc(C(=O)NC[C@](C)(O)c2cc3ccccc3s2)c1 ZINC000217501772 522259133 /nfs/dbraw/zinc/25/91/33/522259133.db2.gz UGKDAXFAFQTTDQ-FQEVSTJZSA-N 0 0 354.475 3.605 50 70 FHIARN C[C@](O)(CNC(=O)c1ccc2nsnc2c1)c1cc2ccccc2s1 ZINC000217502694 525176722 /nfs/dbraw/zinc/17/67/22/525176722.db2.gz JTZSDTMPNZIYAY-SFHVURJKSA-N 0 0 369.471 3.544 50 70 FHIARN O=C(NC[C@](O)(c1ccccc1)C1CC1)c1cc(Br)cs1 ZINC000217578093 526630541 /nfs/dbraw/zinc/63/05/41/526630541.db2.gz QFNRVIUYTIQWOM-INIZCTEOSA-N 0 0 366.280 3.538 50 70 FHIARN O=C(c1ccc2ncsc2c1)N1CCC[C@@H](Cc2nc(C3CC3)no2)C1 ZINC000217806088 526740762 /nfs/dbraw/zinc/74/07/62/526740762.db2.gz ZWODMGFEUVWPLA-LBPRGKRZSA-N 0 0 368.462 3.652 50 70 FHIARN O=C(N[C@@H]1[C@@H](Cc2ccccc2)[C@H]2OCC[C@@H]12)c1cccc(OC(F)F)c1 ZINC000218526343 526980196 /nfs/dbraw/zinc/98/01/96/526980196.db2.gz MQMZERGCCSFFQO-RDGPPVDQSA-N 0 0 373.399 3.664 50 70 FHIARN O=C(CSCc1ccccc1)N1CCC[C@@H](Cc2nc(C3CC3)no2)C1 ZINC000217809521 527024196 /nfs/dbraw/zinc/02/41/96/527024196.db2.gz NBWDEEFJLDFLKX-INIZCTEOSA-N 0 0 371.506 3.662 50 70 FHIARN Cc1nc([C@@H]2CCCN(C(=O)CCSCc3ccc(F)cc3)C2)no1 ZINC000218330180 527043331 /nfs/dbraw/zinc/04/33/31/527043331.db2.gz CNRGBOZCQGWLLE-OAHLLOKOSA-N 0 0 363.458 3.547 50 70 FHIARN Cc1ncsc1CCN(C)C(=O)CCc1nc2c(ccc(C)c2C)[nH]1 ZINC000217357447 527485339 /nfs/dbraw/zinc/48/53/39/527485339.db2.gz VTXCMBXSZHZBKY-UHFFFAOYSA-N 0 0 356.495 3.578 50 70 FHIARN Cc1onc(-c2ccccc2)c1C(=O)N[C@H]1[C@@H](C2CCCC2)[C@H]2OCC[C@@H]12 ZINC000218032694 568215379 /nfs/dbraw/zinc/21/53/79/568215379.db2.gz KHXDXIWVBAEPOD-QAKNJHSXSA-N 0 0 366.461 3.974 50 70 FHIARN COc1ccc(CC(=O)N[C@H](c2nc3ccccc3n2C)C(C)C)cc1 ZINC000218347488 568229517 /nfs/dbraw/zinc/22/95/17/568229517.db2.gz SCERMPJHZVJSAD-FQEVSTJZSA-N 0 0 351.450 3.638 50 70 FHIARN O=C(Nc1cnn(CC2CCOCC2)c1)Nc1ccc(C(F)(F)F)cc1 ZINC000218236941 571171488 /nfs/dbraw/zinc/17/14/88/571171488.db2.gz CPTPMEFKCZUTST-UHFFFAOYSA-N 0 0 368.359 3.973 50 70 FHIARN O=C(N[C@@H]1CCOC2(CCOCC2)C1)C(c1ccccc1)c1ccccc1 ZINC000217117411 222669570 /nfs/dbraw/zinc/66/95/70/222669570.db2.gz ACQZJSTWCSCHMQ-HXUWFJFHSA-N 0 0 365.473 3.663 50 70 FHIARN O=C(c1cccc(N2CCOCC2)c1)N1CCC[C@H]1c1ccc(F)cc1 ZINC000217832248 132272384 /nfs/dbraw/zinc/27/23/84/132272384.db2.gz HXHLKLJGCTVUGQ-FQEVSTJZSA-N 0 0 354.425 3.640 50 70 FHIARN COCCn1ccc2ccc(C(=O)NCCn3ccc4ccccc43)cc21 ZINC000218008848 522136111 /nfs/dbraw/zinc/13/61/11/522136111.db2.gz FNDHGHUWIDXPGS-UHFFFAOYSA-N 0 0 361.445 3.672 50 70 FHIARN COc1ccccc1-c1ccc(C(=O)NCCCNc2cccnc2)cc1 ZINC000218114749 524270939 /nfs/dbraw/zinc/27/09/39/524270939.db2.gz ZNKJHVDFLXISKA-UHFFFAOYSA-N 0 0 361.445 3.989 50 70 FHIARN C[C@@](O)(CNC(=O)Cc1c(F)cccc1Cl)c1cc2ccccc2o1 ZINC000217993261 525769303 /nfs/dbraw/zinc/76/93/03/525769303.db2.gz YMEFMQLARHMWPP-LJQANCHMSA-N 0 0 361.800 3.792 50 70 FHIARN O=C(NC[C@@](O)(c1ccccc1)C1CC1)c1csc(-c2ccccc2)n1 ZINC000217577103 526564478 /nfs/dbraw/zinc/56/44/78/526564478.db2.gz OAIUVAQFLPZOIN-OAQYLSRUSA-N 0 0 364.470 3.838 50 70 FHIARN O=C(CCc1ccc2c(c1)OCO2)N1CCCC[C@@H]1CCc1ccccn1 ZINC000218506245 526598063 /nfs/dbraw/zinc/59/80/63/526598063.db2.gz FAMWRWNLCALHQX-LJQANCHMSA-N 0 0 366.461 3.757 50 70 FHIARN Cc1nc([C@H]2CCCN(C(=O)CCSCc3ccc(F)cc3)C2)no1 ZINC000218330275 527074943 /nfs/dbraw/zinc/07/49/43/527074943.db2.gz CNRGBOZCQGWLLE-HNNXBMFYSA-N 0 0 363.458 3.547 50 70 FHIARN O=S(=O)(Cc1ccc(F)cc1)NCC1(c2ccsc2)CCCC1 ZINC000217483700 527191624 /nfs/dbraw/zinc/19/16/24/527191624.db2.gz SCWRQPMZLDVCTD-UHFFFAOYSA-N 0 0 353.484 3.819 50 70 FHIARN Cn1nc(CN(C(=O)NCc2cccs2)C2CCCC2)c2c1CCC2 ZINC000217911959 527553976 /nfs/dbraw/zinc/55/39/76/527553976.db2.gz BOQNJKSEWZNEFJ-UHFFFAOYSA-N 0 0 358.511 3.625 50 70 FHIARN Cc1nc([C@@H]2CCCN(C(=O)c3csc(-c4cccs4)n3)C2)no1 ZINC000217930682 568211407 /nfs/dbraw/zinc/21/14/07/568211407.db2.gz PTLHBWUNVVGERH-LLVKDONJSA-N 0 0 360.464 3.583 50 70 FHIARN COc1ccc(C2(C(=O)N[C@@H](C)c3c(C)n[nH]c3C)CCCC2)cc1OC ZINC000217995069 568213919 /nfs/dbraw/zinc/21/39/19/568213919.db2.gz KFZORPUHAOIGAW-ZDUSSCGKSA-N 0 0 371.481 3.733 50 70 FHIARN O=C(c1cnc2c(Cl)cccc2c1O)N1CCO[C@H](c2ccccc2)C1 ZINC000218416984 568232960 /nfs/dbraw/zinc/23/29/60/568232960.db2.gz OWUUORYSIRBCOU-KRWDZBQOSA-N 0 0 368.820 3.808 50 70 FHIARN COc1cc2c(c(OC)c1OC)[C@@H](c1ccc(SC)cc1)CC(=O)O2 ZINC000218057445 210174423 /nfs/dbraw/zinc/17/44/23/210174423.db2.gz RBEZBGJAUUVSFK-CYBMUJFWSA-N 0 0 360.431 3.875 50 70 FHIARN Cc1nc([C@H](C)NC(=O)Cc2c(C)nn(-c3ccccc3)c2C)c(C)s1 ZINC000218311779 222680158 /nfs/dbraw/zinc/68/01/58/222680158.db2.gz YTPRRLKGVRRQBM-ZDUSSCGKSA-N 0 0 368.506 3.982 50 70 FHIARN O=C(NCc1ccccc1OC1CCC1)Nc1ccn(CC(F)(F)F)n1 ZINC000160350348 222555502 /nfs/dbraw/zinc/55/55/02/222555502.db2.gz LMFDQLYTOZRCAC-UHFFFAOYSA-N 0 0 368.359 3.698 50 70 FHIARN C[C@@](O)(CNC(=O)c1ccccc1Br)c1cc2ccccc2o1 ZINC000217990654 525774188 /nfs/dbraw/zinc/77/41/88/525774188.db2.gz GCLYMBXKRWWSSA-GOSISDBHSA-N 0 0 374.234 3.833 50 70 FHIARN C[C@@](O)(CNS(=O)(=O)/C=C/c1ccccc1)c1cc2ccccc2s1 ZINC000217511854 525775964 /nfs/dbraw/zinc/77/59/64/525775964.db2.gz OYDBDGNHAUWUDP-TZZQJPOUSA-N 0 0 373.499 3.699 50 70 FHIARN O=C(NCc1cccnc1)c1csc(NCc2ccccc2Cl)n1 ZINC000218199839 526769782 /nfs/dbraw/zinc/76/97/82/526769782.db2.gz RRVHUFSRCZUTPV-UHFFFAOYSA-N 0 0 358.854 3.734 50 70 FHIARN O=C(C[C@H](Cn1cccc1)c1ccc(Cl)cc1)Nc1nnc(C2CC2)[nH]1 ZINC000218279285 527149014 /nfs/dbraw/zinc/14/90/14/527149014.db2.gz CJNHXXWPQPZYMT-OAHLLOKOSA-N 0 0 369.856 3.950 50 70 FHIARN O=C(NC1CCCCCCC1)c1cc(=O)c(OCc2ccccc2)c[nH]1 ZINC000218328868 527521315 /nfs/dbraw/zinc/52/13/15/527521315.db2.gz OIHRLWGJUCIYSV-UHFFFAOYSA-N 0 0 354.450 3.797 50 70 FHIARN Cc1cccc2[nH]c(COCC(=O)N3CCC[C@H]3c3ccc(F)cc3)nc21 ZINC000217164106 568155040 /nfs/dbraw/zinc/15/50/40/568155040.db2.gz NWIQIKPGFDRAPF-SFHVURJKSA-N 0 0 367.424 3.891 50 70 FHIARN Cc1ccsc1CN1CCCn2nc([C@@H](O)c3ccccc3)cc2C1 ZINC000217813512 568205089 /nfs/dbraw/zinc/20/50/89/568205089.db2.gz CYIXYNQNNBLROS-FQEVSTJZSA-N 0 0 353.491 3.741 50 70 FHIARN O=C(CC1(n2cccc2)CCOCC1)Nc1nc2c(s1)CCCCC2 ZINC000218140562 568218576 /nfs/dbraw/zinc/21/85/76/568218576.db2.gz UJUCPNMHHHGMGM-UHFFFAOYSA-N 0 0 359.495 3.748 50 70 FHIARN CC(C)c1cc([C@H]2CCCN2C(=O)c2cc(=O)c3ccccc3o2)no1 ZINC000218511493 568237372 /nfs/dbraw/zinc/23/73/72/568237372.db2.gz OGKDXARCOJKOTC-OAHLLOKOSA-N 0 0 352.390 3.882 50 70 FHIARN COc1cc2c(c(OC)c1OC)[C@@H](C1=Cc3ccccc3OC1)CC(=O)O2 ZINC000218109697 210175238 /nfs/dbraw/zinc/17/52/38/210175238.db2.gz PCDRVKVTHPHTSW-CQSZACIVSA-N 0 0 368.385 3.581 50 70 FHIARN Cc1ccccc1SC1CCN(c2cc(C3CC(O)C3)ncn2)CC1 ZINC000218662980 132273240 /nfs/dbraw/zinc/27/32/40/132273240.db2.gz FWKQGYSPRPYJQA-UHFFFAOYSA-N 0 0 355.507 3.784 50 70 FHIARN CC(C)c1cc(C(=O)N[C@@H]2CCOC[C@H]2Oc2cccc(F)c2)cs1 ZINC000218581622 519832484 /nfs/dbraw/zinc/83/24/84/519832484.db2.gz IRKLAAVYNQJIER-IAGOWNOFSA-N 0 0 363.454 3.977 50 70 FHIARN COc1ccc(-c2cc(C(=O)N3CCCC[C@H]3c3cccnc3)[nH]n2)cc1 ZINC000218105093 523093607 /nfs/dbraw/zinc/09/36/07/523093607.db2.gz UHYSZIDAWVCOLR-FQEVSTJZSA-N 0 0 362.433 3.848 50 70 FHIARN CN(Cc1ccon1)C(=O)c1cccnc1SCCc1ccccc1 ZINC000217486446 523481554 /nfs/dbraw/zinc/48/15/54/523481554.db2.gz BAXQOFAJYJYBBP-UHFFFAOYSA-N 0 0 353.447 3.677 50 70 FHIARN COc1ccccc1[C@H]1CCCN1C(=O)CCC(=O)N1CCCCCC1 ZINC000217212153 524806929 /nfs/dbraw/zinc/80/69/29/524806929.db2.gz LEVCALKBLDPPML-GOSISDBHSA-N 0 0 358.482 3.542 50 70 FHIARN Cc1cccc([C@H]2CCCN(C(=O)c3cccc(N4CCOCC4)c3)C2)c1 ZINC000218296621 524887558 /nfs/dbraw/zinc/88/75/58/524887558.db2.gz QSAJPYUAGROYOG-NRFANRHFSA-N 0 0 364.489 3.851 50 70 FHIARN CSc1ccc(/C=C/C(=O)NC[C@@](O)(c2ccccc2)C2CC2)cc1 ZINC000217579258 525948634 /nfs/dbraw/zinc/94/86/34/525948634.db2.gz IQNPZFGVQQGHSN-ZGQNHIEXSA-N 0 0 353.487 3.836 50 70 FHIARN O=C(CCc1cccc(O)c1)N1CCC[C@@H](COc2ccccc2F)C1 ZINC000217210331 526602634 /nfs/dbraw/zinc/60/26/34/526602634.db2.gz SLVNNXKJPPEOOU-QGZVFWFLSA-N 0 0 357.425 3.782 50 70 FHIARN O=C(Cc1ccccc1Cl)N1CCC[C@H](Cc2nc(C3CC3)no2)C1 ZINC000217811224 527286068 /nfs/dbraw/zinc/28/60/68/527286068.db2.gz DKUSRQGQYLUTHP-CYBMUJFWSA-N 0 0 359.857 3.624 50 70 FHIARN Cc1cc2nc(CNC(=O)CCCOCc3ccccc3)[nH]c2cc1C ZINC000217072937 568142537 /nfs/dbraw/zinc/14/25/37/568142537.db2.gz XMUDWJXUNDPUCM-UHFFFAOYSA-N 0 0 351.450 3.793 50 70 FHIARN Cc1nccn1CCC(=O)N[C@@H](c1ccncc1)c1ccc(Cl)cc1 ZINC000218007267 568214387 /nfs/dbraw/zinc/21/43/87/568214387.db2.gz YCEZHOAYGCPSEJ-LJQANCHMSA-N 0 0 354.841 3.536 50 70 FHIARN O=C(N1C[C@H]2CCC[C@@H](C1)NC2=O)C1(c2ccc(Cl)cc2)CCCCC1 ZINC000218154090 568219127 /nfs/dbraw/zinc/21/91/27/568219127.db2.gz KDJFSHDUTMARMM-QAPCUYQASA-N 0 0 374.912 3.669 50 70 FHIARN C[C@H]1CSc2ccccc2N(C(=O)c2cnc(-c3ncccn3)s2)C1 ZINC000159509253 571120837 /nfs/dbraw/zinc/12/08/37/571120837.db2.gz ATOCEAARPJIDLC-GFCCVEGCSA-N 0 0 368.487 3.989 50 70 FHIARN COc1cccc([C@@H]2SCCN2C(=O)c2ccc3nsnc3c2)c1 ZINC000217637591 571349470 /nfs/dbraw/zinc/34/94/70/571349470.db2.gz AKMURHCPJPMOBK-KRWDZBQOSA-N 0 0 357.460 3.588 50 70 FHIARN COc1ccc(C)nc1NC(=O)c1cc(C(C)C)n(-c2ccccc2)n1 ZINC000159871182 210247293 /nfs/dbraw/zinc/24/72/93/210247293.db2.gz BSDHLMBQNJBISP-UHFFFAOYSA-N 0 0 350.422 3.960 50 70 FHIARN O=C(N[C@@H]1CCOC2(CCOCC2)C1)c1ccccc1-c1ccc(F)cc1 ZINC000217039674 222669001 /nfs/dbraw/zinc/66/90/01/222669001.db2.gz YOJMDNWWHMIBEI-GOSISDBHSA-N 0 0 369.436 3.951 50 70 FHIARN Cc1ccc(N2CCN(Cc3cnc(N4CCCC4)s3)[C@@H](C)C2)cc1 ZINC000216679789 132271527 /nfs/dbraw/zinc/27/15/27/132271527.db2.gz GXJVHLZUWJPEOV-KRWDZBQOSA-N 0 0 356.539 3.762 50 70 FHIARN CC1(C)OC(=O)C[C@@H]1C(=O)NCCC(c1ccccc1)c1ccccc1 ZINC000218471314 520605913 /nfs/dbraw/zinc/60/59/13/520605913.db2.gz ZLHIJVKOADPOAN-LJQANCHMSA-N 0 0 351.446 3.667 50 70 FHIARN Cc1cc(C)n(CCC(=O)N[C@@H](c2ccc(Cl)cc2)c2cccnc2)n1 ZINC000218123181 524518734 /nfs/dbraw/zinc/51/87/34/524518734.db2.gz FIZVWGNSQQUWPZ-FQEVSTJZSA-N 0 0 368.868 3.844 50 70 FHIARN C[C@](O)(CNC(=O)c1ccccc1Br)c1cc2ccccc2o1 ZINC000217990737 525176505 /nfs/dbraw/zinc/17/65/05/525176505.db2.gz GCLYMBXKRWWSSA-SFHVURJKSA-N 0 0 374.234 3.833 50 70 FHIARN Cc1cc(-c2cccs2)nn1CCNC(=O)[C@@H](C)Oc1ccccc1 ZINC000217873303 526042922 /nfs/dbraw/zinc/04/29/22/526042922.db2.gz INWLBRXFPPAFGI-OAHLLOKOSA-N 0 0 355.463 3.504 50 70 FHIARN O=C(c1ccc(Cl)s1)N1CCC[C@@H](Cc2nc(C3CC3)no2)C1 ZINC000217813683 526683153 /nfs/dbraw/zinc/68/31/53/526683153.db2.gz JVMNAQDKGBRMKC-JTQLQIEISA-N 0 0 351.859 3.757 50 70 FHIARN O=C(c1nnc2n1CCCCC2)N1CCC[C@H](c2ccc(Cl)cc2)C1 ZINC000217186140 568158408 /nfs/dbraw/zinc/15/84/08/568158408.db2.gz CBSCJVRJCZXILP-HNNXBMFYSA-N 0 0 358.873 3.678 50 70 FHIARN O=C([C@@H]1Cc2cc(Cl)ccc2N1)N1CCC(Oc2ccccc2F)CC1 ZINC000217448929 568184502 /nfs/dbraw/zinc/18/45/02/568184502.db2.gz HVMTYHGQYNQBCZ-SFHVURJKSA-N 0 0 374.843 3.886 50 70 FHIARN Cc1nc(CN(C)C(=O)[C@@]2(C)CCc3c(C)c(O)c(C)c(C)c3O2)cs1 ZINC000217733844 568200705 /nfs/dbraw/zinc/20/07/05/568200705.db2.gz AWAPSWBMUNBFKI-HXUWFJFHSA-N 0 0 374.506 3.825 50 70 FHIARN CC1CC[NH+](Cc2ccc(C(=O)NCc3ccc4ccccc4n3)o2)CC1 ZINC000217747373 568201537 /nfs/dbraw/zinc/20/15/37/568201537.db2.gz AOGDMTMWOVIUQB-UHFFFAOYSA-N 0 0 363.461 3.990 50 70 FHIARN Cc1nnc([C@@H]2CCCN2C(=O)c2c(C)onc2-c2ccccc2Cl)[nH]1 ZINC000218392043 568231698 /nfs/dbraw/zinc/23/16/98/568231698.db2.gz XWJIEESWOJZDSY-AWEZNQCLSA-N 0 0 371.828 3.707 50 70 FHIARN COc1cc(C)sc1C(=O)N[C@@H](c1ccc(F)cc1F)[C@H]1C[C@@H](O)C1 ZINC000218607322 568242158 /nfs/dbraw/zinc/24/21/58/568242158.db2.gz XOIZQOGFXSKQPJ-NSODJVPESA-N 0 0 367.417 3.585 50 70 FHIARN O=C(CSc1ccc(F)cc1)N1CCC[C@]2(C1)OC(=O)c1ccccc12 ZINC000217564979 571348712 /nfs/dbraw/zinc/34/87/12/571348712.db2.gz JQYKLQPYSFFNCQ-HXUWFJFHSA-N 0 0 371.433 3.606 50 70 FHIARN O=C(c1ccc(F)cc1Cl)N1CCC[C@]2(C1)OC(=O)c1ccccc12 ZINC000217594876 222672444 /nfs/dbraw/zinc/67/24/44/222672444.db2.gz LLTYLOAPZRFELU-LJQANCHMSA-N 0 0 359.784 3.781 50 70 FHIARN COC(=O)C[C@H](c1ccc(OC(C)C)cc1)c1cc2c(cc1O)OCO2 ZINC000218062593 523340509 /nfs/dbraw/zinc/34/05/09/523340509.db2.gz AQMXQPTXXATXAC-OAHLLOKOSA-N 0 0 358.390 3.603 50 70 FHIARN Cc1cc(CN(C)C(=O)C(=O)c2c(-c3ccccc3)cc3ccccn32)on1 ZINC000217947707 524646943 /nfs/dbraw/zinc/64/69/43/524646943.db2.gz OQGKWUJCTRDJTG-UHFFFAOYSA-N 0 0 373.412 3.744 50 70 FHIARN C[C@@H]1CN(Cc2cc(Cl)ccc2OCCCn2ccnc2)C[C@H](C)O1 ZINC000218156128 524982922 /nfs/dbraw/zinc/98/29/22/524982922.db2.gz RLQCTMQTXFLQNQ-IYBDPMFKSA-N 0 0 363.889 3.615 50 70 FHIARN COc1cccc(CCc2ccccc2C(=O)N(C)Cc2cnccn2)c1 ZINC000218437385 525902781 /nfs/dbraw/zinc/90/27/81/525902781.db2.gz UIBKQAVUUGFLLF-UHFFFAOYSA-N 0 0 361.445 3.543 50 70 FHIARN O=C(CCSc1ccccc1)N1CC(n2cc(-c3ccccc3)nn2)C1 ZINC000217671523 526541031 /nfs/dbraw/zinc/54/10/31/526541031.db2.gz IPPYRIUUXYOMPR-UHFFFAOYSA-N 0 0 364.474 3.511 50 70 FHIARN O=C(CCc1cccnc1)N[C@H](c1ccncc1)c1ccc(Cl)cc1 ZINC000218294611 526618169 /nfs/dbraw/zinc/61/81/69/526618169.db2.gz JLKHOQLJVYJPKL-FQEVSTJZSA-N 0 0 351.837 3.968 50 70 FHIARN O=C(c1cccc(C(F)(F)F)c1)N1CC(n2cc(-c3ccccc3)nn2)C1 ZINC000217671647 526751678 /nfs/dbraw/zinc/75/16/78/526751678.db2.gz PZYCHEAWZOFTLN-UHFFFAOYSA-N 0 0 372.350 3.661 50 70 FHIARN COc1ccnc(CNC(=O)c2ccc(CSc3ccccn3)cc2)c1 ZINC000218677720 568245606 /nfs/dbraw/zinc/24/56/06/568245606.db2.gz KNZMZOPKNJUSLG-UHFFFAOYSA-N 0 0 365.458 3.708 50 70 FHIARN COc1cccc([C@@H]2CCCCN2C(=O)CCN2CCCCCC2=O)c1 ZINC000218729476 568248444 /nfs/dbraw/zinc/24/84/44/568248444.db2.gz NIZKEKQIOALNKN-IBGZPJMESA-N 0 0 358.482 3.542 50 70 FHIARN Cc1ccsc1CCC(=O)N1CCC2(CC1)OC(=O)c1ccccc12 ZINC000217523118 571348343 /nfs/dbraw/zinc/34/83/43/571348343.db2.gz XUBSAQFRPKDHAV-UHFFFAOYSA-N 0 0 355.459 3.677 50 70 FHIARN COc1cc2c(c(OC)c1OC)[C@H](c1ccc(SC)cc1)CC(=O)O2 ZINC000218057496 210175225 /nfs/dbraw/zinc/17/52/25/210175225.db2.gz RBEZBGJAUUVSFK-ZDUSSCGKSA-N 0 0 360.431 3.875 50 70 FHIARN COc1ccc(Cl)cc1C(=O)N1CCC[C@]2(C1)OC(=O)c1ccccc12 ZINC000217565389 222672665 /nfs/dbraw/zinc/67/26/65/222672665.db2.gz JMEOLJSOGZPIBU-HXUWFJFHSA-N 0 0 371.820 3.651 50 70 FHIARN O=C(c1cccc(N2CCOCC2)c1)N1CCC[C@@H]1c1ccc(F)cc1 ZINC000217832174 132272498 /nfs/dbraw/zinc/27/24/98/132272498.db2.gz HXHLKLJGCTVUGQ-HXUWFJFHSA-N 0 0 354.425 3.640 50 70 FHIARN Cc1nc(NC(=O)c2cnn(-c3cccc(Cl)c3)c2)cc(C2CC2)n1 ZINC000160063430 222555267 /nfs/dbraw/zinc/55/52/67/222555267.db2.gz YELKONHIZZPJRQ-UHFFFAOYSA-N 0 0 353.813 3.754 50 70 FHIARN COC(=O)CS[C@H]1CCN(C(=O)c2ccc(-c3ccsc3)cc2)C1 ZINC000217559139 523247632 /nfs/dbraw/zinc/24/76/32/523247632.db2.gz FBQGWJWALMTFGT-INIZCTEOSA-N 0 0 361.488 3.536 50 70 FHIARN Cc1cc(CN(C)C(=O)[C@@H](C)Sc2cc(C)c3ccccc3n2)on1 ZINC000217848485 524651251 /nfs/dbraw/zinc/65/12/51/524651251.db2.gz VVWPDRUVWUTXLW-CQSZACIVSA-N 0 0 355.463 3.979 50 70 FHIARN C[C@@](O)(CNC(=O)c1cc(-c2ccco2)on1)c1cc2ccccc2s1 ZINC000217502253 525772608 /nfs/dbraw/zinc/77/26/08/525772608.db2.gz DQZMISPVUVEQJA-LJQANCHMSA-N 0 0 368.414 3.787 50 70 FHIARN CSc1ccc(CC(=O)NCc2ccc(-c3noc(C)n3)cc2)cc1 ZINC000218438523 525983435 /nfs/dbraw/zinc/98/34/35/525983435.db2.gz YRLCXBHYYFHKMS-UHFFFAOYSA-N 0 0 353.447 3.626 50 70 FHIARN O=C(NCCCc1ncc[nH]1)c1ccc(-c2cn(-c3ccccc3)cn2)cc1 ZINC000218508431 526282174 /nfs/dbraw/zinc/28/21/74/526282174.db2.gz UGEZEFCLNVDJCW-UHFFFAOYSA-N 0 0 371.444 3.625 50 70 FHIARN O[C@H](c1ccccc1)[C@@H](Nc1cc(C2CC(O)C2)ncn1)c1ccccc1 ZINC000218496020 526301323 /nfs/dbraw/zinc/30/13/23/526301323.db2.gz XUIKRMUZAZQEGK-GHZCZGOHSA-N 0 0 361.445 3.602 50 70 FHIARN O=C(NCCSC1CCOCC1)NC(c1ccccc1)c1ccccc1 ZINC000217708083 526371024 /nfs/dbraw/zinc/37/10/24/526371024.db2.gz CRVOEEMTKXCRRT-UHFFFAOYSA-N 0 0 370.518 3.987 50 70 FHIARN O=C(c1c(F)cccc1Cl)N1CCC[C@H](Cc2nc(C3CC3)no2)C1 ZINC000217808458 526576324 /nfs/dbraw/zinc/57/63/24/526576324.db2.gz FTKUCZSWEUQRJM-LLVKDONJSA-N 0 0 363.820 3.834 50 70 FHIARN Cc1nc(C2CCN(C(=O)CSCc3ccccc3Cl)CC2)no1 ZINC000218445538 526775456 /nfs/dbraw/zinc/77/54/56/526775456.db2.gz LFVLYNHGCRUBBU-UHFFFAOYSA-N 0 0 365.886 3.671 50 70 FHIARN O=C(N[C@H]1CCOC2(CCOCC2)C1)C(c1ccccc1)c1ccccc1 ZINC000217117427 568147917 /nfs/dbraw/zinc/14/79/17/568147917.db2.gz ACQZJSTWCSCHMQ-FQEVSTJZSA-N 0 0 365.473 3.663 50 70 FHIARN COc1cccc2c1OCCCN(C(=O)c1ccc(N3CCCC3)cc1)C2 ZINC000216933907 568156565 /nfs/dbraw/zinc/15/65/65/568156565.db2.gz JKCJNHDXQDSHCV-UHFFFAOYSA-N 0 0 366.461 3.720 50 70 FHIARN CN(Cc1cnccn1)C(=O)c1ccc(C(F)(F)F)cc1C(F)(F)F ZINC000217706545 568199490 /nfs/dbraw/zinc/19/94/90/568199490.db2.gz AQHJHOJQLINEII-UHFFFAOYSA-N 0 0 363.261 3.786 50 70 FHIARN CC(C)[C@H](NC(=O)c1cc(=O)[nH]c2ccccc21)c1nc2ccccc2n1C ZINC000218156194 568219213 /nfs/dbraw/zinc/21/92/13/568219213.db2.gz BDCVQKCSLRMRMH-FQEVSTJZSA-N 0 0 374.444 3.542 50 70 FHIARN CCn1ncc(C(=O)O[C@@H](C)c2ccc3c(c2)OCCO3)c1C(F)(F)F ZINC000159945821 571164811 /nfs/dbraw/zinc/16/48/11/571164811.db2.gz NXZCNPBKPNFTTB-JTQLQIEISA-N 0 0 370.327 3.611 50 70 FHIARN O=C(c1cnc2cc(Cl)ccc2c1O)N1CCO[C@H](c2ccccc2)C1 ZINC000218127115 571352498 /nfs/dbraw/zinc/35/24/98/571352498.db2.gz FTLTVZHHUVEAHY-SFHVURJKSA-N 0 0 368.820 3.808 50 70 FHIARN O=C(N[C@H]1CCOC[C@H]1C1CCOCC1)c1ccccc1-c1ccccc1 ZINC000218297222 222680190 /nfs/dbraw/zinc/68/01/90/222680190.db2.gz KSNCIGJVNIGXKK-VXKWHMMOSA-N 0 0 365.473 3.915 50 70 FHIARN CC(C)[C@H](NC(=O)Cc1ccc2c(c1)OCC2)c1nc2ccccc2n1C ZINC000218264186 222680415 /nfs/dbraw/zinc/68/04/15/222680415.db2.gz WUJBHCGUCYKJTB-NRFANRHFSA-N 0 0 363.461 3.564 50 70 FHIARN O=C(NCc1cccnc1)c1sc(Br)nc1-c1ccccc1 ZINC000218556502 222683427 /nfs/dbraw/zinc/68/34/27/222683427.db2.gz PEXJIUGNJANDEB-UHFFFAOYSA-N 0 0 374.263 3.898 50 70 FHIARN O=C(NCCc1ccccn1)c1cc(Br)ccc1-n1cccc1 ZINC000218222699 526435182 /nfs/dbraw/zinc/43/51/82/526435182.db2.gz FDIWTPDFVAMHHB-UHFFFAOYSA-N 0 0 370.250 3.607 50 70 FHIARN O=C(c1cc(=O)c(OCc2cccc(Cl)c2)c[nH]1)N1CCCCCC1 ZINC000218362754 526599981 /nfs/dbraw/zinc/59/99/81/526599981.db2.gz BGOGKDOUQGUUML-UHFFFAOYSA-N 0 0 360.841 3.624 50 70 FHIARN O=C(CCc1cccc(O)c1)N1CCC[C@H](COc2ccccc2F)C1 ZINC000217210339 526603083 /nfs/dbraw/zinc/60/30/83/526603083.db2.gz SLVNNXKJPPEOOU-KRWDZBQOSA-N 0 0 357.425 3.782 50 70 FHIARN Cc1nc(NCCc2cccc(C(F)(F)F)c2)cc(C2CC(O)C2)n1 ZINC000218323956 526997304 /nfs/dbraw/zinc/99/73/04/526997304.db2.gz RUKPFGMINOXOSJ-UHFFFAOYSA-N 0 0 351.372 3.697 50 70 FHIARN Cn1nc(CN(Cc2ccco2)C(=O)Cc2cccs2)cc1C1CC1 ZINC000217894865 527554488 /nfs/dbraw/zinc/55/44/88/527554488.db2.gz SUWSZPIKPIGDJN-UHFFFAOYSA-N 0 0 355.463 3.724 50 70 FHIARN O=C1C[C@@H](c2ccc(OC(F)(F)F)cc2)c2cc3c(cc2O1)OCO3 ZINC000218316362 568227899 /nfs/dbraw/zinc/22/78/99/568227899.db2.gz GNWKEFBQNQDISG-NSHDSACASA-N 0 0 352.264 3.755 50 70 FHIARN Cc1nc(-c2cccc(F)c2)sc1C(=O)Nc1nnc(CC(C)C)[nH]1 ZINC000218563026 568240076 /nfs/dbraw/zinc/24/00/76/568240076.db2.gz QDBRNTKVXJXTFO-UHFFFAOYSA-N 0 0 359.430 3.827 50 70 FHIARN COc1cccc(SCC(=O)NCCc2nc3cc(C)c(C)cc3[nH]2)c1 ZINC000218765375 568250648 /nfs/dbraw/zinc/25/06/48/568250648.db2.gz PJMCYCGPEKUNHR-UHFFFAOYSA-N 0 0 369.490 3.639 50 70 FHIARN O=C(CSc1ccc(F)cc1)N1CCC2(CC1)OC(=O)c1ccccc12 ZINC000217516135 571348308 /nfs/dbraw/zinc/34/83/08/571348308.db2.gz DHXBMICDCNADQH-UHFFFAOYSA-N 0 0 371.433 3.606 50 70 FHIARN O=C(NC[C@@](O)(c1ccccc1)C1CC1)c1cc(Br)cs1 ZINC000217578171 571348939 /nfs/dbraw/zinc/34/89/39/571348939.db2.gz QFNRVIUYTIQWOM-MRXNPFEDSA-N 0 0 366.280 3.538 50 70 FHIARN O=C(Nc1cnn(CC2CCOCC2)c1)c1cc(-c2ccc(F)cc2)c[nH]1 ZINC000218225880 571352922 /nfs/dbraw/zinc/35/29/22/571352922.db2.gz DOXMXOGSUARSDH-UHFFFAOYSA-N 0 0 368.412 3.696 50 70 FHIARN O=C(CCSc1ccccc1)N1CCC[C@@]2(C1)OC(=O)c1ccccc12 ZINC000217564873 222672460 /nfs/dbraw/zinc/67/24/60/222672460.db2.gz UBGKOSZLEHQLKJ-NRFANRHFSA-N 0 0 367.470 3.857 50 70 FHIARN O=C(c1ccc(N2CCCC2)cc1)N(Cc1ccccn1)C[C@H]1CCCO1 ZINC000218594677 222683735 /nfs/dbraw/zinc/68/37/35/222683735.db2.gz CRFLBQHMNCLVBT-OAQYLSRUSA-N 0 0 365.477 3.503 50 70 FHIARN Cc1cc([C@H]2C[C@H]3CC[C@@H](C2)N3C(=O)CCc2ccnn2C)ccc1F ZINC000217188313 568158652 /nfs/dbraw/zinc/15/86/52/568158652.db2.gz HWJZFKHIJDYJSY-GGPHIMKMSA-N 0 0 355.457 3.737 50 70 FHIARN CC(=O)c1ccccc1C(=O)N[C@@H](c1cnc2ccccc2c1)C1CC(O)C1 ZINC000218030257 568215359 /nfs/dbraw/zinc/21/53/59/568215359.db2.gz MPBNLDDAYOSOAR-CWZMJNCASA-N 0 0 374.440 3.679 50 70 FHIARN Cc1cccc2c1ccn2CCNC(=O)C1(c2ccccc2)CCOCC1 ZINC000218564320 568240179 /nfs/dbraw/zinc/24/01/79/568240179.db2.gz WGIPCHUHYZVHFE-UHFFFAOYSA-N 0 0 362.473 3.814 50 70 FHIARN COc1ccccc1N1CC[C@@H](Sc2nncc3ccccc32)C1=O ZINC000160256217 571113742 /nfs/dbraw/zinc/11/37/42/571113742.db2.gz PTQACSNZFDDLGC-QGZVFWFLSA-N 0 0 351.431 3.536 50 70 FHIARN O=C(NCc1cccc2ccccc21)Nc1cnn(CC2CCOCC2)c1 ZINC000218236747 571171504 /nfs/dbraw/zinc/17/15/04/571171504.db2.gz XCLZXXDAWLDZKF-UHFFFAOYSA-N 0 0 364.449 3.785 50 70 FHIARN Cc1cc(=O)oc2c1ccc1c2[C@H](c2coc3ccccc3c2=O)CC(=O)O1 ZINC000217591724 571348966 /nfs/dbraw/zinc/34/89/66/571348966.db2.gz WSECUAKZZZAVET-AWEZNQCLSA-N 0 0 374.348 3.649 50 70 FHIARN O=C(c1ccc(F)cc1Cl)N1CCC[C@@]2(C1)OC(=O)c1ccccc12 ZINC000217594948 571349033 /nfs/dbraw/zinc/34/90/33/571349033.db2.gz LLTYLOAPZRFELU-IBGZPJMESA-N 0 0 359.784 3.781 50 70 FHIARN CC[C@H](C)[C@H](NC(=O)Cc1ccc2c(c1)OCC2)c1nc2ccccc2[nH]1 ZINC000217775891 571350622 /nfs/dbraw/zinc/35/06/22/571350622.db2.gz RYAGXBXIBXSFJR-QKKBWIMNSA-N 0 0 363.461 3.944 50 70 FHIARN COc1ccc2c(c1)CCC[C@@]2(O)CNC(=O)c1cccc2ccccc21 ZINC000218007314 571351962 /nfs/dbraw/zinc/35/19/62/571351962.db2.gz IVDOVSGMMSXHIA-HSZRJFAPSA-N 0 0 361.441 3.802 50 70 FHIARN CC(=O)c1ccc2c(c1O)[C@@H](c1ccc(OC(F)(F)F)cc1)CC(=O)O2 ZINC000218427645 571353771 /nfs/dbraw/zinc/35/37/71/571353771.db2.gz LLYPFGDLFYQODW-CYBMUJFWSA-N 0 0 366.291 3.934 50 70 FHIARN O=C(c1ccc(N2CCCC2)cc1)N(Cc1ccccn1)C[C@@H]1CCCO1 ZINC000218594624 222683831 /nfs/dbraw/zinc/68/38/31/222683831.db2.gz CRFLBQHMNCLVBT-NRFANRHFSA-N 0 0 365.477 3.503 50 70 FHIARN COc1ccccc1-c1ccc(C(=O)N(C)CCCc2nccn2C)cc1 ZINC000218526247 524270263 /nfs/dbraw/zinc/27/02/63/524270263.db2.gz XTVDLYHEPNMZEU-UHFFFAOYSA-N 0 0 363.461 3.801 50 70 FHIARN O=C(CCc1ccc2c(c1)OCO2)N1CCCC[C@H]1CCc1ccccn1 ZINC000218506339 526598181 /nfs/dbraw/zinc/59/81/81/526598181.db2.gz FAMWRWNLCALHQX-IBGZPJMESA-N 0 0 366.461 3.757 50 70 FHIARN CC[C@H](C)[C@H](NC(=O)c1c[nH]c(=O)c2ccccc12)c1nc2ccccc2[nH]1 ZINC000218229856 568223250 /nfs/dbraw/zinc/22/32/50/568223250.db2.gz VWRRLQXNNDWGFI-DJJJIMSYSA-N 0 0 374.444 3.922 50 70 FHIARN COc1ccc(N(C)C(=O)c2nc(-c3cccc(Cl)c3)[nH]c2C)cn1 ZINC000160443784 571160293 /nfs/dbraw/zinc/16/02/93/571160293.db2.gz JHJPYOMXPXHMDT-UHFFFAOYSA-N 0 0 356.813 3.719 50 70 FHIARN CCn1ncc(C(=O)O[C@H](C)c2ccc3c(c2)OCCO3)c1C(F)(F)F ZINC000159945931 571164805 /nfs/dbraw/zinc/16/48/05/571164805.db2.gz NXZCNPBKPNFTTB-SNVBAGLBSA-N 0 0 370.327 3.611 50 70 FHIARN C[C@](O)(CNC(=O)c1nc2ccccc2s1)c1cc2ccccc2o1 ZINC000217988681 222676073 /nfs/dbraw/zinc/67/60/73/222676073.db2.gz ZKEHBDUWOWSUQQ-IBGZPJMESA-N 0 0 352.415 3.680 50 70 FHIARN COc1ccc(C(=O)Nc2ccc3ncn(CCC(C)C)c(=O)c3c2)cc1 ZINC000218434862 222681171 /nfs/dbraw/zinc/68/11/71/222681171.db2.gz NGZCCZLNZXIVMD-UHFFFAOYSA-N 0 0 365.433 3.704 50 70 FHIARN O=C(CCc1cccnc1)N[C@@H](c1ccncc1)c1ccc(Cl)cc1 ZINC000218294560 526618202 /nfs/dbraw/zinc/61/82/02/526618202.db2.gz JLKHOQLJVYJPKL-HXUWFJFHSA-N 0 0 351.837 3.968 50 70 FHIARN Cn1nc(CN(C(=O)COc2ccc(F)cc2)C2CCCC2)cc1C1CC1 ZINC000217899104 527554083 /nfs/dbraw/zinc/55/40/83/527554083.db2.gz JRGWSNRTHWLKCP-UHFFFAOYSA-N 0 0 371.456 3.787 50 70 FHIARN O=C(Nc1n[nH]c2cc(Br)ccc21)c1n[nH]c2c1CCCCC2 ZINC000218535348 568238519 /nfs/dbraw/zinc/23/85/19/568238519.db2.gz KLCQQWNEZKXLNY-UHFFFAOYSA-N 0 0 374.242 3.570 50 70 FHIARN O=C(CN1CCO[C@@]2(CCc3ccccc32)C1)Nc1cc(Cl)ccc1F ZINC000159605492 571140058 /nfs/dbraw/zinc/14/00/58/571140058.db2.gz CRKGUTUYDMSDAX-FQEVSTJZSA-N 0 0 374.843 3.592 50 70 FHIARN O=C(CCSc1ccccc1)N1CCC[C@]2(C1)OC(=O)c1ccccc12 ZINC000217564790 571348764 /nfs/dbraw/zinc/34/87/64/571348764.db2.gz UBGKOSZLEHQLKJ-OAQYLSRUSA-N 0 0 367.470 3.857 50 70 FHIARN C[C@](O)(CNC(=O)CCc1ccccc1F)c1cc2ccccc2s1 ZINC000217508284 525171229 /nfs/dbraw/zinc/17/12/29/525171229.db2.gz WOOQTSKKTGESLT-FQEVSTJZSA-N 0 0 357.450 3.997 50 70 FHIARN C[C@](O)(CNS(=O)(=O)/C=C/c1ccccc1)c1cc2ccccc2s1 ZINC000217511954 525178549 /nfs/dbraw/zinc/17/85/49/525178549.db2.gz OYDBDGNHAUWUDP-CVTTXWKISA-N 0 0 373.499 3.699 50 70 FHIARN Cc1ccc2[nH]c(CCCNC(=O)Cc3ccc(N(C)C)cc3)nc2c1C ZINC000218012006 526097612 /nfs/dbraw/zinc/09/76/12/526097612.db2.gz GLONWXIPBCPHII-UHFFFAOYSA-N 0 0 364.493 3.537 50 70 FHIARN O=C(NC1CCCCCC1)c1cc(=O)c(OCc2ccccc2F)co1 ZINC000218348075 527518989 /nfs/dbraw/zinc/51/89/89/527518989.db2.gz KQTJUGURDJPQQF-UHFFFAOYSA-N 0 0 359.397 3.811 50 70 FHIARN Cc1nc([C@H]2CCCN(C(=O)c3csc(-c4cccs4)n3)C2)no1 ZINC000217930782 568211463 /nfs/dbraw/zinc/21/14/63/568211463.db2.gz PTLHBWUNVVGERH-NSHDSACASA-N 0 0 360.464 3.583 50 70 FHIARN Cc1nccn1CCC(=O)N[C@H](c1ccncc1)c1ccc(Cl)cc1 ZINC000218007349 568214342 /nfs/dbraw/zinc/21/43/42/568214342.db2.gz YCEZHOAYGCPSEJ-IBGZPJMESA-N 0 0 354.841 3.536 50 70 FHIARN O=C(N1CCO[C@H](c2cccnc2)C1)C1(c2ccc(Cl)cc2)CCC1 ZINC000218239852 568223890 /nfs/dbraw/zinc/22/38/90/568223890.db2.gz CTXKJFUFULKYAY-SFHVURJKSA-N 0 0 356.853 3.757 50 70 FHIARN CC(C)[C@H](NC(=O)c1cc(-c2ccco2)n[nH]1)c1nc2ccccc2n1C ZINC000218424561 568233344 /nfs/dbraw/zinc/23/33/44/568233344.db2.gz JWYZBEAZFAODNB-SFHVURJKSA-N 0 0 363.421 3.684 50 70 FHIARN COc1cc(C)sc1C(=O)N[C@H](c1ccc(F)cc1F)[C@H]1C[C@@H](O)C1 ZINC000218607386 568242134 /nfs/dbraw/zinc/24/21/34/568242134.db2.gz XOIZQOGFXSKQPJ-PKWAYOAASA-N 0 0 367.417 3.585 50 70 FHIARN C[C@@H]1CSc2ccccc2N(C(=O)c2cnc(-c3ncccn3)s2)C1 ZINC000159509392 571120838 /nfs/dbraw/zinc/12/08/38/571120838.db2.gz ATOCEAARPJIDLC-LBPRGKRZSA-N 0 0 368.487 3.989 50 70 FHIARN COc1cccc([C@@H]2SCCN2C(=O)Nc2ccc3c(c2)OCO3)c1 ZINC000217640187 571349463 /nfs/dbraw/zinc/34/94/63/571349463.db2.gz OVSBFBMFLFYKBB-KRWDZBQOSA-N 0 0 358.419 3.703 50 70 FHIARN O=C(c1ccc(N2CCCC2)cc1)N1CCCN(c2ccc(F)cc2)CC1 ZINC000218011475 222676382 /nfs/dbraw/zinc/67/63/82/222676382.db2.gz JHHIXTLVODJLNL-UHFFFAOYSA-N 0 0 367.468 3.778 50 70 FHIARN CCc1c(C(=O)N(C)c2ccc(OC)c(F)c2)cnn1-c1ccc(F)cc1 ZINC000159635900 222553955 /nfs/dbraw/zinc/55/39/55/222553955.db2.gz RMQAXGSTRPFPAX-UHFFFAOYSA-N 0 0 371.387 3.998 50 70 FHIARN CC(C)C[C@H](NC(=O)c1cc(-c2cccnc2)n[nH]1)c1nc2ccccc2[nH]1 ZINC000218249303 519391412 /nfs/dbraw/zinc/39/14/12/519391412.db2.gz BQUHBCKVKMWDRA-SFHVURJKSA-N 0 0 374.448 3.865 50 70 FHIARN COc1ccc(CCC(=O)NC[C@@](C)(O)c2cc3ccccc3s2)cc1 ZINC000217502978 523923593 /nfs/dbraw/zinc/92/35/93/523923593.db2.gz BZVFCSCDHHDXAZ-OAQYLSRUSA-N 0 0 369.486 3.866 50 70 FHIARN C[C@](O)(CNC(=O)CSc1ccc(F)cc1)c1cc2ccccc2o1 ZINC000217989403 525171343 /nfs/dbraw/zinc/17/13/43/525171343.db2.gz ACJRRGXEWOXNED-IBGZPJMESA-N 0 0 359.422 3.688 50 70 FHIARN O=C(CCSc1ccccc1)NCCn1ccc(-c2ccsc2)n1 ZINC000217887390 526542716 /nfs/dbraw/zinc/54/27/16/526542716.db2.gz AYXPGRBIDOMYKS-UHFFFAOYSA-N 0 0 357.504 3.910 50 70 FHIARN CC(C)C[C@H](NC(=O)c1cc(-c2ccccn2)n[nH]1)c1nc2ccccc2[nH]1 ZINC000218253972 568224566 /nfs/dbraw/zinc/22/45/66/568224566.db2.gz LGZIQCNSXQCSNN-SFHVURJKSA-N 0 0 374.448 3.865 50 70 FHIARN COc1cc2c(c(OC)c1OC)[C@H](c1ccc(F)cc1Cl)CC(=O)O2 ZINC000218544553 568238890 /nfs/dbraw/zinc/23/88/90/568238890.db2.gz YXEBDQYLOZWDIF-NSHDSACASA-N 0 0 366.772 3.946 50 70 FHIARN COc1cccc(-c2ccc(C(=O)NCCCc3csc(N)n3)cc2)c1 ZINC000218685874 568246051 /nfs/dbraw/zinc/24/60/51/568246051.db2.gz AXBXSGKYGYKEKK-UHFFFAOYSA-N 0 0 367.474 3.764 50 70 FHIARN CC1=C(c2ccccc2)[C@@H]1C(=O)NCCc1nc(C)cc(C(F)(F)F)n1 ZINC000218744197 568249472 /nfs/dbraw/zinc/24/94/72/568249472.db2.gz AUJABLLNWIKAKL-QGZVFWFLSA-N 0 0 361.367 3.566 50 70 FHIARN Cc1cn2c(CCC(=O)Nc3cc(C(F)(F)F)ccc3O)csc2n1 ZINC000159669592 571141654 /nfs/dbraw/zinc/14/16/54/571141654.db2.gz TUHQEWMQDMQJMR-UHFFFAOYSA-N 0 0 369.368 4.000 50 70 FHIARN O=C(Nc1ccc(C(F)(F)F)cc1)N[C@H]1CCN(c2ccccn2)C1 ZINC000159936238 571163915 /nfs/dbraw/zinc/16/39/15/571163915.db2.gz MLBYHMPRXCAMHH-AWEZNQCLSA-N 0 0 350.344 3.501 50 70 FHIARN COc1cc2c(c(OC)c1OC)[C@@H](c1ccc3ncccc3c1)CC(=O)O2 ZINC000218061429 222677714 /nfs/dbraw/zinc/67/77/14/222677714.db2.gz CRIHIVVYGRKVIB-CQSZACIVSA-N 0 0 365.385 3.702 50 70 FHIARN COc1cc2c(c(OC)c1OC)[C@@H](c1ccc(F)cc1Cl)CC(=O)O2 ZINC000218544471 222684350 /nfs/dbraw/zinc/68/43/50/222684350.db2.gz YXEBDQYLOZWDIF-LLVKDONJSA-N 0 0 366.772 3.946 50 70 FHIARN COc1ccccc1C1CCN(C(=O)c2ccc(SCCO)cc2)CC1 ZINC000218681514 222686787 /nfs/dbraw/zinc/68/67/87/222686787.db2.gz ASWRLMFTWPVIMT-UHFFFAOYSA-N 0 0 371.502 3.799 50 70 FHIARN CC[C@@H](C)[C@@H](CO)NC(=O)c1c[nH]nc1-c1ccc(Cl)cc1Cl ZINC000218208506 522300633 /nfs/dbraw/zinc/30/06/33/522300633.db2.gz UMFHBWPJSNOYRN-YMTOWFKASA-N 0 0 356.253 3.520 50 70 FHIARN COc1ccc(CCC(=O)NC[C@](C)(O)c2cc3ccccc3s2)cc1 ZINC000217503066 523923724 /nfs/dbraw/zinc/92/37/24/523923724.db2.gz BZVFCSCDHHDXAZ-NRFANRHFSA-N 0 0 369.486 3.866 50 70 FHIARN COc1cccc2c1ccn2CCNC(=O)Cc1cn(C)c2ccccc12 ZINC000217925467 524253265 /nfs/dbraw/zinc/25/32/65/524253265.db2.gz IJCOKZSELYONAS-UHFFFAOYSA-N 0 0 361.445 3.501 50 70 FHIARN Cc1cc(CN(C)C(=O)[C@H](C)Sc2cc(C)c3ccccc3n2)on1 ZINC000217848563 524653706 /nfs/dbraw/zinc/65/37/06/524653706.db2.gz VVWPDRUVWUTXLW-AWEZNQCLSA-N 0 0 355.463 3.979 50 70 FHIARN COc1cccc(NC(=O)NCCn2nc(-c3cccs3)cc2C)c1 ZINC000217875761 526191027 /nfs/dbraw/zinc/19/10/27/526191027.db2.gz YOHNBEARAMBISJ-UHFFFAOYSA-N 0 0 356.451 3.750 50 70 FHIARN O=C(c1nc2ccccc2s1)N1CCC[C@@]2(C1)OC(=O)c1ccccc12 ZINC000217561999 571348715 /nfs/dbraw/zinc/34/87/15/571348715.db2.gz FRZIWOSXMFCTJI-FQEVSTJZSA-N 0 0 364.426 3.598 50 70 FHIARN O=C(Nc1cnn(CC2CCOCC2)c1)c1csc(-c2ccccc2)n1 ZINC000218196823 571352722 /nfs/dbraw/zinc/35/27/22/571352722.db2.gz RSNVSKIUESIKEW-UHFFFAOYSA-N 0 0 368.462 3.686 50 70 FHIARN CC(C)[C@H](NC(=O)c1c[nH]c(=O)c2ccccc12)c1nc2ccccc2n1C ZINC000218185241 222679105 /nfs/dbraw/zinc/67/91/05/222679105.db2.gz AXFJEYOTRPTUEL-IBGZPJMESA-N 0 0 374.444 3.542 50 70 FHIARN C[C@](O)(CNC(=O)Cc1c(F)cccc1Cl)c1cc2ccccc2o1 ZINC000217993327 525170014 /nfs/dbraw/zinc/17/00/14/525170014.db2.gz YMEFMQLARHMWPP-IBGZPJMESA-N 0 0 361.800 3.792 50 70 FHIARN O=C(c1c(F)cccc1Cl)N1CCC[C@@H](Cc2nc(C3CC3)no2)C1 ZINC000217808535 526576093 /nfs/dbraw/zinc/57/60/93/526576093.db2.gz FTKUCZSWEUQRJM-NSHDSACASA-N 0 0 363.820 3.834 50 70 FHIARN O=C(Cc1ccc(F)c(F)c1)NC[C@@H](c1ccccc1)[NH+]1CCCCC1 ZINC000217075190 568142855 /nfs/dbraw/zinc/14/28/55/568142855.db2.gz ANJMYRZWRXQDNH-FQEVSTJZSA-N 0 0 358.432 3.851 50 70 FHIARN O=C(c1cnc(-c2cccs2)nc1)N1CCCC[C@H]1c1ccccn1 ZINC000218343941 568229410 /nfs/dbraw/zinc/22/94/10/568229410.db2.gz XZDMOUOCWYJREJ-INIZCTEOSA-N 0 0 350.447 3.968 50 70 FHIARN Cc1nc(C(=O)NCCc2nc3ccccc3[nH]2)c(-c2ccccc2)s1 ZINC000218605788 568242098 /nfs/dbraw/zinc/24/20/98/568242098.db2.gz KTKHZHOPALGBDV-UHFFFAOYSA-N 0 0 362.458 3.967 50 70 FHIARN COC(=O)C[C@@H](c1ccc(OC)c2ccccc21)c1c(O)cc(C)oc1=O ZINC000218025104 571189527 /nfs/dbraw/zinc/18/95/27/571189527.db2.gz KPHATRVHXADABG-INIZCTEOSA-N 0 0 368.385 3.511 50 70 FHIARN COc1ccc([C@@H]2CC(=O)Oc3ccc4c(c32)OC(C)(C)CC4=O)cc1 ZINC000217609078 571349223 /nfs/dbraw/zinc/34/92/23/571349223.db2.gz STECWHGPRFVUOV-HNNXBMFYSA-N 0 0 352.386 3.880 50 70 FHIARN